0 B6R0.2 C=C(Br)CC(N)=O Amb25174913 [0,0,0,0,0,0|2,0,2]=4 1 B6R0.2 C=C(Br)CC(O)=O Amb24479176 [0,0,0,0,0,0|1,0,2]=3 2 B6R0.2 C=C(Cl)CC(N)=O Amb24376175 [0,0,0,0,0,0|2,0,2]=4 3 B6R0.2 CC(=C)CC(=O)C Amb17593075 [0,0,0,0,0,0|1,0,2]=3 4 B6R0.2 CC(=C)CC(Cl)Cl Amb24429119 [0,0,0,0,0,0|4,0,0]=4 5 B6R0.2 CC(=C)CN(C)C Amb25747292 [0,0,0,0,0,0|3,0,0]=3 6 B6R0.2 CC(=CC(=O)N)C Amb10561758 [0,0,0,0,0,0|1,0,2]=3 7 B6R0.2 CC(=CC(=O)O)C Amb1485519 [0,0,0,0,0,0|0,0,2]=2 8 B6R0.2 CC(=N)CC(N)=O Amb25259783 [0,0,0,0,0,0|2,0,1]=3 9 B6R0.2 CC(=O)C=S(C)C Amb25370005 [0,0,0,0,0,0|2,0,1]=3 10 B6R0.2 CC(=O)CC(=C)Br Amb25662372 [0,0,0,0,0,0|2,0,2]=4 11 B6R0.2 CC(=O)CC(=O)Br Amb24422459 [0,0,0,0,0,0|2,0,1]=3 12 B6R0.2 CC(=O)CC(C)=N Amb22345922 [0,0,0,0,0,0|2,0,1]=3 13 B6R0.2 CC(=O)CC(C)=O Amb22727963 [0,0,0,0,0,0|2,0,1]=3 14 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [0,0,0,0,0,0|2,0,0]=2 15 B6R0.2 CC(=O)CC(C)[O-] Amb22729909 [0,0,0,0,0,0|2,0,0]=2 16 B6R0.2 CC(=O)CC(Cl)Cl Amb24476084 [0,0,0,0,0,0|3,0,0]=3 17 B6R0.2 CC(=O)CC(F)F Amb24669174 [0,0,0,0,0,0|3,0,0]=3 18 B6R0.2 CC(=O)CC(N)=S Amb24102403 [0,0,0,0,0,0|2,1,1]=4 19 B6R0.2 CC(=O)CC(O)=O Amb22348460 [0,0,0,0,0,0|1,0,1]=2 20 B6R0.2 CC(=O)CC(O)=S Amb24689856 [0,0,0,0,0,0|1,1,1]=3 21 B6R0.2 CC(=O)CC(O)O Amb25273111 [0,0,0,0,0,0|3,0,0]=3 22 B6R0.2 CC(=O)CC([O-])=O Amb22265051 [0,0,0,0,0,0|1,0,2]=3 23 B6R0.2 CC(=O)CP(Cl)Cl Amb25319017 [0,0,0,0,0,0|4,0,0]=4 24 B6R0.2 CC(=O)CS(C)=O Amb25025354 [0,0,0,0,0,0|3,0,0]=3 25 B6R0.2 CC(=O)C[N+]([O-])=O Amb18833135 [0,0,0,0,0,0|2,0,2]=4 26 B6R0.2 CC(=O)C[S+](C)C Amb24614662 [0,0,0,0,0,0|2,0,0]=2 27 B6R0.2 CC(=O)NN(C)C Amb25064806 [0,0,0,0,0,0|3,0,0]=3 28 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22045487 [0,0,0,0,0,0|2,0,2]=4 29 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22053694 [0,0,0,0,0,0|2,0,2]=4 30 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22054021 [0,0,0,0,0,0|2,0,2]=4 31 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22730050 [0,0,0,0,0,0|2,0,2]=4 32 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22730391 [0,0,0,0,0,0|2,0,2]=4 33 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22733055 [0,0,0,0,0,0|2,0,2]=4 34 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22734591 [0,0,0,0,0,0|2,0,2]=4 35 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22734615 [0,0,0,0,0,0|2,0,2]=4 36 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22734932 [0,0,0,0,0,0|2,0,2]=4 37 B6R0.2 CC(=S)C=C(C)O Amb24518407 [0,0,0,0,0,0|2,0,2]=4 38 B6R0.2 CC(=S)CC(N)=O Amb24479846 [0,0,0,0,0,0|2,0,1]=3 39 B6R0.2 CC(Br)=CC(O)=O Amb25347173 [0,0,0,0,0,0|1,0,2]=3 40 B6R0.2 CC(Br)C=C(C)C Amb25745333 [0,0,0,0,0,0|3,0,1]=4 41 B6R0.2 CC(Br)CC(C)=C Amb24365286 [0,0,0,0,0,0|3,0,0]=3 42 B6R0.2 CC(Br)CC(C)Br Amb22524372 [0,0,0,0,0,0|3,0,1]=4 43 B6R0.2 CC(Br)CC(C)N Amb25186933 [0,0,0,0,0,0|3,0,1]=4 44 B6R0.2 CC(Br)CC(C)O Amb25139315 [0,0,0,0,0,0|2,0,1]=3 45 B6R0.2 CC(Br)CC(N)=N Amb25700372 [0,0,0,0,0,0|3,0,0]=3 46 B6R0.2 CC(Br)CC(N)=O Amb24635749 [0,0,0,0,0,0|2,0,0]=2 47 B6R0.2 CC(Br)OC(C)=O Amb19958925 [0,0,0,0,0,0|3,0,0]=3 48 B6R0.2 CC(C)=C=C(C)C Amb17670588 [0,0,0,0,0,0|2,0,2]=4 49 B6R0.2 CC(C)=CC(N)=N Amb24677991 [0,0,0,0,0,0|2,0,2]=4 50 B6R0.2 CC(C)=CC(N)=S Amb18108367 [0,0,0,0,0,0|1,1,2]=4 51 B6R0.2 CC(C)=C[N+]([O-])=O Amb22167019 [0,0,0,0,0,0|1,0,3]=4 52 B6R0.2 CC(C)=NC(N)=O Amb24682478 [0,0,0,0,0,0|2,0,1]=3 53 B6R0.2 CC(C)=NN(C)C Amb22230207 [0,0,0,0,0,0|4,0,0]=4 54 B6R0.2 CC(C)C=C(Br)Br Amb24736609 [0,0,0,0,0,0|2,0,1]=3 55 B6R0.2 CC(C)CC(=C)Br Amb22583739 [0,0,0,0,0,0|2,0,0]=2 56 B6R0.2 CC(C)CC(C)C Amb22045157 [0,0,0,0,0,0|2,0,1]=3 57 B6R0.2 CC(C)CC(C)I Amb25783778 [0,0,0,0,0,0|2,0,1]=3 58 B6R0.2 CC(C)CC(Cl)Br Amb24634052 [0,0,0,0,0,0|2,0,1]=3 59 B6R0.2 CC(C)CC(Cl)Cl Amb17689252 [0,0,0,0,0,0|2,0,1]=3 60 B6R0.2 CC(C)CC([O-])=O Amb22732147 [0,0,0,0,0,0|0,0,1]=1 61 B6R0.2 CC(C)CC([O-])=O Amb22732282 [0,0,0,0,0,0|0,0,1]=1 62 B6R0.2 CC(C)CC([O-])=O Amb22734041 [0,0,0,0,0,0|0,0,1]=1 63 B6R0.2 CC(C)CC([O-])=O Amb22734425 [0,0,0,0,0,0|0,0,1]=1 64 B6R0.2 CC(C)CN(C)N Amb25339332 [0,0,0,0,0,0|3,0,0]=3 65 B6R0.2 CC(C)CS(N)=O Amb24527860 [0,0,0,0,0,0|2,0,0]=2 66 B6R0.2 CC(C)CS([O-])=O Amb19930010 [0,0,0,0,0,0|1,0,1]=2 67 B6R0.2 CC(C)C[13C](O)=O Amb22336513 [0,0,0,0,0,0|0,0,0]=0 68 B6R0.2 CC(C)C[13C]([O-])=O Amb22336662 [0,0,0,0,0,0|0,0,1]=1 69 B6R0.2 CC(C)C[Al](Cl)Cl Amb22353406 [0,0,0,0,0,0|3,0,0]=3 70 B6R0.2 CC(C)C[N+]([O-])=O Amb17672613 [0,0,0,0,0,0|1,0,1]=2 71 B6R0.2 CC(C)C[SiH](Cl)Cl Amb25143964 [0,0,0,0,0,0|2,1,0]=3 72 B6R0.2 CC(C)NC(=O)F Amb24567697 [0,0,0,0,0,0|2,0,0]=2 73 B6R0.2 CC(C)NC(C)=C Amb25746179 [0,0,0,0,0,0|3,0,0]=3 74 B6R0.2 CC(C)NC(C)=N Amb25711699 [0,0,0,0,0,0|3,0,0]=3 75 B6R0.2 CC(C)NC(C)C Amb22489624 [0,0,0,0,0,0|3,0,1]=4 76 B6R0.2 CC(C)NC(C)O Amb25662502 [0,0,0,0,0,0|2,0,1]=3 77 B6R0.2 CC(C)NC(N)=N Amb24271074 [0,0,0,0,0,0|3,0,0]=3 78 B6R0.2 CC(C)NC(S)=S Amb24761419 [0,0,0,0,0,0|1,2,0]=3 79 B6R0.2 CC(C)OC(=C)O Amb24086570 [0,0,0,0,0,0|2,0,0]=2 80 B6R0.2 CC(C)OC(C)=S Amb24697607 [0,0,0,0,0,0|2,1,0]=3 81 B6R0.2 CC(C)OC(N)=S Amb25732665 [0,0,0,0,0,0|2,1,0]=3 82 B6R0.2 CC(C)OC(S)=S Amb22274297 [0,0,0,0,0,0|1,2,0]=3 83 B6R0.2 CC(C)OC(S)=S Amb24465791 [0,0,0,0,0,0|1,2,0]=3 84 B6R0.2 CC(C)OC([S-])=S Amb19748282 [0,0,0,0,0,0|1,2,0]=3 85 B6R0.2 CC(C)OC([S-])=S Amb22729007 [0,0,0,0,0,0|1,2,0]=3 86 B6R0.2 CC(C)OP(C)=O Amb24592794 [0,0,0,0,0,0|3,0,0]=3 87 B6R0.2 CC(C)O[Al](C)C Amb22353901 [0,0,0,0,0,0|4,0,0]=4 88 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [0,0,0,0,0,0|2,0,0]=2 89 B6R0.2 CC(C)SC(N)=N Amb22369433 [0,0,0,0,0,0|3,0,0]=3 90 B6R0.2 CC(C)SC(N)=O Amb24461669 [0,0,0,0,0,0|2,0,0]=2 91 B6R0.2 CC(C)[N-]C(C)C Amb17943072 [0,0,0,0,0,0|3,0,1]=4 92 B6R0.2 CC(C)[N-]C(C)C Amb22351644 [0,0,0,0,0,0|3,0,1]=4 93 B6R0.2 CC(C)[SiH2]C(C)C Amb19893819 [0,0,0,0,0,0|2,1,1]=4 94 B6R0.2 CC(C)[Te]C(C)C Amb22731910 [0,0,0,0,0,0|3,0,1]=4 95 B6R0.2 CC(C)[Zn]C(C)C Amb22348372 [0,0,0,0,0,0|3,0,1]=4 96 B6R0.2 CC(CC(=C)C)O Amb17593083 [0,0,0,0,0,0|3,0,0]=3 97 B6R0.2 CC(CC(=N)N)C Amb10066934 [0,0,0,0,0,0|2,0,0]=2 98 B6R0.2 CC(CC(=O)C)Cl Amb17593234 [0,0,0,0,0,0|2,0,0]=2 99 B6R0.2 CC(CC(=O)C)N Amb2583230 [0,0,0,0,0,0|2,0,0]=2 100 B6R0.2 CC(CC(=O)C)O Amb17593091 [0,0,0,0,0,0|2,0,0]=2 101 B6R0.2 CC(CC(Cl)C)O Amb17593253 [0,0,0,0,0,0|2,0,1]=3 102 B6R0.2 CC(CC(N)C)C Amb1121431 [0,0,0,0,0,0|2,0,1]=3 103 B6R0.2 CC(CC(O)C)O Amb10068523 [0,0,0,0,0,0|2,0,1]=3 104 B6R0.2 CC(CN(C)C)C Amb17231805 [0,0,0,0,0,0|3,0,0]=3 105 B6R0.2 CC(Cl)=CC(N)=O Amb24567853 [0,0,0,0,0,0|2,0,2]=4 106 B6R0.2 CC(Cl)C=C(Cl)Cl Amb24429113 [0,0,0,0,0,0|3,0,1]=4 107 B6R0.2 CC(Cl)CC(C)=C Amb24558200 [0,0,0,0,0,0|3,0,0]=3 108 B6R0.2 CC(Cl)CC(C)Cl Amb22168237 [0,0,0,0,0,0|3,0,1]=4 109 B6R0.2 CC(Cl)CC(Cl)Cl Amb25074047 [0,0,0,0,0,0|3,0,1]=4 110 B6R0.2 CC(Cl)CP(O)O Amb25061243 [0,0,0,0,0,0|2,0,1]=3 111 B6R0.2 CC(Cl)C[SiH](Cl)Cl Amb24478548 [0,0,0,0,0,0|3,1,0]=4 112 B6R0.2 CC(Cl)NC(=O)Cl Amb24480662 [0,0,0,0,0,0|3,0,0]=3 113 B6R0.2 CC(Cl)OC(=S)Cl Amb25210549 [0,0,0,0,0,0|3,1,0]=4 114 B6R0.2 CC(Cl)OC(C)=O Amb24058273 [0,0,0,0,0,0|3,0,0]=3 115 B6R0.2 CC(Cl)OC(N)=O Amb24372683 [0,0,0,0,0,0|3,0,0]=3 116 B6R0.2 CC(Cl)SC(=C)Cl Amb25779926 [0,0,0,0,0,0|4,0,0]=4 117 B6R0.2 CC(Cl)SC(C)=O Amb24625146 [0,0,0,0,0,0|3,0,0]=3 118 B6R0.2 CC(Cl)\C=C(/C)\Cl Amb25242497 [0,0,0,0,0,0|3,0,1]=4 119 B6R0.2 CC(F)=CC(O)=O Amb24676595 [0,0,0,0,0,0|1,0,2]=3 120 B6R0.2 CC(F)CC(C)F Amb25779026 [0,0,0,0,0,0|3,0,1]=4 121 B6R0.2 CC(F)CC(O)=O Amb24561809 [0,0,0,0,0,0|1,0,0]=1 122 B6R0.2 CC(F)C[N+]([O-])=O Amb25024317 [0,0,0,0,0,0|2,0,1]=3 123 B6R0.2 CC(I)=CC(O)=O Amb24668934 [0,0,0,0,0,0|1,0,2]=3 124 B6R0.2 CC(I)CC(C)O Amb25743469 [0,0,0,0,0,0|2,0,1]=3 125 B6R0.2 CC(I)CC(N)=O Amb25783800 [0,0,0,0,0,0|2,0,0]=2 126 B6R0.2 CC(N)=CC(O)=O Amb25856437 [0,0,0,0,0,0|1,0,2]=3 127 B6R0.2 CC(N)C=C(Cl)Cl Amb24479878 [0,0,0,0,0,0|3,0,1]=4 128 B6R0.2 CC(N)CC(=O)Cl Amb25830663 [0,0,0,0,0,0|2,0,0]=2 129 B6R0.2 CC(N)CC(C)=C Amb25064223 [0,0,0,0,0,0|3,0,0]=3 130 B6R0.2 CC(N)CC(C)=O Amb22587050 [0,0,0,0,0,0|2,0,0]=2 131 B6R0.2 CC(N)CC(C)N Amb18639985 [0,0,0,0,0,0|3,0,1]=4 132 B6R0.2 CC(N)CC(N)=N Amb25051498 [0,0,0,0,0,0|3,0,0]=3 133 B6R0.2 CC(N)CC(N)=O Amb18281237 [0,0,0,0,0,0|2,0,0]=2 134 B6R0.2 CC(N)CC(N)=S Amb25198821 [0,0,0,0,0,0|2,1,0]=3 135 B6R0.2 CC(N)CC(O)=O Amb19888354 [0,0,0,0,0,0|1,0,0]=1 136 B6R0.2 CC(N)CN(C)C Amb22728279 [0,0,0,0,0,0|3,0,1]=4 137 B6R0.2 CC(N)CN(C)N Amb24560270 [0,0,0,0,0,0|4,0,0]=4 138 B6R0.2 CC(N)NC(N)=N Amb24585782 [0,0,0,0,0,0|4,0,0]=4 139 B6R0.2 CC(N)OP(O)O Amb24479895 [0,0,0,0,0,0|3,0,1]=4 140 B6R0.2 CC(NC(=O)N)C Amb1104587 [0,0,0,0,0,0|2,0,0]=2 141 B6R0.2 CC(NC(=S)N)C Amb1152626 [0,0,0,0,0,0|2,1,0]=3 142 B6R0.2 CC(NC(C)C)C Amb10068440 [0,0,0,0,0,0|3,0,1]=4 143 B6R0.2 CC(NC(C)C)C Amb2568045 [0,0,0,0,0,0|3,0,1]=4 144 B6R0.2 CC(O)=CC(O)O Amb24431523 [0,0,0,0,0,0|3,0,1]=4 145 B6R0.2 CC(O)C=C(C)C Amb22229846 [0,0,0,0,0,0|1,0,3]=4 146 B6R0.2 CC(O)C=C(Cl)Cl Amb25801932 [0,0,0,0,0,0|3,0,1]=4 147 B6R0.2 CC(O)CC(=C)Br Amb24618620 [0,0,0,0,0,0|3,0,0]=3 148 B6R0.2 CC(O)CC(C)N Amb18640217 [0,0,0,0,0,0|2,0,1]=3 149 B6R0.2 CC(O)CC(N)=S Amb24479794 [0,0,0,0,0,0|2,1,0]=3 150 B6R0.2 CC(O)CC(O)=O Amb22348403 [0,0,0,0,0,0|1,0,0]=1 151 B6R0.2 CC(O)CC(O)O Amb25716084 [0,0,0,0,0,0|1,0,2]=3 152 B6R0.2 CC(O)CC(S)=S Amb25215114 [0,0,0,0,0,0|1,2,0]=3 153 B6R0.2 CC(O)CP(O)=O Amb24406357 [0,0,0,0,0,0|2,0,0]=2 154 B6R0.2 CC(O)NC(N)=N Amb24736099 [0,0,0,0,0,0|4,0,0]=4 155 B6R0.2 CC(O)NC(N)=O Amb25811550 [0,0,0,0,0,0|3,0,0]=3 156 B6R0.2 CC(O)OC(C)N Amb24479444 [0,0,0,0,0,0|3,0,1]=4 157 B6R0.2 CC(O)OC(C)O Amb25662319 [0,0,0,0,0,0|3,0,1]=4 158 B6R0.2 CC(O)OC(N)=O Amb24669632 [0,0,0,0,0,0|3,0,0]=3 159 B6R0.2 CC(O)SC(C)=O Amb24544015 [0,0,0,0,0,0|3,0,0]=3 160 B6R0.2 CC(O)\C=C(\C)/S Amb25800756 [0,0,0,0,0,0|2,1,1]=4 161 B6R0.2 CC(OC(=S)[S-])C Amb2371664 [0,0,0,0,0,0|1,2,0]=3 162 B6R0.2 CC(O[N+](=O)[O-])C Amb2447326 [0,0,0,0,0,0|2,0,1]=3 163 B6R0.2 CC(P)CC(C)O Amb25792365 [0,0,0,0,0,0|2,0,1]=3 164 B6R0.2 CC(S)=CC(C)=O Amb24611600 [0,0,0,0,0,0|2,0,2]=4 165 B6R0.2 CC(S)CC(C)=O Amb24600676 [0,0,0,0,0,0|2,0,0]=2 166 B6R0.2 CC(S)CC(C)O Amb24122653 [0,0,0,0,0,0|2,0,1]=3 167 B6R0.2 CC(S)CC(N)=O Amb24479823 [0,0,0,0,0,0|2,0,0]=2 168 B6R0.2 CC(S)CC(O)=O Amb18281031 [0,0,0,0,0,0|1,0,0]=1 169 B6R0.2 CC(S)CN(C)C Amb24415953 [0,0,0,0,0,0|2,1,1]=4 170 B6R0.2 CC(S)NC(N)=N Amb24649055 [0,0,0,0,0,0|4,0,0]=4 171 B6R0.2 CC(SC(=N)N)C Amb1093763 [0,0,0,0,0,0|3,0,0]=3 172 B6R0.2 CN(Br)CC(O)=O Amb25745878 [0,0,0,0,0,0|2,0,0]=2 173 B6R0.2 CN(C)CB(F)F Amb25366581 [0,0,0,0,0,0|4,0,0]=4 174 B6R0.2 CN(C)CB(O)O Amb25131560 [0,0,0,0,0,0|2,0,1]=3 175 B6R0.2 CN(C)CC(=C)Br Amb24699168 [0,0,0,0,0,0|3,0,0]=3 176 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [0,0,0,0,0,0|2,0,0]=2 177 B6R0.2 CN(C)CC(N)=S Amb19373088 [0,0,0,0,0,0|2,1,0]=3 178 B6R0.2 CN(C)CC(O)O Amb25226405 [0,0,0,0,0,0|1,0,2]=3 179 B6R0.2 CN(C)CC(O)S Amb24610156 [0,0,0,0,0,0|1,1,1]=3 180 B6R0.2 CN(C)CC([O-])=O Amb22002291 [0,0,0,0,0,0|1,0,1]=2 181 B6R0.2 CN(C)CS(O)=O Amb25376029 [0,0,0,0,0,0|2,0,0]=2 182 B6R0.2 CN(C)C[SiH](O)O Amb25811267 [0,0,0,0,0,0|1,1,1]=3 183 B6R0.2 CN(C)NC(N)=N Amb19515724 [0,0,0,0,0,0|4,0,0]=4 184 B6R0.2 CN(C)NC(N)=O Amb24325231 [0,0,0,0,0,0|3,0,0]=3 185 B6R0.2 CN(CC(=N)N)C Amb10610521 [0,0,0,0,0,0|3,0,0]=3 186 B6R0.2 CN(CC(=N)N)C Amb10610536 [0,0,0,0,0,0|3,0,0]=3 187 B6R0.2 CN(CC(=O)N)C Amb17231806 [0,0,0,0,0,0|2,0,0]=2 188 B6R0.2 CN(CC(=S)N)C Amb16232219 [0,0,0,0,0,0|2,1,0]=3 189 B6R0.2 CN(CC(N)C)C Amb1135029 [0,0,0,0,0,0|3,0,1]=4 190 B6R0.2 CN(C[C@@H](O)C)C Amb10844893 [0,0,0,0,0,0|2,0,1]=3 191 B6R0.2 CN(Cl)CC(O)=O Amb24455857 [0,0,0,0,0,0|2,0,0]=2 192 B6R0.2 CN(N)CC(O)=O Amb23592296 [0,0,0,0,0,0|2,0,0]=2 193 B6R0.2 CN(N)NC(N)=O Amb25327360 [0,0,0,0,0,0|4,0,0]=4 194 B6R0.2 CN(NC(=S)S)C Amb16203907 [0,0,0,0,0,0|2,2,0]=4 195 B6R0.2 CN(O)CC(O)=O Amb24732008 [0,0,0,0,0,0|2,0,0]=2 196 B6R0.2 CP(C)CP(C)C Amb22054159 [0,0,0,0,0,0|4,0,0]=4 197 B6R0.2 CS(=O)CC(N)=O Amb24394100 [0,0,0,0,0,0|3,0,0]=3 198 B6R0.2 CS(=O)CC(O)=O Amb18957960 [0,0,0,0,0,0|2,0,0]=2 199 B6R0.2 CS(C)=CC(O)=O Amb25717234 [0,0,0,0,0,0|1,0,1]=2 200 B6R0.2 C[13CH](O)C[13C]([O-])=O Amb22338641 [0,0,0,0,0,0|1,0,1]=2 201 B6R0.2 C[13C](=O)O[13C](C)=O Amb22353530 [0,0,0,0,0,0|3,0,1]=4 202 B6R0.2 C[C@@H](CC(=O)O)N Amb16184012 [0,0,0,0,0,0|1,0,0]=1 203 B6R0.2 C[C@@H](Cl)CC(=O)Cl Amb25321802 [0,0,0,0,0,0|2,0,0]=2 204 B6R0.2 C[C@@H](Cl)CN(C)C Amb24479697 [0,0,0,0,0,0|3,0,1]=4 205 B6R0.2 C[C@@H](N)CC(N)=O Amb25789836 [0,0,0,0,0,0|2,0,0]=2 206 B6R0.2 C[C@@H](N)C[C@@H](C)N Amb25127735 [0,0,0,0,0,0|3,0,1]=4 207 B6R0.2 C[C@@H](O)C=C(C)C Amb25700154 [0,0,0,0,0,0|1,0,3]=4 208 B6R0.2 C[C@@H](O)CC(=C)Br Amb25045702 [0,0,0,0,0,0|3,0,0]=3 209 B6R0.2 C[C@@H](O)CC(C)O Amb25083401 [0,0,0,0,0,0|2,0,1]=3 210 B6R0.2 C[C@@H](O)CC(N)=O Amb25746564 [0,0,0,0,0,0|2,0,0]=2 211 B6R0.2 C[C@@H](O)CN(C)C Amb22746407 [0,0,0,0,0,0|2,0,1]=3 212 B6R0.2 C[C@@H](O)C[C@@H](C)N Amb24568258 [0,0,0,0,0,0|2,0,1]=3 213 B6R0.2 C[C@@H](O)C[C@H](C)N Amb24479559 [0,0,0,0,0,0|2,0,1]=3 214 B6R0.2 C[C@@H](S)CC(O)=O Amb24480921 [0,0,0,0,0,0|1,0,0]=1 215 B6R0.2 C[C@H](Br)CC(O)=O Amb24432019 [0,0,0,0,0,0|1,0,0]=1 216 B6R0.2 C[C@H](CC(=O)O)N Amb16184009 [0,0,0,0,0,0|1,0,0]=1 217 B6R0.2 C[C@H](Cl)CC(=O)Cl Amb25053837 [0,0,0,0,0,0|2,0,0]=2 218 B6R0.2 C[C@H](Cl)CC(O)=O Amb25259323 [0,0,0,0,0,0|1,0,0]=1 219 B6R0.2 C[C@H](Cl)C[C@@H](C)Cl Amb24479097 [0,0,0,0,0,0|3,0,1]=4 220 B6R0.2 C[C@H](Cl)C[C@H](C)Cl Amb25697162 [0,0,0,0,0,0|3,0,1]=4 221 B6R0.2 C[C@H](F)CC(O)=O Amb24586490 [0,0,0,0,0,0|1,0,0]=1 222 B6R0.2 C[C@H](N)C=C(C)C Amb24333107 [0,0,0,0,0,0|3,0,1]=4 223 B6R0.2 C[C@H](N)CN(C)C Amb24074602 [0,0,0,0,0,0|3,0,1]=4 224 B6R0.2 C[C@H](N)CN(C)C Amb24074603 [0,0,0,0,0,0|3,0,1]=4 225 B6R0.2 C[C@H](N)C[C@H](C)N Amb24479909 [0,0,0,0,0,0|3,0,1]=4 226 B6R0.2 C[C@H](O)C=C(C)C Amb24734239 [0,0,0,0,0,0|1,0,3]=4 227 B6R0.2 C[C@H](O)CC(C)=O Amb24334071 [0,0,0,0,0,0|2,0,0]=2 228 B6R0.2 C[C@H](O)CC(C)N Amb25835759 [0,0,0,0,0,0|2,0,1]=3 229 B6R0.2 C[C@H](O)CC(C)O Amb25381310 [0,0,0,0,0,0|2,0,1]=3 230 B6R0.2 C[C@H](O)CC(O)=O Amb22232025 [0,0,0,0,0,0|1,0,0]=1 231 B6R0.2 C[C@H](O)C[C@@H](C)N Amb24351024 [0,0,0,0,0,0|2,0,1]=3 232 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [0,0,0,0,0,0|2,0,1]=3 233 B6R0.2 C[C@H](S)CC(O)=O Amb25190038 [0,0,0,0,0,0|1,0,0]=1 234 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [0,0,0,0,0,0|2,0,0]=2 235 B6R0.2 C[NH+](C)CC(O)=O Amb24113881 [0,0,0,0,0,0|1,0,0]=1 236 B6R0.2 C\C(=C/C(=O)C)\N Amb1149988 [0,0,0,0,0,0|2,0,2]=4 237 B6R0.2 C\C(\Br)=C\C(O)=O Amb25662428 [0,0,0,0,0,0|1,0,2]=3 238 B6R0.2 C\C(\Cl)=C/C(C)=O Amb25795658 [0,0,0,0,0,0|2,0,2]=4 239 B6R0.2 C\C(\Cl)=C/C(O)=O Amb18123483 [0,0,0,0,0,0|1,0,2]=3 240 B6R0.2 C\C(\Cl)=C\C(N)=O Amb24714532 [0,0,0,0,0,0|2,0,2]=4 241 B6R0.2 C\C(\Cl)=C\C(O)=O Amb23556468 [0,0,0,0,0,0|1,0,2]=3 242 B6R0.2 C\C(\F)=C/C(C)=O Amb24614698 [0,0,0,0,0,0|2,0,2]=4 243 B6R0.2 C\C(\F)=C\C(C)=O Amb25717786 [0,0,0,0,0,0|2,0,2]=4 244 B6R0.2 C\C(\I)=C/C(N)=O Amb25378941 [0,0,0,0,0,0|2,0,2]=4 245 B6R0.2 C\C(\I)=C\C(O)=O Amb24741877 [0,0,0,0,0,0|1,0,2]=3 246 B6R0.2 C\C(\N)=C\C(N)=O Amb22002462 [0,0,0,0,0,0|2,0,2]=4 247 B6R0.2 C\C(\O)=C\C(C)=O Amb22034390 [0,0,0,0,0,0|2,0,2]=4 248 B6R0.2 C\C(\[O-])=C/C(C)=O Amb19894693 [0,0,0,0,0,0|2,0,2]=4 249 B6R0.2 C\C(\[O-])=C\C(C)=O Amb19959976 [0,0,0,0,0,0|2,0,2]=4 250 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239360 [0,0,0,0,0,0|2,0,2]=4 251 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239373 [0,0,0,0,0,0|2,0,2]=4 252 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239374 [0,0,0,0,0,0|2,0,2]=4 253 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239443 [0,0,0,0,0,0|2,0,2]=4 254 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20246565 [0,0,0,0,0,0|2,0,2]=4 255 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045337 [0,0,0,0,0,0|2,0,2]=4 256 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045339 [0,0,0,0,0,0|2,0,2]=4 257 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045350 [0,0,0,0,0,0|2,0,2]=4 258 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045370 [0,0,0,0,0,0|2,0,2]=4 259 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045376 [0,0,0,0,0,0|2,0,2]=4 260 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045378 [0,0,0,0,0,0|2,0,2]=4 261 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045379 [0,0,0,0,0,0|2,0,2]=4 262 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045386 [0,0,0,0,0,0|2,0,2]=4 263 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045388 [0,0,0,0,0,0|2,0,2]=4 264 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045392 [0,0,0,0,0,0|2,0,2]=4 265 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045393 [0,0,0,0,0,0|2,0,2]=4 266 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045408 [0,0,0,0,0,0|2,0,2]=4 267 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045419 [0,0,0,0,0,0|2,0,2]=4 268 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045578 [0,0,0,0,0,0|2,0,2]=4 269 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045602 [0,0,0,0,0,0|2,0,2]=4 270 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045712 [0,0,0,0,0,0|2,0,2]=4 271 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045835 [0,0,0,0,0,0|2,0,2]=4 272 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045854 [0,0,0,0,0,0|2,0,2]=4 273 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045869 [0,0,0,0,0,0|2,0,2]=4 274 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22052617 [0,0,0,0,0,0|2,0,2]=4 275 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053071 [0,0,0,0,0,0|2,0,2]=4 276 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053499 [0,0,0,0,0,0|2,0,2]=4 277 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053500 [0,0,0,0,0,0|2,0,2]=4 278 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053502 [0,0,0,0,0,0|2,0,2]=4 279 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053503 [0,0,0,0,0,0|2,0,2]=4 280 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053559 [0,0,0,0,0,0|2,0,2]=4 281 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053596 [0,0,0,0,0,0|2,0,2]=4 282 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053692 [0,0,0,0,0,0|2,0,2]=4 283 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053697 [0,0,0,0,0,0|2,0,2]=4 284 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053737 [0,0,0,0,0,0|2,0,2]=4 285 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053933 [0,0,0,0,0,0|2,0,2]=4 286 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053935 [0,0,0,0,0,0|2,0,2]=4 287 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053939 [0,0,0,0,0,0|2,0,2]=4 288 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053940 [0,0,0,0,0,0|2,0,2]=4 289 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053954 [0,0,0,0,0,0|2,0,2]=4 290 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054002 [0,0,0,0,0,0|2,0,2]=4 291 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054020 [0,0,0,0,0,0|2,0,2]=4 292 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054022 [0,0,0,0,0,0|2,0,2]=4 293 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054119 [0,0,0,0,0,0|2,0,2]=4 294 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22466635 [0,0,0,0,0,0|2,0,2]=4 295 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22728947 [0,0,0,0,0,0|2,0,2]=4 296 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22729908 [0,0,0,0,0,0|2,0,2]=4 297 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22729969 [0,0,0,0,0,0|2,0,2]=4 298 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22729970 [0,0,0,0,0,0|2,0,2]=4 299 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22730028 [0,0,0,0,0,0|2,0,2]=4 300 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22730125 [0,0,0,0,0,0|2,0,2]=4 301 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22731170 [0,0,0,0,0,0|2,0,2]=4 302 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22733289 [0,0,0,0,0,0|2,0,2]=4 303 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22733723 [0,0,0,0,0,0|2,0,2]=4 304 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22735083 [0,0,0,0,0,0|2,0,2]=4 305 B6R0.2 N=C(Cl)CC(O)=O Amb25796071 [0,0,0,0,0,0|2,0,1]=3 306 B6R0.2 NC(=N)CC(=O)N Amb1981332 [0,0,0,0,0,0|3,0,1]=4 307 B6R0.2 NC(=O)CC(=N)[NH3+] Amb2439350 [0,0,0,0,0,0|3,0,1]=4 308 B6R0.2 NC(=O)CC(=O)N Amb1971463 [0,0,0,0,0,0|3,0,1]=4 309 B6R0.2 NC(=O)CC(=S)N Amb1155422 [0,0,0,0,0,0|3,0,1]=4 310 B6R0.2 NC(=O)CC(Cl)Cl Amb24479899 [0,0,0,0,0,0|3,0,0]=3 311 B6R0.2 NC(=O)CC(O)O Amb25810087 [0,0,0,0,0,0|3,0,0]=3 312 B6R0.2 NC(=O)CC([O-])=O Amb22263088 [0,0,0,0,0,0|2,0,2]=4 313 B6R0.2 NC(=S)CC(F)F Amb25225435 [0,0,0,0,0,0|3,1,0]=4 314 B6R0.2 NC(F)CC(O)=O Amb24479804 [0,0,0,0,0,0|2,0,0]=2 315 B6R0.2 NC(N)C[N+]([O-])=O Amb25775386 [0,0,0,0,0,0|3,0,1]=4 316 B6R0.2 N[13C](=O)[13CH2][13C](=O)N Amb17616663 [0,0,0,0,0,0|3,0,1]=4 317 B6R0.2 N[C@@H](CC(=O)O)O Amb16232006 [0,0,0,0,0,0|2,0,0]=2 318 B6R0.2 N[C@@H](F)CC(O)=O Amb25854307 [0,0,0,0,0,0|2,0,0]=2 319 B6R0.2 O=C(Cl)CC(Cl)Cl Amb24478549 [0,0,0,0,0,0|3,0,0]=3 320 B6R0.2 OB(C=C(C)C)O Amb2455988 [0,0,0,0,0,0|1,0,3]=4 321 B6R0.2 OB(CC(C)C)O Amb2447316 [0,0,0,0,0,0|1,0,1]=2 322 B6R0.2 OB(O)CC(O)=O Amb24053058 [0,0,0,0,0,0|3,0,0]=3 323 B6R0.2 OC(=O)C=C(Br)Br Amb24435008 [0,0,0,0,0,0|2,0,2]=4 324 B6R0.2 OC(=O)C=C(F)F Amb24116995 [0,0,0,0,0,0|2,0,2]=4 325 B6R0.2 OC(=O)CC(=S)N Amb17465742 [0,0,0,0,0,0|2,0,1]=3 326 B6R0.2 OC(=O)CC(F)Br Amb25336987 [0,0,0,0,0,0|2,0,0]=2 327 B6R0.2 OC(=O)CC(F)F Amb22001551 [0,0,0,0,0,0|2,0,0]=2 328 B6R0.2 OC(=O)CC(O)=O Amb21935659 [0,0,0,0,0,0|2,0,1]=3 329 B6R0.2 OC(=O)CC(O)=O Amb22230690 [0,0,0,0,0,0|2,0,1]=3 330 B6R0.2 OC(=O)CC(O)=O Amb22230927 [0,0,0,0,0,0|2,0,1]=3 331 B6R0.2 OC(=O)CN(Cl)Cl Amb25133084 [0,0,0,0,0,0|3,0,0]=3 332 B6R0.2 OC(=O)[13CH2]C(O)=O Amb22337806 [0,0,0,0,0,0|2,0,1]=3 333 B6R0.2 O[13C](=O)C[13C](O)=O Amb22353218 [0,0,0,0,0,0|2,0,1]=3 334 B6R0.2 O[13C](=O)[13CH2][13C](O)=O Amb22363192 [0,0,0,0,0,0|2,0,1]=3 335 B6R0.2 O[14C](=O)O[14C](O)=O Amb22362831 [0,0,0,0,0,0|3,0,1]=4 336 B6R0.2 [13CH3]C(=O)OC([13CH3])=O Amb22336728 [0,0,0,0,0,0|3,0,1]=4 337 B6R0.2 [13CH3]C(O)[13CH2]C([O-])=O Amb22351144 [0,0,0,0,0,0|1,0,1]=2 338 B6R0.2 [13CH3][13CH]([13CH3])O[13CH]([13CH3])[13CH3] Amb22367319 [0,0,0,0,0,0|3,0,1]=4 339 B6R0.2 [13CH3][13C](=O)O[13C]([13CH3])=O Amb22338759 [0,0,0,0,0,0|3,0,1]=4 340 B6R0.2 [BH3-][S+](C)CC(O)=O Amb24480870 [0,0,0,0,0,0|2,0,0]=2 341 B6R0.2 [O-]C(=O)CC(=O)[O-] Amb10070428 [0,0,0,0,0,0|2,0,2]=4 342 B6R0.2 [O-]C(=O)CC(F)F Amb24117960 [0,0,0,0,0,0|2,0,1]=3 343 B6R0.2 [O-]C(=O)CC([O-])=O Amb22730396 [0,0,0,0,0,0|2,0,2]=4 344 B6R0.2 [O-]C(=O)C[C@@H](O)C Amb10844672 [0,0,0,0,0,0|1,0,1]=2 345 B6R0.2 [O-]C(=S)CC(F)F Amb24420974 [0,0,0,0,0,0|2,1,1]=4 346 B6R0.2 [O-][N+](=O)CC(=O)N Amb10069145 [0,0,0,0,0,0|4,0,0]=4 347 B6R0.2 [O-][N+](=O)CC(=O)N Amb1101925 [0,0,0,0,0,0|4,0,0]=4 348 B5R0.1 BC(=O)NCC Amb22343194 [1,0,0,0,0,0|2,0,0]=3 349 B5R0.1 BrCCN(C)C Amb10603116 [1,0,0,0,0,0|2,0,1]=4 350 B5R0.1 BrCCN(C)C Amb10608907 [1,0,0,0,0,0|2,0,1]=4 351 B5R0.1 C/C=C/C(C)=O Amb17940030 [1,0,0,0,0,0|1,0,2]=4 352 B5R0.1 C=C(Br)CCBr Amb25827098 [1,0,0,0,0,0|3,0,0]=4 353 B5R0.1 C=C(Br)CCN Amb23512022 [1,0,0,0,0,0|3,0,0]=4 354 B5R0.1 C=C(Cl)CCCl Amb24636781 [1,0,0,0,0,0|3,0,0]=4 355 B5R0.1 C=C(F)CCO Amb25747437 [1,0,0,0,0,0|3,0,0]=4 356 B5R0.1 C=C(I)CCCl Amb24349789 [1,0,0,0,0,0|3,0,0]=4 357 B5R0.1 C=C(I)CCN Amb24756665 [1,0,0,0,0,0|3,0,0]=4 358 B5R0.1 C=C=CC(O)=O Amb24391957 [1,0,0,0,0,0|0,0,3]=4 359 B5R0.1 C=CCC(Cl)Cl Amb24366054 [1,0,0,0,0,0|3,0,0]=4 360 B5R0.1 C=CCC(O)O Amb25144470 [1,0,0,0,0,0|3,0,0]=4 361 B5R0.1 CC#CC(=O)C Amb17593016 [1,0,0,0,0,0|1,0,2]=4 362 B5R0.1 CC#CC(=O)N Amb10552409 [1,0,0,0,0,0|1,0,2]=4 363 B5R0.1 CC#CC(C)C Amb22337411 [1,0,0,0,0,0|1,0,2]=4 364 B5R0.1 CC(=C)CC=C Amb22347764 [1,0,0,0,0,0|1,0,2]=4 365 B5R0.1 CC(=C)CCBr Amb21857866 [1,0,0,0,0,0|3,0,0]=4 366 B5R0.1 CC(=C)CCN Amb17673481 [1,0,0,0,0,0|3,0,0]=4 367 B5R0.1 CC(=C)NC=O Amb25065862 [1,0,0,0,0,0|1,0,2]=4 368 B5R0.1 CC(=O)CC#C Amb17673302 [1,0,0,0,0,0|1,0,2]=4 369 B5R0.1 CC(=O)CC#N Amb1102132 [1,0,0,0,0,0|2,0,1]=4 370 B5R0.1 CC(=O)CC#N Amb22274239 [1,0,0,0,0,0|2,0,1]=4 371 B5R0.1 CC(=O)CC=O Amb17666764 [1,0,0,0,0,0|1,0,1]=3 372 B5R0.1 CC(=O)CCBr Amb24078246 [1,0,0,0,0,0|2,0,0]=3 373 B5R0.1 CC(=O)CCN Amb10067110 [1,0,0,0,0,0|2,0,0]=3 374 B5R0.1 CC(=O)CCN Amb18632933 [1,0,0,0,0,0|2,0,0]=3 375 B5R0.1 CC(=O)CN=O Amb24645582 [1,0,0,0,0,0|2,0,1]=4 376 B5R0.1 CC(=O)CON Amb25128844 [1,0,0,0,0,0|3,0,0]=4 377 B5R0.1 CC(=O)CSCl Amb24631131 [1,0,0,0,0,0|3,0,0]=4 378 B5R0.1 CC(=O)NCCl Amb25790034 [1,0,0,0,0,0|3,0,0]=4 379 B5R0.1 CC(=O)NCS Amb25124326 [1,0,0,0,0,0|3,0,0]=4 380 B5R0.1 CC(=O)OC=O Amb25283525 [1,0,0,0,0,0|2,0,1]=4 381 B5R0.1 CC(=O)OCCl Amb17673336 [1,0,0,0,0,0|3,0,0]=4 382 B5R0.1 CC(=O)OCI Amb25226851 [1,0,0,0,0,0|3,0,0]=4 383 B5R0.1 CC(=O)OCN Amb24359000 [1,0,0,0,0,0|3,0,0]=4 384 B5R0.1 CC(=O)SCBr Amb25349900 [1,0,0,0,0,0|3,0,0]=4 385 B5R0.1 CC(Br)CC#C Amb25147254 [1,0,0,0,0,0|2,0,1]=4 386 B5R0.1 CC(Br)CC#N Amb22432187 [1,0,0,0,0,0|2,0,1]=4 387 B5R0.1 CC(Br)CC=O Amb25074611 [1,0,0,0,0,0|1,0,0]=2 388 B5R0.1 CC(Br)CCN Amb24476717 [1,0,0,0,0,0|2,0,1]=4 389 B5R0.1 CC(Br)SC=C Amb25135745 [1,0,0,0,0,0|3,0,0]=4 390 B5R0.1 CC(Br)\C=C\Cl Amb25196204 [1,0,0,0,0,0|2,0,1]=4 391 B5R0.1 CC(C)=C=C=O Amb24699230 [1,0,0,0,0,0|0,0,3]=4 392 B5R0.1 CC(C)=C=CBr Amb17673288 [1,0,0,0,0,0|1,0,2]=4 393 B5R0.1 CC(C)=CC=C Amb22229813 [1,0,0,0,0,0|1,0,2]=4 394 B5R0.1 CC(C)C#CO Amb22492599 [1,0,0,0,0,0|0,0,2]=3 395 B5R0.1 CC(C)C=NN Amb25124227 [1,0,0,0,0,0|2,0,1]=4 396 B5R0.1 CC(C)CCF Amb24117499 [1,0,0,0,0,0|1,0,1]=3 397 B5R0.1 CC(C)CCN Amb22337707 [1,0,0,0,0,0|1,0,1]=3 398 B5R0.1 CC(C)CNN Amb22886984 [1,0,0,0,0,0|2,0,0]=3 399 B5R0.1 CC(C)CON Amb19889788 [1,0,0,0,0,0|2,0,0]=3 400 B5R0.1 CC(C)C[13CH]=O Amb22353955 [1,0,0,0,0,0|0,0,0]=1 401 B5R0.1 CC(C)C[Mg]Br Amb22336608 [1,0,0,0,0,0|2,0,0]=3 402 B5R0.1 CC(C)C[Mg]Cl Amb22351464 [1,0,0,0,0,0|2,0,0]=3 403 B5R0.1 CC(C)C[Zn]Br Amb22000395 [1,0,0,0,0,0|2,0,0]=3 404 B5R0.1 CC(C)N=C=N Amb25811139 [1,0,0,0,0,0|2,0,1]=4 405 B5R0.1 CC(C)NCO Amb24384251 [1,0,0,0,0,0|1,0,1]=3 406 B5R0.1 CC(C)OC#C Amb24691057 [1,0,0,0,0,0|2,0,1]=4 407 B5R0.1 CC(C)OC=C Amb22230777 [1,0,0,0,0,0|2,0,0]=3 408 B5R0.1 CC(C)OC=N Amb22337834 [1,0,0,0,0,0|2,0,0]=3 409 B5R0.1 CC(C)OC=N Amb25248353 [1,0,0,0,0,0|2,0,0]=3 410 B5R0.1 CC(C)OCCl Amb22168148 [1,0,0,0,0,0|2,0,1]=4 411 B5R0.1 CC(C)ON=O Amb17938692 [1,0,0,0,0,0|2,0,0]=3 412 B5R0.1 CC(C)O[PH2]=O Amb24599573 [1,0,0,0,0,0|2,0,0]=3 413 B5R0.1 CC(C)SC=C Amb24599592 [1,0,0,0,0,0|2,0,0]=3 414 B5R0.1 CC(C)SCCl Amb25807978 [1,0,0,0,0,0|2,0,1]=4 415 B5R0.1 CC(C)\C=C/C Amb22731717 [1,0,0,0,0,0|1,0,1]=3 416 B5R0.1 CC(C)\C=C\Br Amb25690202 [1,0,0,0,0,0|1,0,1]=3 417 B5R0.1 CC(C)\C=C\Cl Amb25793515 [1,0,0,0,0,0|1,0,1]=3 418 B5R0.1 CC(CC#N)C Amb1162737 [1,0,0,0,0,0|1,0,1]=3 419 B5R0.1 CC(CC#N)N Amb13951628 [1,0,0,0,0,0|2,0,1]=4 420 B5R0.1 CC(Cl)CC#N Amb18640320 [1,0,0,0,0,0|2,0,1]=4 421 B5R0.1 CC(Cl)CC=O Amb18640602 [1,0,0,0,0,0|1,0,0]=2 422 B5R0.1 CC(Cl)CCI Amb25091805 [1,0,0,0,0,0|2,0,1]=4 423 B5R0.1 CC(Cl)CSCl Amb24651125 [1,0,0,0,0,0|3,0,0]=4 424 B5R0.1 CC(Cl)N=C=O Amb25835524 [1,0,0,0,0,0|2,0,1]=4 425 B5R0.1 CC(Cl)OC=O Amb25811235 [1,0,0,0,0,0|2,0,0]=3 426 B5R0.1 CC(Cl)\C=C\Cl Amb25256868 [1,0,0,0,0,0|2,0,1]=4 427 B5R0.1 CC(Cl)\C=C\O Amb22734803 [1,0,0,0,0,0|1,0,1]=3 428 B5R0.1 CC(Cl)\C=C\S Amb25242442 [1,0,0,0,0,0|1,1,1]=4 429 B5R0.1 CC(F)CCF Amb25146337 [1,0,0,0,0,0|2,0,1]=4 430 B5R0.1 CC(F)CCI Amb25146599 [1,0,0,0,0,0|2,0,1]=4 431 B5R0.1 CC(F)CCO Amb21951900 [1,0,0,0,0,0|1,0,1]=3 432 B5R0.1 CC(I)CC#C Amb25173702 [1,0,0,0,0,0|2,0,1]=4 433 B5R0.1 CC(I)CC#N Amb24627011 [1,0,0,0,0,0|2,0,1]=4 434 B5R0.1 CC(I)CCCl Amb25241583 [1,0,0,0,0,0|2,0,1]=4 435 B5R0.1 CC(N)CC#C Amb18946962 [1,0,0,0,0,0|2,0,1]=4 436 B5R0.1 CC(N)CC#N Amb19515067 [1,0,0,0,0,0|2,0,1]=4 437 B5R0.1 CC(N)CC=C Amb17673480 [1,0,0,0,0,0|2,0,0]=3 438 B5R0.1 CC(N)CC=C Amb19515336 [1,0,0,0,0,0|2,0,0]=3 439 B5R0.1 CC(N)CC=O Amb25292247 [1,0,0,0,0,0|1,0,0]=2 440 B5R0.1 CC(N)CCF Amb25811370 [1,0,0,0,0,0|2,0,1]=4 441 B5R0.1 CC(N)CCN Amb18951361 [1,0,0,0,0,0|2,0,1]=4 442 B5R0.1 CC(N)CCN Amb19338152 [1,0,0,0,0,0|2,0,1]=4 443 B5R0.1 CC(N)CNN Amb24680308 [1,0,0,0,0,0|3,0,0]=4 444 B5R0.1 CC(N=[N+]=[N-])C Amb15701595 [1,0,0,0,0,0|3,0,0]=4 445 B5R0.1 CC(O)C=C=O Amb25747435 [1,0,0,0,0,0|1,0,2]=4 446 B5R0.1 CC(O)C=NO Amb24583649 [1,0,0,0,0,0|2,0,1]=4 447 B5R0.1 CC(O)CCCl Amb24551052 [1,0,0,0,0,0|2,0,1]=4 448 B5R0.1 CC(O)CCO Amb22227721 [1,0,0,0,0,0|1,0,1]=3 449 B5R0.1 CC(O)CCO Amb22232248 [1,0,0,0,0,0|1,0,1]=3 450 B5R0.1 CC(O)CCS Amb22359316 [1,0,0,0,0,0|1,1,1]=4 451 B5R0.1 CC(O)CN=O Amb25746175 [1,0,0,0,0,0|2,0,0]=3 452 B5R0.1 CC(O)CNO Amb24333693 [1,0,0,0,0,0|2,0,0]=3 453 B5R0.1 CC(O)CON Amb21962618 [1,0,0,0,0,0|3,0,0]=4 454 B5R0.1 CC(O)CON Amb22491794 [1,0,0,0,0,0|3,0,0]=4 455 B5R0.1 CC(O)OC=C Amb25215838 [1,0,0,0,0,0|3,0,0]=4 456 B5R0.1 CC(O)\C=C/Br Amb25809927 [1,0,0,0,0,0|2,0,1]=4 457 B5R0.1 CC(O)\C=C/Cl Amb24635620 [1,0,0,0,0,0|2,0,1]=4 458 B5R0.1 CC(O)\C=C/I Amb24373761 [1,0,0,0,0,0|2,0,1]=4 459 B5R0.1 CC(O)\C=C\Br Amb24519445 [1,0,0,0,0,0|2,0,1]=4 460 B5R0.1 CC(O)\C=C\Cl Amb25264104 [1,0,0,0,0,0|2,0,1]=4 461 B5R0.1 CC(S)CC=O Amb18122380 [1,0,0,0,0,0|1,0,0]=2 462 B5R0.1 CC(S)CCN Amb18908261 [1,0,0,0,0,0|2,0,1]=4 463 B5R0.1 CC(S)CCO Amb19148316 [1,0,0,0,0,0|1,0,1]=3 464 B5R0.1 CC(S)CCS Amb22227722 [1,0,0,0,0,0|1,1,1]=4 465 B5R0.1 CC(S)NC=O Amb25835741 [1,0,0,0,0,0|2,0,0]=3 466 B5R0.1 CC(\C=N\O)C Amb2455920 [1,0,0,0,0,0|1,0,1]=3 467 B5R0.1 CC=CC(C)=O Amb24061083 [1,0,0,0,0,0|1,0,2]=4 468 B5R0.1 CC=CC(C)N Amb19514513 [1,0,0,0,0,0|2,0,1]=4 469 B5R0.1 CCC=C(C)C Amb22336412 [1,0,0,0,0,0|2,0,1]=4 470 B5R0.1 CCC=C(F)F Amb10839842 [1,0,0,0,0,0|2,0,1]=4 471 B5R0.1 CCCB(O)O Amb2447105 [1,0,0,0,0,0|1,0,1]=3 472 B5R0.1 CCCC(=C)Br Amb22583743 [1,0,0,0,0,0|2,0,0]=3 473 B5R0.1 CCCC(=N)N Amb10610381 [1,0,0,0,0,0|2,0,0]=3 474 B5R0.1 CCCC(=O)Br Amb22734023 [1,0,0,0,0,0|1,0,0]=2 475 B5R0.1 CCCC(=S)Cl Amb24626931 [1,0,0,0,0,0|1,1,0]=3 476 B5R0.1 CCCC(C)F Amb22008011 [1,0,0,0,0,0|2,0,1]=4 477 B5R0.1 CCCC(C)I Amb17939400 [1,0,0,0,0,0|2,0,1]=4 478 B5R0.1 CCCC(Cl)Cl Amb25062516 [1,0,0,0,0,0|2,0,1]=4 479 B5R0.1 CCCC(F)Cl Amb25065258 [1,0,0,0,0,0|2,0,1]=4 480 B5R0.1 CCCC(N)C Amb10609075 [1,0,0,0,0,0|2,0,1]=4 481 B5R0.1 CCCC(N)O Amb25147414 [1,0,0,0,0,0|1,0,1]=3 482 B5R0.1 CCCC(O)=S Amb22229383 [1,0,0,0,0,0|0,1,0]=2 483 B5R0.1 CCCC(O)Br Amb25106743 [1,0,0,0,0,0|1,0,1]=3 484 B5R0.1 CCCC(O)Cl Amb22552567 [1,0,0,0,0,0|1,0,1]=3 485 B5R0.1 CCCC([O-])=O Amb17772223 [1,0,0,0,0,0|0,0,1]=2 486 B5R0.1 CCCC([O-])=O Amb22732283 [1,0,0,0,0,0|0,0,1]=2 487 B5R0.1 CCCC([O-])=O Amb22732651 [1,0,0,0,0,0|0,0,1]=2 488 B5R0.1 CCCN(C)C Amb22336514 [1,0,0,0,0,0|2,0,1]=4 489 B5R0.1 CCCN(C)C Amb22733186 [1,0,0,0,0,0|2,0,1]=4 490 B5R0.1 CCCN(C)N Amb24587192 [1,0,0,0,0,0|3,0,0]=4 491 B5R0.1 CCCN(C)O Amb25024622 [1,0,0,0,0,0|2,0,0]=3 492 B5R0.1 CCCP(Cl)Cl Amb22053969 [1,0,0,0,0,0|3,0,0]=4 493 B5R0.1 CCCS(=O)Cl Amb25025566 [1,0,0,0,0,0|2,0,0]=3 494 B5R0.1 CCCS(N)=O Amb24733579 [1,0,0,0,0,0|2,0,0]=3 495 B5R0.1 CCCS(O)=O Amb24615072 [1,0,0,0,0,0|1,0,0]=2 496 B5R0.1 CCCS([O-])=O Amb19929119 [1,0,0,0,0,0|1,0,1]=3 497 B5R0.1 CCC[13C](O)=O Amb22337992 [1,0,0,0,0,0|0,0,0]=1 498 B5R0.1 CCC[13C](O)=O Amb22338339 [1,0,0,0,0,0|0,0,0]=1 499 B5R0.1 CCC[C@@H](C)Br Amb24373894 [1,0,0,0,0,0|2,0,1]=4 500 B5R0.1 CCC[C@@H](C)Cl Amb24711432 [1,0,0,0,0,0|2,0,1]=4 501 B5R0.1 CCC[C@@H](C)I Amb24432363 [1,0,0,0,0,0|2,0,1]=4 502 B5R0.1 CCC[C@@H](C)N Amb22898992 [1,0,0,0,0,0|2,0,1]=4 503 B5R0.1 CCC[C@@H](C)N Amb23439500 [1,0,0,0,0,0|2,0,1]=4 504 B5R0.1 CCC[C@H](C)I Amb25237438 [1,0,0,0,0,0|2,0,1]=4 505 B5R0.1 CCC[C@H](C)N Amb21618754 [1,0,0,0,0,0|2,0,1]=4 506 B5R0.1 CCNC(=O)Br Amb24563760 [1,0,0,0,0,0|2,0,0]=3 507 B5R0.1 CCNC(=O)Cl Amb25791793 [1,0,0,0,0,0|2,0,0]=3 508 B5R0.1 CCNC(=S)Cl Amb25063250 [1,0,0,0,0,0|2,1,0]=4 509 B5R0.1 CCNC(C)=N Amb25246070 [1,0,0,0,0,0|3,0,0]=4 510 B5R0.1 CCNC(C)=S Amb24580999 [1,0,0,0,0,0|2,1,0]=4 511 B5R0.1 CCNC(N)=N Amb21964689 [1,0,0,0,0,0|3,0,0]=4 512 B5R0.1 CCNC(N)=N Amb22053912 [1,0,0,0,0,0|3,0,0]=4 513 B5R0.1 CCNC(N)=N Amb22168156 [1,0,0,0,0,0|3,0,0]=4 514 B5R0.1 CCNC(N)=[NH2+] Amb22734753 [1,0,0,0,0,0|3,0,0]=4 515 B5R0.1 CCNC(O)=S Amb24612743 [1,0,0,0,0,0|1,1,0]=3 516 B5R0.1 CCOC(=C)Cl Amb25768135 [1,0,0,0,0,0|3,0,0]=4 517 B5R0.1 CCOC(=N)N Amb16231402 [1,0,0,0,0,0|3,0,0]=4 518 B5R0.1 CCOC(=S)N Amb10241338 [1,0,0,0,0,0|2,1,0]=4 519 B5R0.1 CCOC(C)=S Amb22047276 [1,0,0,0,0,0|2,1,0]=4 520 B5R0.1 CCOC(C)C Amb22230687 [1,0,0,0,0,0|2,0,1]=4 521 B5R0.1 CCOC(O)O Amb24749789 [1,0,0,0,0,0|1,0,2]=4 522 B5R0.1 CCOC(S)=S Amb17938960 [1,0,0,0,0,0|1,2,0]=4 523 B5R0.1 CCOC(S)=S Amb22274286 [1,0,0,0,0,0|1,2,0]=4 524 B5R0.1 CCOC([13CH3])=O Amb22363103 [1,0,0,0,0,0|2,0,0]=3 525 B5R0.1 CCOC([S-])=S Amb22729921 [1,0,0,0,0,0|1,2,0]=4 526 B5R0.1 CCOP(=O)=O Amb25808749 [1,0,0,0,0,0|2,0,1]=4 527 B5R0.1 CCOP(=O)S Amb24540781 [1,0,0,0,0,0|2,1,0]=4 528 B5R0.1 CCOP(C)=O Amb17673512 [1,0,0,0,0,0|3,0,0]=4 529 B5R0.1 CCOP(O)=O Amb22360741 [1,0,0,0,0,0|2,0,0]=3 530 B5R0.1 CCOP(O)O Amb25348821 [1,0,0,0,0,0|2,0,1]=4 531 B5R0.1 CCOP([O-])=O Amb22731647 [1,0,0,0,0,0|2,0,1]=4 532 B5R0.1 CCOS(=O)Cl Amb25239825 [1,0,0,0,0,0|3,0,0]=4 533 B5R0.1 CCO[13C](C)=O Amb22363160 [1,0,0,0,0,0|2,0,0]=3 534 B5R0.1 CCO[13C]([13CH3])=O Amb22351310 [1,0,0,0,0,0|2,0,0]=3 535 B5R0.1 CCO[14C](N)=O Amb22732757 [1,0,0,0,0,0|2,0,0]=3 536 B5R0.1 CCO[N+]([O-])=O Amb22732543 [1,0,0,0,0,0|2,0,1]=4 537 B5R0.1 CCSC(=N)N Amb16205363 [1,0,0,0,0,0|3,0,0]=4 538 B5R0.1 CCSC(=N)[NH3+] Amb24113877 [1,0,0,0,0,0|3,0,0]=4 539 B5R0.1 CCSC(C)C Amb22731934 [1,0,0,0,0,0|2,0,1]=4 540 B5R0.1 CCSC(N)=O Amb24394612 [1,0,0,0,0,0|2,0,0]=3 541 B5R0.1 CCSC(O)O Amb25788582 [1,0,0,0,0,0|1,0,2]=4 542 B5R0.1 CC[13CH2]C(O)=O Amb22367520 [1,0,0,0,0,0|0,0,0]=1 543 B5R0.1 CC[13CH2]C([O-])=O Amb22351787 [1,0,0,0,0,0|0,0,1]=2 544 B5R0.1 CC[13CH2][13C](O)=O Amb22351790 [1,0,0,0,0,0|0,0,0]=1 545 B5R0.1 CC[O+]=C(N)N Amb22492446 [1,0,0,0,0,0|3,0,0]=4 546 B5R0.1 CN(C)CC=O Amb22002191 [1,0,0,0,0,0|1,0,0]=2 547 B5R0.1 CN(C)CC=O Amb22491245 [1,0,0,0,0,0|1,0,0]=2 548 B5R0.1 CN(C)CC=O Amb22491584 [1,0,0,0,0,0|1,0,0]=2 549 B5R0.1 CN(C)CC=O Amb22756473 [1,0,0,0,0,0|1,0,0]=2 550 B5R0.1 CN(C)CC=O Amb23440511 [1,0,0,0,0,0|1,0,0]=2 551 B5R0.1 CN(C)CCBr Amb22756040 [1,0,0,0,0,0|2,0,1]=4 552 B5R0.1 CN(C)CCCl Amb22233801 [1,0,0,0,0,0|2,0,1]=4 553 B5R0.1 CN(C)CC[O-] Amb22731918 [1,0,0,0,0,0|1,0,2]=4 554 B5R0.1 CN(C)CC[O-] Amb22734831 [1,0,0,0,0,0|1,0,2]=4 555 B5R0.1 CN(C)\C=C\Cl Amb24670513 [1,0,0,0,0,0|2,0,1]=4 556 B5R0.1 CN(O)CCO Amb25234570 [1,0,0,0,0,0|2,0,1]=4 557 B5R0.1 CN=CC(C)=O Amb25746654 [1,0,0,0,0,0|2,0,1]=4 558 B5R0.1 CNCC(=C)Br Amb18950247 [1,0,0,0,0,0|3,0,0]=4 559 B5R0.1 CNCC(=C)Cl Amb18281327 [1,0,0,0,0,0|3,0,0]=4 560 B5R0.1 CNCC(=O)C Amb17621974 [1,0,0,0,0,0|2,0,0]=3 561 B5R0.1 CNCC(=O)N Amb10610205 [1,0,0,0,0,0|2,0,0]=3 562 B5R0.1 CNCC(=S)N Amb17231807 [1,0,0,0,0,0|2,1,0]=4 563 B5R0.1 CNCC(C)=O Amb21959975 [1,0,0,0,0,0|2,0,0]=3 564 B5R0.1 CNCC(C)Br Amb24731625 [1,0,0,0,0,0|3,0,0]=4 565 B5R0.1 CNCC(C)C Amb1119103 [1,0,0,0,0,0|2,0,0]=3 566 B5R0.1 CNCC(C)C Amb13951443 [1,0,0,0,0,0|2,0,0]=3 567 B5R0.1 CNCC(C)F Amb24354896 [1,0,0,0,0,0|3,0,0]=4 568 B5R0.1 CNCC(C)N Amb18281800 [1,0,0,0,0,0|3,0,0]=4 569 B5R0.1 CNCC(C)N Amb20629142 [1,0,0,0,0,0|3,0,0]=4 570 B5R0.1 CNCC(C)S Amb18640506 [1,0,0,0,0,0|3,0,0]=4 571 B5R0.1 CNCC([O-])=O Amb20246714 [1,0,0,0,0,0|1,0,1]=3 572 B5R0.1 CNCN(C)C Amb24763670 [1,0,0,0,0,0|3,0,0]=4 573 B5R0.1 CNCP(O)=O Amb24478116 [1,0,0,0,0,0|2,0,0]=3 574 B5R0.1 CNOC(C)=O Amb24323679 [1,0,0,0,0,0|3,0,0]=4 575 B5R0.1 CNOC(C)=O Amb24629247 [1,0,0,0,0,0|3,0,0]=4 576 B5R0.1 CNOC(C)C Amb25272672 [1,0,0,0,0,0|3,0,0]=4 577 B5R0.1 COCC(=C)Br Amb25361496 [1,0,0,0,0,0|3,0,0]=4 578 B5R0.1 COCC(=O)Br Amb25282928 [1,0,0,0,0,0|2,0,0]=3 579 B5R0.1 COCC(=O)N Amb1153776 [1,0,0,0,0,0|2,0,0]=3 580 B5R0.1 COCC(C)=S Amb25108516 [1,0,0,0,0,0|2,1,0]=4 581 B5R0.1 COCC(C)Br Amb18180533 [1,0,0,0,0,0|3,0,0]=4 582 B5R0.1 COCC(C)Cl Amb24061175 [1,0,0,0,0,0|3,0,0]=4 583 B5R0.1 COCC(C)I Amb25361647 [1,0,0,0,0,0|3,0,0]=4 584 B5R0.1 COCC(C)N Amb22233778 [1,0,0,0,0,0|3,0,0]=4 585 B5R0.1 COCN(C)C Amb24407205 [1,0,0,0,0,0|3,0,0]=4 586 B5R0.1 COC[C@@H](C)N Amb18529651 [1,0,0,0,0,0|3,0,0]=4 587 B5R0.1 COC[C@@H](C)N Amb19149178 [1,0,0,0,0,0|3,0,0]=4 588 B5R0.1 COC[C@@H](N)C Amb17061637 [1,0,0,0,0,0|3,0,0]=4 589 B5R0.1 COC[C@H](C)N Amb24052963 [1,0,0,0,0,0|3,0,0]=4 590 B5R0.1 CONC(=O)N Amb2417193 [1,0,0,0,0,0|3,0,0]=4 591 B5R0.1 CONC(C)=O Amb25046114 [1,0,0,0,0,0|3,0,0]=4 592 B5R0.1 CONC(C)C Amb20668193 [1,0,0,0,0,0|3,0,0]=4 593 B5R0.1 CONC(C)C Amb22897032 [1,0,0,0,0,0|3,0,0]=4 594 B5R0.1 CONC(C)C Amb24333864 [1,0,0,0,0,0|3,0,0]=4 595 B5R0.1 CS(=O)CC=O Amb25173706 [1,0,0,0,0,0|2,0,0]=3 596 B5R0.1 CS(=O)CCCl Amb24116979 [1,0,0,0,0,0|3,0,0]=4 597 B5R0.1 CS(=O)CCN Amb19889121 [1,0,0,0,0,0|3,0,0]=4 598 B5R0.1 CS(=O)CCN Amb20248083 [1,0,0,0,0,0|3,0,0]=4 599 B5R0.1 CSCC(=O)Cl Amb24528357 [1,0,0,0,0,0|2,0,0]=3 600 B5R0.1 CSCC(=O)O Amb1152425 [1,0,0,0,0,0|1,0,0]=2 601 B5R0.1 CSCC(=S)N Amb17503394 [1,0,0,0,0,0|2,1,0]=4 602 B5R0.1 CSCC(C)=C Amb20671946 [1,0,0,0,0,0|3,0,0]=4 603 B5R0.1 CSCC(C)=O Amb20621731 [1,0,0,0,0,0|2,0,0]=3 604 B5R0.1 CSCC(C)Br Amb25857964 [1,0,0,0,0,0|3,0,0]=4 605 B5R0.1 CSCC(C)Cl Amb24626062 [1,0,0,0,0,0|3,0,0]=4 606 B5R0.1 CSCC(C)N Amb18963391 [1,0,0,0,0,0|3,0,0]=4 607 B5R0.1 CSCC(C)O Amb20622311 [1,0,0,0,0,0|2,0,1]=4 608 B5R0.1 CSCC(N)=O Amb19515874 [1,0,0,0,0,0|2,0,0]=3 609 B5R0.1 CSCN(C)C Amb19889371 [1,0,0,0,0,0|3,0,0]=4 610 B5R0.1 CSCS(C)=O Amb22045140 [1,0,0,0,0,0|3,0,0]=4 611 B5R0.1 CSC[C@@H](C)O Amb24408899 [1,0,0,0,0,0|2,0,1]=4 612 B5R0.1 CSC[C@H](C)O Amb24699036 [1,0,0,0,0,0|2,0,1]=4 613 B5R0.1 CSNC(C)=O Amb22500292 [1,0,0,0,0,0|3,0,0]=4 614 B5R0.1 CSNC(N)=O Amb25810134 [1,0,0,0,0,0|3,0,0]=4 615 B5R0.1 C[13CH2]CC([O-])=O Amb22367521 [1,0,0,0,0,0|0,0,1]=2 616 B5R0.1 C[Al](C)C[Ti]Cl Amb22735005 [1,0,0,0,0,0|3,0,0]=4 617 B5R0.1 C[C@@H](Cl)CC=C Amb25123337 [1,0,0,0,0,0|2,0,0]=3 618 B5R0.1 C[C@@H](Cl)CCCl Amb25072661 [1,0,0,0,0,0|2,0,1]=4 619 B5R0.1 C[C@@H](Cl)CCO Amb24478443 [1,0,0,0,0,0|1,0,1]=3 620 B5R0.1 C[C@@H](F)CCBr Amb24552891 [1,0,0,0,0,0|2,0,1]=4 621 B5R0.1 C[C@@H](N)CC#N Amb22823160 [1,0,0,0,0,0|2,0,1]=4 622 B5R0.1 C[C@@H](N)CC#N Amb24183330 [1,0,0,0,0,0|2,0,1]=4 623 B5R0.1 C[C@@H](N)CCBr Amb25690979 [1,0,0,0,0,0|2,0,1]=4 624 B5R0.1 C[C@@H](N)CCCl Amb24550613 [1,0,0,0,0,0|2,0,1]=4 625 B5R0.1 C[C@@H](N)CCO Amb19515999 [1,0,0,0,0,0|1,0,1]=3 626 B5R0.1 C[C@@H](N)CCO Amb22746127 [1,0,0,0,0,0|1,0,1]=3 627 B5R0.1 C[C@@H](O)C=C=O Amb25146481 [1,0,0,0,0,0|1,0,2]=4 628 B5R0.1 C[C@@H](O)CC#N Amb22224888 [1,0,0,0,0,0|2,0,1]=4 629 B5R0.1 C[C@@H](O)CC=C Amb22225370 [1,0,0,0,0,0|2,0,0]=3 630 B5R0.1 C[C@@H](O)CC=O Amb24356009 [1,0,0,0,0,0|1,0,0]=2 631 B5R0.1 C[C@@H](O)CCCl Amb24565032 [1,0,0,0,0,0|2,0,1]=4 632 B5R0.1 C[C@@H](O)CCN Amb22736702 [1,0,0,0,0,0|2,0,1]=4 633 B5R0.1 C[C@@H](O)\C=C\I Amb24334105 [1,0,0,0,0,0|2,0,1]=4 634 B5R0.1 C[C@H](Br)CCBr Amb24528250 [1,0,0,0,0,0|2,0,1]=4 635 B5R0.1 C[C@H](Cl)CC=C Amb24626620 [1,0,0,0,0,0|2,0,0]=3 636 B5R0.1 C[C@H](Cl)CCCl Amb25745563 [1,0,0,0,0,0|2,0,1]=4 637 B5R0.1 C[C@H](N)CC#N Amb25304255 [1,0,0,0,0,0|2,0,1]=4 638 B5R0.1 C[C@H](N)CCBr Amb24634172 [1,0,0,0,0,0|2,0,1]=4 639 B5R0.1 C[C@H](N)CCN Amb24393216 [1,0,0,0,0,0|2,0,1]=4 640 B5R0.1 C[C@H](N)CCO Amb19515998 [1,0,0,0,0,0|1,0,1]=3 641 B5R0.1 C[C@H](N)CCO Amb24055217 [1,0,0,0,0,0|1,0,1]=3 642 B5R0.1 C[C@H](O)CC#N Amb22736701 [1,0,0,0,0,0|2,0,1]=4 643 B5R0.1 C[C@H](O)CC=C Amb22226758 [1,0,0,0,0,0|2,0,0]=3 644 B5R0.1 C[C@H](O)CCI Amb24675161 [1,0,0,0,0,0|2,0,1]=4 645 B5R0.1 C[C@H](O)CCN Amb22736705 [1,0,0,0,0,0|2,0,1]=4 646 B5R0.1 C[C@H](O)CON Amb24557560 [1,0,0,0,0,0|3,0,0]=4 647 B5R0.1 C[NH+](C)CCO Amb22493791 [1,0,0,0,0,0|1,0,1]=3 648 B5R0.1 C[S+](C)CC#C Amb24564323 [1,0,0,0,0,0|2,0,1]=4 649 B5R0.1 C[S+](C)CCCl Amb22496543 [1,0,0,0,0,0|2,0,1]=4 650 B5R0.1 C[S+](C)CCO Amb24420852 [1,0,0,0,0,0|1,0,1]=3 651 B5R0.1 C[SiH](C)CC=C Amb19930034 [1,0,0,0,0,0|1,1,0]=3 652 B5R0.1 C[SiH](C)CCO Amb25184701 [1,0,0,0,0,0|0,1,1]=3 653 B5R0.1 C\C(\Br)=C\C=O Amb18124620 [1,0,0,0,0,0|1,0,2]=4 654 B5R0.1 C\C(\Cl)=C/C=O Amb18640408 [1,0,0,0,0,0|1,0,2]=4 655 B5R0.1 C\C(\I)=C/C=O Amb25095164 [1,0,0,0,0,0|1,0,2]=4 656 B5R0.1 C\C(\I)=C\C=O Amb24424054 [1,0,0,0,0,0|1,0,2]=4 657 B5R0.1 C\C=C/C(C)C Amb20618870 [1,0,0,0,0,0|1,0,1]=3 658 B5R0.1 C\C=C\C(=O)Br Amb25026006 [1,0,0,0,0,0|1,0,2]=4 659 B5R0.1 C\C=C\C(C)Br Amb24725263 [1,0,0,0,0,0|2,0,1]=4 660 B5R0.1 C\C=C\C(C)Cl Amb24377224 [1,0,0,0,0,0|2,0,1]=4 661 B5R0.1 C\C=C\C(C)F Amb24733620 [1,0,0,0,0,0|2,0,1]=4 662 B5R0.1 C\C=C\C(C)I Amb25061857 [1,0,0,0,0,0|2,0,1]=4 663 B5R0.1 C\C=C\C([O-])=O Amb22231404 [1,0,0,0,0,0|0,0,3]=4 664 B5R0.1 C\C=C\[C@@H](C)Cl Amb24692647 [1,0,0,0,0,0|2,0,1]=4 665 B5R0.1 C\C=C\[C@H](C)Cl Amb24332071 [1,0,0,0,0,0|2,0,1]=4 666 B5R0.1 C\C=C\[C@H](C)O Amb25145549 [1,0,0,0,0,0|2,0,1]=4 667 B5R0.1 ClC(=O)CC#N Amb17593096 [1,0,0,0,0,0|2,0,1]=4 668 B5R0.1 ClCCN(C)C Amb1152528 [1,0,0,0,0,0|2,0,1]=4 669 B5R0.1 ClCCN(C)C Amb2519363 [1,0,0,0,0,0|2,0,1]=4 670 B5R0.1 N#CCC(O)=O Amb20247050 [1,0,0,0,0,0|1,0,1]=3 671 B5R0.1 N#CCS(O)=O Amb25232047 [1,0,0,0,0,0|2,0,1]=4 672 B5R0.1 N#C[13CH2][13C]([O-])=O Amb22054790 [1,0,0,0,0,0|1,0,2]=4 673 B5R0.1 NC(=N)CCCl Amb25839424 [1,0,0,0,0,0|3,0,0]=4 674 B5R0.1 NC(=N)CCS Amb25126101 [1,0,0,0,0,0|3,0,0]=4 675 B5R0.1 NC(=O)CC=C Amb17610156 [1,0,0,0,0,0|1,0,2]=4 676 B5R0.1 NC(=O)CC=O Amb25777522 [1,0,0,0,0,0|2,0,1]=4 677 B5R0.1 NC(=O)CCBr Amb21618712 [1,0,0,0,0,0|2,0,0]=3 678 B5R0.1 NC(=O)CCCl Amb1127569 [1,0,0,0,0,0|2,0,0]=3 679 B5R0.1 NC(=O)CNO Amb25199017 [1,0,0,0,0,0|3,0,0]=4 680 B5R0.1 NC(=O)NCCl Amb25130799 [1,0,0,0,0,0|3,0,0]=4 681 B5R0.1 NC(=O)NCO Amb17674341 [1,0,0,0,0,0|3,0,0]=4 682 B5R0.1 NC(=O)OCCl Amb24681219 [1,0,0,0,0,0|3,0,0]=4 683 B5R0.1 NC(=O)OCI Amb25146422 [1,0,0,0,0,0|3,0,0]=4 684 B5R0.1 NC(=O)OCO Amb25662384 [1,0,0,0,0,0|3,0,0]=4 685 B5R0.1 NC(=S)CCS Amb17503271 [1,0,0,0,0,0|2,1,0]=4 686 B5R0.1 NCCC(=O)Cl Amb24117140 [1,0,0,0,0,0|2,0,0]=3 687 B5R0.1 NCCC(=O)N Amb1137251 [1,0,0,0,0,0|2,0,0]=3 688 B5R0.1 NCCC(=O)O Amb1935127 [1,0,0,0,0,0|1,0,0]=2 689 B5R0.1 NCCC(N)=S Amb18523221 [1,0,0,0,0,0|2,1,0]=4 690 B5R0.1 NCCC(N)O Amb24657290 [1,0,0,0,0,0|2,0,1]=4 691 B5R0.1 NCCP(O)=O Amb22168066 [1,0,0,0,0,0|2,0,0]=3 692 B5R0.1 NCCS(=O)=O Amb25744074 [1,0,0,0,0,0|2,0,1]=4 693 B5R0.1 NCC[N+]([O-])=O Amb18203119 [1,0,0,0,0,0|2,0,1]=4 694 B5R0.1 NCOP(O)=O Amb24333271 [1,0,0,0,0,0|3,0,0]=4 695 B5R0.1 NNCC(C)C Amb1105732 [1,0,0,0,0,0|2,0,0]=3 696 B5R0.1 NOCC(=O)O Amb1154237 [1,0,0,0,0,0|2,0,0]=3 697 B5R0.1 NOCC(N)=O Amb22059481 [1,0,0,0,0,0|3,0,0]=4 698 B5R0.1 NS(=O)CCCl Amb24407159 [1,0,0,0,0,0|3,0,0]=4 699 B5R0.1 N[C@H](O)CCO Amb24421109 [1,0,0,0,0,0|2,0,1]=4 700 B5R0.1 N\N=C\C(O)=O Amb25703365 [1,0,0,0,0,0|2,0,1]=4 701 B5R0.1 O=C(Br)CCBr Amb24624022 [1,0,0,0,0,0|2,0,0]=3 702 B5R0.1 O=C(Br)CCCl Amb24474527 [1,0,0,0,0,0|2,0,0]=3 703 B5R0.1 O=C(F)NCF Amb24478456 [1,0,0,0,0,0|3,0,0]=4 704 B5R0.1 O=C(I)CCCl Amb25146462 [1,0,0,0,0,0|2,0,0]=3 705 B5R0.1 O=CCC(Br)Br Amb25026607 [1,0,0,0,0,0|2,0,0]=3 706 B5R0.1 O=CNN(C)C Amb1930732 [1,0,0,0,0,0|2,0,0]=3 707 B5R0.1 O=COC(Cl)Cl Amb24525151 [1,0,0,0,0,0|3,0,0]=4 708 B5R0.1 O=S(Cl)CCBr Amb24563387 [1,0,0,0,0,0|3,0,0]=4 709 B5R0.1 OC(=O)C#CBr Amb17593707 [1,0,0,0,0,0|1,0,2]=4 710 B5R0.1 OC(=O)C#CCl Amb17593098 [1,0,0,0,0,0|1,0,2]=4 711 B5R0.1 OC(=O)C#CI Amb25274128 [1,0,0,0,0,0|1,0,2]=4 712 B5R0.1 OC(=O)C=C=O Amb24671304 [1,0,0,0,0,0|1,0,2]=4 713 B5R0.1 OC(=O)CC=O Amb22169407 [1,0,0,0,0,0|1,0,1]=3 714 B5R0.1 OC(=O)CCF Amb10603694 [1,0,0,0,0,0|1,0,0]=2 715 B5R0.1 OC(=O)CI=O Amb25146428 [1,0,0,0,0,0|2,0,0]=3 716 B5R0.1 OC(=O)CNBr Amb25053433 [1,0,0,0,0,0|2,0,0]=3 717 B5R0.1 OC(=O)CNCl Amb24653229 [1,0,0,0,0,0|2,0,0]=3 718 B5R0.1 OC(=O)CNI Amb25216175 [1,0,0,0,0,0|2,0,0]=3 719 B5R0.1 OC(=O)CSCl Amb24597301 [1,0,0,0,0,0|2,0,0]=3 720 B5R0.1 OC(=O)C[Hg]Cl Amb22347659 [1,0,0,0,0,0|2,0,0]=3 721 B5R0.1 OC(=O)\C=C/Br Amb18644453 [1,0,0,0,0,0|1,0,2]=4 722 B5R0.1 OC(=O)\C=C\F Amb24417763 [1,0,0,0,0,0|1,0,2]=4 723 B5R0.1 OC(=O)\C=C\I Amb20242758 [1,0,0,0,0,0|1,0,2]=4 724 B5R0.1 OC(O)CC=S Amb24478084 [1,0,0,0,0,0|2,1,0]=4 725 B5R0.1 OC(O)CCS Amb25746150 [1,0,0,0,0,0|1,0,2]=4 726 B5R0.1 OCCC(Cl)Cl Amb24563836 [1,0,0,0,0,0|2,0,1]=4 727 B5R0.1 OCCS(=O)=O Amb24474283 [1,0,0,0,0,0|2,0,1]=4 728 B5R0.1 OCOP(O)=O Amb24333194 [1,0,0,0,0,0|3,0,0]=4 729 B5R0.1 OCOS(O)=O Amb25106091 [1,0,0,0,0,0|3,0,0]=4 730 B5R0.1 ON=CC(O)=O Amb25046587 [1,0,0,0,0,0|2,0,1]=4 731 B5R0.1 ONCC(O)=O Amb24120360 [1,0,0,0,0,0|2,0,0]=3 732 B5R0.1 OP(=O)CC=O Amb25706451 [1,0,0,0,0,0|2,0,1]=4 733 B5R0.1 OP(=O)CCBr Amb24634095 [1,0,0,0,0,0|2,0,0]=3 734 B5R0.1 OP(=O)CCCl Amb24465178 [1,0,0,0,0,0|2,0,0]=3 735 B5R0.1 O\N=C/C(=O)O Amb10601571 [1,0,0,0,0,0|2,0,1]=4 736 B5R0.1 O\N=C\C(O)=O Amb20671938 [1,0,0,0,0,0|2,0,1]=4 737 B5R0.1 [13CH3]CCC([O-])=O Amb22351845 [1,0,0,0,0,0|0,0,1]=2 738 B5R0.1 [13CH3]C[13CH2]C([O-])=O Amb22351704 [1,0,0,0,0,0|0,0,1]=2 739 B5R0.1 [13CH3][13CH2][13CH2][13C]([O-])=O Amb22353296 [1,0,0,0,0,0|0,0,1]=2 740 B5R0.1 [15NH2]C[13CH2][13C](O)=O Amb22353834 [1,0,0,0,0,0|1,0,0]=2 741 B5R0.1 [15NH2][13CH2][13CH2][13C](O)=O Amb22353457 [1,0,0,0,0,0|1,0,0]=2 742 B5R0.1 [2H]C(=O)OCC Amb22336312 [1,0,0,0,0,0|2,0,0]=3 743 B5R0.1 [C-]#[N+]CC(C)C Amb22900913 [1,0,0,0,0,0|2,0,0]=3 744 B5R0.1 [C-]#[N+]CC(C)O Amb25810214 [1,0,0,0,0,0|3,0,0]=4 745 B5R0.1 [N-]=[N+]=CC(O)=O Amb24333367 [1,0,0,0,0,0|2,0,1]=4 746 B5R0.1 [O-]C(=O)CCBr Amb22229633 [1,0,0,0,0,0|1,0,1]=3 747 B5R0.1 [O-]C(=O)CCCl Amb10604124 [1,0,0,0,0,0|1,0,1]=3 748 B5R0.1 [O-]C(=O)CCCl Amb22051669 [1,0,0,0,0,0|1,0,1]=3 749 B5R0.1 [O-]C(=O)CCO Amb22055495 [1,0,0,0,0,0|1,0,1]=3 750 B5R0.1 [O-]S(=O)CCBr Amb24442971 [1,0,0,0,0,0|2,0,1]=4 751 B5R0.1 [O-][N+](=O)CCF Amb17674352 [1,0,0,0,0,0|2,0,1]=4 752 B5R0.1 [S-]C(=S)OCC Amb10789364 [1,0,0,0,0,0|1,2,0]=4 753 B7R0.2 BrCC(=O)C=C(C)C Amb17594501 [0,1,0,0,0,0|1,0,2]=4 754 B7R0.2 BrCC(=O)NC(C)C Amb2090260 [0,1,0,0,0,0|2,0,0]=3 755 B7R0.2 C#CC(N)CC(O)=O Amb24529562 [0,1,0,0,0,0|1,0,1]=3 756 B7R0.2 C#CC(O)CC(O)=O Amb25737576 [0,1,0,0,0,0|1,0,1]=3 757 B7R0.2 C=C(Br)C[C@H](O)CO Amb25369386 [0,1,0,0,0,0|3,0,0]=4 758 B7R0.2 C=C(CC(O)=O)C#C Amb24568901 [0,1,0,0,0,0|0,0,3]=4 759 B7R0.2 C=C(CC(O)=O)C=C Amb24561923 [0,1,0,0,0,0|0,0,3]=4 760 B7R0.2 C=C(Cl)CC(O)CO Amb24482396 [0,1,0,0,0,0|3,0,0]=4 761 B7R0.2 C=C(Cl)C[C@H](O)CO Amb24560451 [0,1,0,0,0,0|3,0,0]=4 762 B7R0.2 C=CC(Br)CC(O)=O Amb18125534 [0,1,0,0,0,0|1,0,1]=3 763 B7R0.2 C=CC(Cl)CC(O)=O Amb18124408 [0,1,0,0,0,0|1,0,1]=3 764 B7R0.2 C=CC(F)CC(O)=O Amb25359137 [0,1,0,0,0,0|1,0,1]=3 765 B7R0.2 C=CC(N)CC(O)=O Amb22641963 [0,1,0,0,0,0|1,0,1]=3 766 B7R0.2 C=CC(O)CC(N)=O Amb25799663 [0,1,0,0,0,0|2,0,1]=4 767 B7R0.2 C=CC(O)CC(O)=O Amb18641866 [0,1,0,0,0,0|1,0,1]=3 768 B7R0.2 C=CN(Br)CC(O)=O Amb24629979 [0,1,0,0,0,0|2,0,1]=4 769 B7R0.2 C=C[C@@H](O)CC(O)=O Amb25314661 [0,1,0,0,0,0|1,0,1]=3 770 B7R0.2 C=C[C@H](O)CC(O)=O Amb25844309 [0,1,0,0,0,0|1,0,1]=3 771 B7R0.2 CC(=C)CC(=O)CN Amb24621765 [0,1,0,0,0,0|1,0,2]=4 772 B7R0.2 CC(=C)CC(=O)NC Amb24741594 [0,1,0,0,0,0|1,0,2]=4 773 B7R0.2 CC(=C)CC(N)CO Amb24665584 [0,1,0,0,0,0|3,0,0]=4 774 B7R0.2 CC(=C)CC(O)CCl Amb25322238 [0,1,0,0,0,0|3,0,0]=4 775 B7R0.2 CC(=C)C[C@H](O)CO Amb25235652 [0,1,0,0,0,0|3,0,0]=4 776 B7R0.2 CC(=C)NC(=O)OC Amb24418498 [0,1,0,0,0,0|1,0,2]=4 777 B7R0.2 CC(=CC(C)=O)NC Amb25850096 [0,1,0,0,0,0|1,0,2]=4 778 B7R0.2 CC(=CC(C)=O)OC Amb24583696 [0,1,0,0,0,0|1,0,2]=4 779 B7R0.2 CC(=CC(N)=O)OC Amb25128053 [0,1,0,0,0,0|1,0,2]=4 780 B7R0.2 CC(=CC(O)=O)C#C Amb25687994 [0,1,0,0,0,0|0,0,3]=4 781 B7R0.2 CC(=CC(O)=O)C=O Amb25378040 [0,1,0,0,0,0|0,0,3]=4 782 B7R0.2 CC(=CC(O)=O)OC Amb24699194 [0,1,0,0,0,0|0,0,2]=3 783 B7R0.2 CC(=N)CC(=O)CC Amb24734350 [0,1,0,0,0,0|2,0,1]=4 784 B7R0.2 CC(=N)NC(=O)OC Amb25189033 [0,1,0,0,0,0|2,0,1]=4 785 B7R0.2 CC(=O)CC(=C)CCl Amb25092223 [0,1,0,0,0,0|1,0,2]=4 786 B7R0.2 CC(=O)CC(=N)CF Amb25087799 [0,1,0,0,0,0|2,0,1]=4 787 B7R0.2 CC(=O)CC(=N)NC Amb24096720 [0,1,0,0,0,0|2,0,1]=4 788 B7R0.2 CC(=O)CC(=O)C#N Amb25328629 [0,1,0,0,0,0|2,0,1]=4 789 B7R0.2 CC(=O)CC(=O)CBr Amb24442011 [0,1,0,0,0,0|2,0,1]=4 790 B7R0.2 CC(=O)CC(=O)NN Amb24677298 [0,1,0,0,0,0|2,0,1]=4 791 B7R0.2 CC(=O)CC(=O)NO Amb24096625 [0,1,0,0,0,0|1,0,1]=3 792 B7R0.2 CC(=O)CC(=O)SC Amb24097115 [0,1,0,0,0,0|1,1,1]=4 793 B7R0.2 CC(=O)CC(=S)C=O Amb25142738 [0,1,0,0,0,0|1,1,1]=4 794 B7R0.2 CC(=O)CC(=S)CC Amb24378474 [0,1,0,0,0,0|2,0,1]=4 795 B7R0.2 CC(=O)CC(=S)NC Amb24096719 [0,1,0,0,0,0|2,0,1]=4 796 B7R0.2 CC(=O)CC(=S)OC Amb24096829 [0,1,0,0,0,0|1,1,1]=4 797 B7R0.2 CC(=O)CC(Cl)CCl Amb25335495 [0,1,0,0,0,0|2,0,0]=3 798 B7R0.2 CC(=O)CC(O)C#C Amb24690832 [0,1,0,0,0,0|2,0,1]=4 799 B7R0.2 CC(=O)CC(O)C=C Amb25103770 [0,1,0,0,0,0|2,0,1]=4 800 B7R0.2 CC(=O)CC(O)C=O Amb24481554 [0,1,0,0,0,0|1,0,2]=4 801 B7R0.2 CC(=O)CC(O)CO Amb25304727 [0,1,0,0,0,0|2,0,0]=3 802 B7R0.2 CC(=O)CC(S)C=O Amb25838806 [0,1,0,0,0,0|2,0,1]=4 803 B7R0.2 CC(=O)CN(C)C=O Amb25134136 [0,1,0,0,0,0|2,0,1]=4 804 B7R0.2 CC(=O)C[C@@H](O)CO Amb24640954 [0,1,0,0,0,0|2,0,0]=3 805 B7R0.2 CC(=O)C[C@H](O)C=C Amb25051451 [0,1,0,0,0,0|2,0,1]=4 806 B7R0.2 CC(=O)C[C@H](O)CCl Amb25810138 [0,1,0,0,0,0|2,0,0]=3 807 B7R0.2 CC(=O)C\C(\Cl)=C/C Amb24553550 [0,1,0,0,0,0|2,0,1]=4 808 B7R0.2 CC(=O)C\C(\Cl)=C\C Amb25834378 [0,1,0,0,0,0|2,0,1]=4 809 B7R0.2 CC(=O)NC(=O)OC Amb24657097 [0,1,0,0,0,0|2,0,1]=4 810 B7R0.2 CC(=O)OC(Br)CBr Amb21520423 [0,1,0,0,0,0|3,0,0]=4 811 B7R0.2 CC(=O)OC(Cl)CBr Amb25843189 [0,1,0,0,0,0|3,0,0]=4 812 B7R0.2 CC(=O)OC(Cl)CCl Amb22729073 [0,1,0,0,0,0|3,0,0]=4 813 B7R0.2 CC(Br)CC(=O)CCl Amb24621526 [0,1,0,0,0,0|2,0,0]=3 814 B7R0.2 CC(C#C)NC(C)=O Amb24382534 [0,1,0,0,0,0|2,0,1]=4 815 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [0,1,0,0,0,0|0,0,1]=2 816 B7R0.2 CC(C#N)NC(=O)C Amb17399792 [0,1,0,0,0,0|2,0,1]=4 817 B7R0.2 CC(C#N)NC(N)=O Amb25290804 [0,1,0,0,0,0|2,0,1]=4 818 B7R0.2 CC(C#N)OC(=O)C Amb17593174 [0,1,0,0,0,0|2,0,1]=4 819 B7R0.2 CC(C#N)SC(N)=O Amb24746653 [0,1,0,0,0,0|2,0,1]=4 820 B7R0.2 CC(C)=CC(=O)C=C Amb21962941 [0,1,0,0,0,0|1,0,2]=4 821 B7R0.2 CC(C)=CC(=O)C=O Amb24418075 [0,1,0,0,0,0|0,0,3]=4 822 B7R0.2 CC(C)=CC(=O)CC Amb25715052 [0,1,0,0,0,0|1,0,2]=4 823 B7R0.2 CC(C)=CC(=O)CN Amb25727127 [0,1,0,0,0,0|1,0,2]=4 824 B7R0.2 CC(C)=CC(=O)NN Amb25688561 [0,1,0,0,0,0|1,0,2]=4 825 B7R0.2 CC(C)=CC(C)=NO Amb25801047 [0,1,0,0,0,0|1,0,2]=4 826 B7R0.2 CC(C)CC(=C)C=O Amb24481535 [0,1,0,0,0,0|1,0,0]=2 827 B7R0.2 CC(C)CC(=C)CBr Amb25701224 [0,1,0,0,0,0|2,0,0]=3 828 B7R0.2 CC(C)CC(=C)CN Amb25709984 [0,1,0,0,0,0|2,0,0]=3 829 B7R0.2 CC(C)CC(=O)C=O Amb25189904 [0,1,0,0,0,0|0,0,1]=2 830 B7R0.2 CC(C)CC(=O)CBr Amb22396854 [0,1,0,0,0,0|1,0,0]=2 831 B7R0.2 CC(C)CC(=O)CCl Amb20622841 [0,1,0,0,0,0|1,0,0]=2 832 B7R0.2 CC(C)CC(=O)CF Amb23454719 [0,1,0,0,0,0|1,0,0]=2 833 B7R0.2 CC(C)CC(=O)CN Amb18641847 [0,1,0,0,0,0|1,0,0]=2 834 B7R0.2 CC(C)CC(=O)CO Amb18559774 [0,1,0,0,0,0|0,0,0]=1 835 B7R0.2 CC(C)CC(Br)CC Amb24346666 [0,1,0,0,0,0|2,0,1]=4 836 B7R0.2 CC(C)CC(C)=CBr Amb24692942 [0,1,0,0,0,0|2,0,0]=3 837 B7R0.2 CC(C)CC(C)=CCl Amb24692762 [0,1,0,0,0,0|2,0,0]=3 838 B7R0.2 CC(C)CC(C)C#C Amb24334125 [0,1,0,0,0,0|2,0,1]=4 839 B7R0.2 CC(C)CC(C)C=C Amb22229087 [0,1,0,0,0,0|2,0,1]=4 840 B7R0.2 CC(C)CC(C)C=O Amb18641813 [0,1,0,0,0,0|1,0,1]=3 841 B7R0.2 CC(C)CC(C)CBr Amb22641845 [0,1,0,0,0,0|2,0,1]=4 842 B7R0.2 CC(C)CC(C)CC Amb22228298 [0,1,0,0,0,0|2,0,1]=4 843 B7R0.2 CC(C)CC(C)CCl Amb25741744 [0,1,0,0,0,0|2,0,1]=4 844 B7R0.2 CC(C)CC(C)CO Amb22228341 [0,1,0,0,0,0|1,0,1]=3 845 B7R0.2 CC(C)CC(C)ON Amb24412592 [0,1,0,0,0,0|1,0,1]=3 846 B7R0.2 CC(C)CC(C)[Mg]Br Amb22897340 [0,1,0,0,0,0|2,0,1]=4 847 B7R0.2 CC(C)CC(C)[Zn]Br Amb22897526 [0,1,0,0,0,0|2,0,1]=4 848 B7R0.2 CC(C)CC(Cl)C=C Amb25295466 [0,1,0,0,0,0|2,0,1]=4 849 B7R0.2 CC(C)CC(Cl)C=O Amb24482192 [0,1,0,0,0,0|1,0,1]=3 850 B7R0.2 CC(C)CC(Cl)CCl Amb25840482 [0,1,0,0,0,0|2,0,1]=4 851 B7R0.2 CC(C)CC(Cl)CN Amb25794707 [0,1,0,0,0,0|2,0,1]=4 852 B7R0.2 CC(C)CC(Cl)CO Amb25783978 [0,1,0,0,0,0|1,0,1]=3 853 B7R0.2 CC(C)CC(F)CN Amb24387968 [0,1,0,0,0,0|2,0,1]=4 854 B7R0.2 CC(C)CC(F)CO Amb25189048 [0,1,0,0,0,0|1,0,1]=3 855 B7R0.2 CC(C)CC(N)C=C Amb25743094 [0,1,0,0,0,0|2,0,1]=4 856 B7R0.2 CC(C)CC(N)CBr Amb22493735 [0,1,0,0,0,0|2,0,1]=4 857 B7R0.2 CC(C)CC(N)CC Amb18523780 [0,1,0,0,0,0|2,0,1]=4 858 B7R0.2 CC(C)CC(N)CO Amb18015118 [0,1,0,0,0,0|1,0,1]=3 859 B7R0.2 CC(C)CC(O)C=C Amb24532138 [0,1,0,0,0,0|1,0,1]=3 860 B7R0.2 CC(C)CC(O)CBr Amb24483137 [0,1,0,0,0,0|1,0,1]=3 861 B7R0.2 CC(C)CC(O)CN Amb19515652 [0,1,0,0,0,0|1,0,1]=3 862 B7R0.2 CC(C)CC(O)CO Amb24731733 [0,1,0,0,0,0|0,0,2]=3 863 B7R0.2 CC(C)CC(O)CS Amb24718446 [0,1,0,0,0,0|0,1,1]=3 864 B7R0.2 CC(C)CC(S)CN Amb18251146 [0,1,0,0,0,0|1,1,1]=4 865 B7R0.2 CC(C)CN(C)C=O Amb25707804 [0,1,0,0,0,0|2,0,0]=3 866 B7R0.2 CC(C)C[C@@H](N)C#N Amb18542350 [0,1,0,0,0,0|2,0,1]=4 867 B7R0.2 CC(C)C[C@@H](N)C=O Amb25698367 [0,1,0,0,0,0|1,0,1]=3 868 B7R0.2 CC(C)C[C@@H](N)CBr Amb25189716 [0,1,0,0,0,0|2,0,1]=4 869 B7R0.2 CC(C)C[C@@H](N)CC Amb24675860 [0,1,0,0,0,0|2,0,1]=4 870 B7R0.2 CC(C)C[C@@H](N)CN Amb25345853 [0,1,0,0,0,0|2,0,1]=4 871 B7R0.2 CC(C)C[C@@H](N)CO Amb22746869 [0,1,0,0,0,0|1,0,1]=3 872 B7R0.2 CC(C)C[C@@H](O)C=O Amb25104909 [0,1,0,0,0,0|0,0,1]=2 873 B7R0.2 CC(C)C[C@@H](O)CC Amb25795362 [0,1,0,0,0,0|1,0,1]=3 874 B7R0.2 CC(C)C[C@H](Cl)C=O Amb24661911 [0,1,0,0,0,0|1,0,1]=3 875 B7R0.2 CC(C)C[C@H](Cl)CO Amb25334028 [0,1,0,0,0,0|1,0,1]=3 876 B7R0.2 CC(C)C[C@H](N)C#C Amb25378790 [0,1,0,0,0,0|2,0,1]=4 877 B7R0.2 CC(C)C[C@H](N)C=C Amb25745886 [0,1,0,0,0,0|2,0,1]=4 878 B7R0.2 CC(C)C[C@H](N)CBr Amb24462739 [0,1,0,0,0,0|2,0,1]=4 879 B7R0.2 CC(C)C[C@H](N)CO Amb22504556 [0,1,0,0,0,0|1,0,1]=3 880 B7R0.2 CC(C)C[C@H](N)CS Amb24392884 [0,1,0,0,0,0|1,1,1]=4 881 B7R0.2 CC(C)C[C@H](O)C#C Amb24363712 [0,1,0,0,0,0|1,0,1]=3 882 B7R0.2 CC(C)C[C@H](O)C#N Amb25855769 [0,1,0,0,0,0|1,0,1]=3 883 B7R0.2 CC(C)C\C(\C)=N\O Amb22729223 [0,1,0,0,0,0|1,0,0]=2 884 B7R0.2 CC(C)NC(=N)CCl Amb25113390 [0,1,0,0,0,0|3,0,0]=4 885 B7R0.2 CC(C)NC(=N)CS Amb25292184 [0,1,0,0,0,0|2,1,0]=4 886 B7R0.2 CC(C)NC(=O)C#C Amb23556960 [0,1,0,0,0,0|2,0,0]=3 887 B7R0.2 CC(C)NC(=O)CF Amb24671297 [0,1,0,0,0,0|2,0,0]=3 888 B7R0.2 CC(C)NC(=S)C#N Amb24594289 [0,1,0,0,0,0|2,1,0]=4 889 B7R0.2 CC(C)NC(O)CC Amb25844070 [0,1,0,0,0,0|2,0,1]=4 890 B7R0.2 CC(C)N[C@H](C)CO Amb25041061 [0,1,0,0,0,0|2,0,1]=4 891 B7R0.2 CC(C)OC(=N)NO Amb24518680 [0,1,0,0,0,0|2,0,0]=3 892 B7R0.2 CC(C)OC(=O)C#C Amb25345845 [0,1,0,0,0,0|2,0,0]=3 893 B7R0.2 CC(C)OC(=O)C=C Amb22734220 [0,1,0,0,0,0|2,0,0]=3 894 B7R0.2 CC(C)OC(=O)C=O Amb18641865 [0,1,0,0,0,0|1,0,1]=3 895 B7R0.2 CC(C)OC(=O)NN Amb19516135 [0,1,0,0,0,0|2,0,0]=3 896 B7R0.2 CC(C)OC(=S)S[K] Amb22169779 [0,1,0,0,0,0|1,2,0]=4 897 B7R0.2 CC(C)OC(C)C=O Amb25243083 [0,1,0,0,0,0|2,0,1]=4 898 B7R0.2 CC(C)OC(C)CO Amb22733844 [0,1,0,0,0,0|2,0,1]=4 899 B7R0.2 CC(C)OC(Cl)=CCl Amb25226872 [0,1,0,0,0,0|3,0,0]=4 900 B7R0.2 CC(C)OC(F)=CCl Amb24467858 [0,1,0,0,0,0|3,0,0]=4 901 B7R0.2 CC(C)OC(O)C#C Amb24534063 [0,1,0,0,0,0|2,0,1]=4 902 B7R0.2 CC(C)OC(O)CC Amb24457780 [0,1,0,0,0,0|2,0,1]=4 903 B7R0.2 CC(C)OS(=O)CCl Amb25726960 [0,1,0,0,0,0|3,0,0]=4 904 B7R0.2 CC(C)SC(=O)CN Amb24652697 [0,1,0,0,0,0|2,0,0]=3 905 B7R0.2 CC(C)SC(C)C=O Amb18642905 [0,1,0,0,0,0|2,0,1]=4 906 B7R0.2 CC(C)SC(Cl)=CCl Amb25328919 [0,1,0,0,0,0|3,0,0]=4 907 B7R0.2 CC(C)SC(N)=S=O Amb25760605 [0,1,0,0,0,0|2,0,0]=3 908 B7R0.2 CC(C)S\C(\Cl)=C\Cl Amb24523907 [0,1,0,0,0,0|3,0,0]=4 909 B7R0.2 CC(C)S\C(\N)=N\O Amb24505936 [0,1,0,0,0,0|2,0,0]=3 910 B7R0.2 CC(C)\C=C(/C)\C=O Amb24678645 [0,1,0,0,0,0|1,0,1]=3 911 B7R0.2 CC(C)\C=C(/F)\C=O Amb25376490 [0,1,0,0,0,0|1,0,1]=3 912 B7R0.2 CC(C)\C=C(\Br)/CO Amb24502159 [0,1,0,0,0,0|1,0,1]=3 913 B7R0.2 CC(C)\C=C(\C)/C=O Amb18641702 [0,1,0,0,0,0|1,0,1]=3 914 B7R0.2 CC(C)\C=C(\C)/CBr Amb25258727 [0,1,0,0,0,0|2,0,1]=4 915 B7R0.2 CC(C)\C=C(\C)/CN Amb25303051 [0,1,0,0,0,0|2,0,1]=4 916 B7R0.2 CC(C)\C=C(\C)/CO Amb25139174 [0,1,0,0,0,0|1,0,1]=3 917 B7R0.2 CC(C)\C=C(\F)/CBr Amb25662476 [0,1,0,0,0,0|2,0,1]=4 918 B7R0.2 CC(C)\C=C(\N)/C#N Amb25293976 [0,1,0,0,0,0|2,0,1]=4 919 B7R0.2 CC(C)\N=C(/C)\CCl Amb25082086 [0,1,0,0,0,0|3,0,0]=4 920 B7R0.2 CC(C=C)OC(=O)Cl Amb24550333 [0,1,0,0,0,0|2,0,1]=4 921 B7R0.2 CC(C=O)NC(C)=O Amb18641830 [0,1,0,0,0,0|2,0,1]=4 922 B7R0.2 CC(C=O)OC(C)=O Amb18641863 [0,1,0,0,0,0|2,0,1]=4 923 B7R0.2 CC(CB(Cl)Cl)CCl Amb24677659 [0,1,0,0,0,0|3,0,0]=4 924 B7R0.2 CC(CBr)=CC(=O)Cl Amb24519437 [0,1,0,0,0,0|1,0,2]=4 925 B7R0.2 CC(CBr)CC(C)=O Amb24365894 [0,1,0,0,0,0|1,0,0]=2 926 B7R0.2 CC(CBr)CN(C)C Amb24726942 [0,1,0,0,0,0|3,0,0]=4 927 B7R0.2 CC(CBr)NC(C)=O Amb25223671 [0,1,0,0,0,0|2,0,0]=3 928 B7R0.2 CC(CBr)OC(N)=O Amb24368693 [0,1,0,0,0,0|2,0,0]=3 929 B7R0.2 CC(CC(=C)Br)C=O Amb24380828 [0,1,0,0,0,0|2,0,1]=4 930 B7R0.2 CC(CC(=O)Cl)C=C Amb25278347 [0,1,0,0,0,0|1,0,1]=3 931 B7R0.2 CC(CC(C)=C)C=O Amb18641711 [0,1,0,0,0,0|2,0,1]=4 932 B7R0.2 CC(CC(C)=C)NN Amb25825816 [0,1,0,0,0,0|3,0,0]=4 933 B7R0.2 CC(CC(C)=O)=CCl Amb25685302 [0,1,0,0,0,0|1,0,2]=4 934 B7R0.2 CC(CC(C)=O)=NC Amb25250042 [0,1,0,0,0,0|1,0,1]=3 935 B7R0.2 CC(CC(C)=O)C#C Amb24738456 [0,1,0,0,0,0|1,0,1]=3 936 B7R0.2 CC(CC(C)=O)C#N Amb18124227 [0,1,0,0,0,0|1,0,1]=3 937 B7R0.2 CC(CC(C)=O)C=O Amb18641789 [0,1,0,0,0,0|1,0,1]=3 938 B7R0.2 CC(CC(C)O)C#N Amb25361796 [0,1,0,0,0,0|1,0,2]=4 939 B7R0.2 CC(CC(C)O)OC Amb22757067 [0,1,0,0,0,0|1,0,1]=3 940 B7R0.2 CC(CC(Cl)Cl)CC Amb25725024 [0,1,0,0,0,0|2,0,1]=4 941 B7R0.2 CC(CC(F)F)CO Amb25738045 [0,1,0,0,0,0|2,0,1]=4 942 B7R0.2 CC(CC(F)F)NC Amb24476603 [0,1,0,0,0,0|2,0,1]=4 943 B7R0.2 CC(CC(N)=O)=CCl Amb25663357 [0,1,0,0,0,0|1,0,2]=4 944 B7R0.2 CC(CC(N)=O)CN Amb18641899 [0,1,0,0,0,0|1,0,0]=2 945 B7R0.2 CC(CC(O)=O)=C=C Amb25265849 [0,1,0,0,0,0|0,0,2]=3 946 B7R0.2 CC(CC(O)=O)=CCl Amb25802122 [0,1,0,0,0,0|0,0,2]=3 947 B7R0.2 CC(CC(O)=O)C=C Amb18641774 [0,1,0,0,0,0|0,0,1]=2 948 B7R0.2 CC(CC(O)=O)C=O Amb25836603 [0,1,0,0,0,0|0,0,1]=2 949 B7R0.2 CC(CC(O)=O)CO Amb18198168 [0,1,0,0,0,0|0,0,0]=1 950 B7R0.2 CC(CC(O)=O)SCl Amb24483173 [0,1,0,0,0,0|1,0,0]=2 951 B7R0.2 CC(CC)=CC(N)=O Amb24640827 [0,1,0,0,0,0|1,0,2]=4 952 B7R0.2 CC(CC)CC(=N)N Amb10607625 [0,1,0,0,0,0|2,0,0]=3 953 B7R0.2 CC(CC)CC(=O)Cl Amb10844649 [0,1,0,0,0,0|1,0,0]=2 954 B7R0.2 CC(CCl)C=C(Cl)Cl Amb25138772 [0,1,0,0,0,0|2,0,1]=4 955 B7R0.2 CC(CCl)C[NH+](C)C Amb22045172 [0,1,0,0,0,0|3,0,0]=4 956 B7R0.2 CC(CCl)N=C(C)Cl Amb24656115 [0,1,0,0,0,0|3,0,0]=4 957 B7R0.2 CC(CCl)NS(C)=O Amb24551851 [0,1,0,0,0,0|3,0,0]=4 958 B7R0.2 CC(CCl)OC(C)=O Amb24481416 [0,1,0,0,0,0|2,0,0]=3 959 B7R0.2 CC(CCl)OS(=O)Cl Amb25121727 [0,1,0,0,0,0|3,0,0]=4 960 B7R0.2 CC(CCl)\N=C(\C)/Cl Amb25189831 [0,1,0,0,0,0|3,0,0]=4 961 B7R0.2 CC(CF)NC(C)=O Amb25077726 [0,1,0,0,0,0|2,0,0]=3 962 B7R0.2 CC(CF)NC(N)=O Amb24354538 [0,1,0,0,0,0|2,0,0]=3 963 B7R0.2 CC(CN)CC(C)=O Amb18251072 [0,1,0,0,0,0|1,0,0]=2 964 B7R0.2 CC(CN)CC(C)O Amb19337142 [0,1,0,0,0,0|1,0,1]=3 965 B7R0.2 CC(CN)CC(O)=O Amb18124263 [0,1,0,0,0,0|0,0,0]=1 966 B7R0.2 CC(CN)CC(O)=O Amb20669501 [0,1,0,0,0,0|0,0,0]=1 967 B7R0.2 CC(CN)CP(O)=O Amb25757942 [0,1,0,0,0,0|1,0,0]=2 968 B7R0.2 CC(CN)NC(C)=O Amb18251073 [0,1,0,0,0,0|2,0,0]=3 969 B7R0.2 CC(CN)NC(N)=O Amb18202682 [0,1,0,0,0,0|2,0,0]=3 970 B7R0.2 CC(CN)NS(C)=O Amb25177123 [0,1,0,0,0,0|3,0,0]=4 971 B7R0.2 CC(CN)SC(C)=O Amb25255492 [0,1,0,0,0,0|2,0,0]=3 972 B7R0.2 CC(CN)SC(N)=N Amb24763725 [0,1,0,0,0,0|3,0,0]=4 973 B7R0.2 CC(CO)=CC(O)=O Amb24689918 [0,1,0,0,0,0|0,0,2]=3 974 B7R0.2 CC(CO)=NN(C)C Amb24476233 [0,1,0,0,0,0|3,0,0]=4 975 B7R0.2 CC(CO)CC(C)=O Amb24606485 [0,1,0,0,0,0|1,0,0]=2 976 B7R0.2 CC(CO)CC(N)=N Amb24579212 [0,1,0,0,0,0|2,0,0]=3 977 B7R0.2 CC(CO)CC(N)=O Amb24452895 [0,1,0,0,0,0|1,0,0]=2 978 B7R0.2 CC(CO)N=C(C)C Amb24699220 [0,1,0,0,0,0|3,0,0]=4 979 B7R0.2 CC(CO)NC(C)=S Amb24482996 [0,1,0,0,0,0|2,1,0]=4 980 B7R0.2 CC(CO)OC(C)=O Amb25144303 [0,1,0,0,0,0|2,0,0]=3 981 B7R0.2 CC(CO)OP(O)=O Amb24643413 [0,1,0,0,0,0|2,0,0]=3 982 B7R0.2 CC(CO)SC(N)=N Amb25119560 [0,1,0,0,0,0|3,0,0]=4 983 B7R0.2 CC(CO)\C=C(\C)/Br Amb25807120 [0,1,0,0,0,0|2,0,1]=4 984 B7R0.2 CC(CS)=CC(O)=O Amb25073137 [0,1,0,0,0,0|0,0,2]=3 985 B7R0.2 CC(C[C@@H](C)N)OC Amb24690074 [0,1,0,0,0,0|2,0,1]=4 986 B7R0.2 CC(C[SiH](Cl)Cl)CCl Amb24440813 [0,1,0,0,0,0|2,1,0]=4 987 B7R0.2 CC(Cl)CC(O)CC Amb25053890 [0,1,0,0,0,0|2,0,1]=4 988 B7R0.2 CC(Cl)OC(=O)CCl Amb24481495 [0,1,0,0,0,0|3,0,0]=4 989 B7R0.2 CC(Cl)OC(=O)CF Amb24711140 [0,1,0,0,0,0|3,0,0]=4 990 B7R0.2 CC(Cl)\C=C(/Cl)\C=O Amb25257485 [0,1,0,0,0,0|2,0,1]=4 991 B7R0.2 CC(Cl)\C=C(\Cl)/C=O Amb24474385 [0,1,0,0,0,0|2,0,1]=4 992 B7R0.2 CC(F)CC(O)CC Amb24675431 [0,1,0,0,0,0|2,0,1]=4 993 B7R0.2 CC(N)CC(C)CN Amb18641914 [0,1,0,0,0,0|2,0,1]=4 994 B7R0.2 CC(N)CC(O)CO Amb18124268 [0,1,0,0,0,0|1,0,2]=4 995 B7R0.2 CC(N)CS(=O)CCl Amb25811638 [0,1,0,0,0,0|3,0,0]=4 996 B7R0.2 CC(N)C\C(\C)=C\N Amb24333342 [0,1,0,0,0,0|3,0,0]=4 997 B7R0.2 CC(NC(=O)N)CC Amb1105272 [0,1,0,0,0,0|2,0,0]=3 998 B7R0.2 CC(NC)CC(=O)N Amb17231826 [0,1,0,0,0,0|1,0,0]=2 999 B7R0.2 CC(NC)CC(=S)N Amb17231886 [0,1,0,0,0,0|1,1,0]=3 1000 B7R0.2 CC(NN(N=O)[O-])C Amb17616217 [0,1,0,0,0,0|2,0,1]=4 1001 B7R0.2 CC(O)CC(=C)C#N Amb18641647 [0,1,0,0,0,0|3,0,0]=4 1002 B7R0.2 CC(O)CC(=C)C=C Amb25369642 [0,1,0,0,0,0|3,0,0]=4 1003 B7R0.2 CC(O)CC(=O)C=O Amb24666713 [0,1,0,0,0,0|1,0,1]=3 1004 B7R0.2 CC(O)CC(=O)CO Amb25116562 [0,1,0,0,0,0|1,0,0]=2 1005 B7R0.2 CC(O)CC(=O)N[O-] Amb25345095 [0,1,0,0,0,0|1,0,1]=3 1006 B7R0.2 CC(O)CC(C)=NO Amb24475817 [0,1,0,0,0,0|2,0,0]=3 1007 B7R0.2 CC(O)CC(C)CO Amb25262806 [0,1,0,0,0,0|1,0,1]=3 1008 B7R0.2 CC(O)CC(N)CI Amb25197705 [0,1,0,0,0,0|2,0,1]=4 1009 B7R0.2 CC(O)CC(N)CO Amb25828018 [0,1,0,0,0,0|2,0,1]=4 1010 B7R0.2 CC(O)CC(O)C=C Amb24397089 [0,1,0,0,0,0|2,0,1]=4 1011 B7R0.2 CC(O)CC(O)CCl Amb24663123 [0,1,0,0,0,0|2,0,1]=4 1012 B7R0.2 CC(O)C\C(\C)=C\Br Amb24415427 [0,1,0,0,0,0|3,0,0]=4 1013 B7R0.2 CC(O)NC(=O)C=C Amb25076501 [0,1,0,0,0,0|3,0,0]=4 1014 B7R0.2 CC(O)OC(=O)C=C Amb25266385 [0,1,0,0,0,0|3,0,0]=4 1015 B7R0.2 CC(O)OC(=O)CS Amb24698028 [0,1,0,0,0,0|2,1,0]=4 1016 B7R0.2 CCC(=C)CC(C)C Amb22228812 [0,1,0,0,0,0|2,0,0]=3 1017 B7R0.2 CCC(=C)CC(C)Cl Amb25256618 [0,1,0,0,0,0|3,0,0]=4 1018 B7R0.2 CCC(=C)CC(O)=O Amb18641782 [0,1,0,0,0,0|0,0,2]=3 1019 B7R0.2 CCC(=O)C=S(C)C Amb25059580 [0,1,0,0,0,0|2,0,1]=4 1020 B7R0.2 CCC(=O)CC(C)Br Amb24483088 [0,1,0,0,0,0|2,0,0]=3 1021 B7R0.2 CCC(=O)CC(C)C Amb17138363 [0,1,0,0,0,0|1,0,0]=2 1022 B7R0.2 CCC(=O)CC(C)Cl Amb25275986 [0,1,0,0,0,0|2,0,0]=3 1023 B7R0.2 CCC(=O)CC(C)N Amb24679340 [0,1,0,0,0,0|2,0,0]=3 1024 B7R0.2 CCC(=O)CC(C)O Amb25113617 [0,1,0,0,0,0|2,0,0]=3 1025 B7R0.2 CCC(=O)CC(C)S Amb24647716 [0,1,0,0,0,0|2,0,0]=3 1026 B7R0.2 CCC(=O)CC(O)=O Amb18641869 [0,1,0,0,0,0|1,0,1]=3 1027 B7R0.2 CCC(=O)CN(C)C Amb25781387 [0,1,0,0,0,0|2,0,0]=3 1028 B7R0.2 CCC(=O)C[C@H](C)O Amb25746635 [0,1,0,0,0,0|2,0,0]=3 1029 B7R0.2 CCC(=O)OC(C)O Amb25234635 [0,1,0,0,0,0|3,0,0]=4 1030 B7R0.2 CCC(=S)NC(C)C Amb25075818 [0,1,0,0,0,0|2,1,0]=4 1031 B7R0.2 CCC(Br)CC(C)=C Amb24355903 [0,1,0,0,0,0|3,0,0]=4 1032 B7R0.2 CCC(Br)CC(O)=O Amb24370499 [0,1,0,0,0,0|1,0,0]=2 1033 B7R0.2 CCC(C)=CC(C)C Amb24640703 [0,1,0,0,0,0|2,0,1]=4 1034 B7R0.2 CCC(C)C=C(Br)Br Amb24744207 [0,1,0,0,0,0|2,0,1]=4 1035 B7R0.2 CCC(C)C=C(Cl)Cl Amb24559351 [0,1,0,0,0,0|2,0,1]=4 1036 B7R0.2 CCC(C)CC(C)=C Amb22228340 [0,1,0,0,0,0|2,0,0]=3 1037 B7R0.2 CCC(C)CC(C)Br Amb24757470 [0,1,0,0,0,0|2,0,1]=4 1038 B7R0.2 CCC(C)CC(N)=N Amb19890168 [0,1,0,0,0,0|2,0,0]=3 1039 B7R0.2 CCC(C)CC(N)=O Amb25230669 [0,1,0,0,0,0|1,0,0]=2 1040 B7R0.2 CCC(C)CN(C)C Amb25851027 [0,1,0,0,0,0|3,0,0]=4 1041 B7R0.2 CCC(C)C[N+]([O-])=O Amb25075983 [0,1,0,0,0,0|1,0,1]=3 1042 B7R0.2 CCC(C)NC(C)=N Amb25081674 [0,1,0,0,0,0|3,0,0]=4 1043 B7R0.2 CCC(C)NC(C)=S Amb24332642 [0,1,0,0,0,0|2,1,0]=4 1044 B7R0.2 CCC(C)NC(N)=N Amb24531881 [0,1,0,0,0,0|3,0,0]=4 1045 B7R0.2 CCC(C)NC(O)=S Amb25368326 [0,1,0,0,0,0|1,1,0]=3 1046 B7R0.2 CCC(C)NC(S)=S Amb24382369 [0,1,0,0,0,0|1,2,0]=4 1047 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [0,1,0,0,0,0|2,0,0]=3 1048 B7R0.2 CCC(C)OC(N)=N Amb24563563 [0,1,0,0,0,0|3,0,0]=4 1049 B7R0.2 CCC(C)O[N+]([O-])=O Amb25088971 [0,1,0,0,0,0|2,0,1]=4 1050 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [0,1,0,0,0,0|2,0,0]=3 1051 B7R0.2 CCC(CC(=O)C)C Amb10608208 [0,1,0,0,0,0|1,0,0]=2 1052 B7R0.2 CCC(CC(=O)O)N Amb1993862 [0,1,0,0,0,0|1,0,0]=2 1053 B7R0.2 CCC(CC(=O)O)O Amb10844270 [0,1,0,0,0,0|1,0,0]=2 1054 B7R0.2 CCC(CC(N)C)C Amb10069423 [0,1,0,0,0,0|2,0,1]=4 1055 B7R0.2 CCC(Cl)CC(=O)Cl Amb24390220 [0,1,0,0,0,0|2,0,0]=3 1056 B7R0.2 CCC(Cl)CC(C)=C Amb24735482 [0,1,0,0,0,0|3,0,0]=4 1057 B7R0.2 CCC(Cl)OC(=O)Cl Amb25853933 [0,1,0,0,0,0|3,0,0]=4 1058 B7R0.2 CCC(F)=CC(O)=O Amb24674138 [0,1,0,0,0,0|1,0,2]=4 1059 B7R0.2 CCC(N)CC(C)=C Amb24367516 [0,1,0,0,0,0|3,0,0]=4 1060 B7R0.2 CCC(N)CC(C)=O Amb18631696 [0,1,0,0,0,0|2,0,0]=3 1061 B7R0.2 CCC(N)CC(N)=O Amb25727686 [0,1,0,0,0,0|2,0,0]=3 1062 B7R0.2 CCC(N)CS(C)=O Amb24481377 [0,1,0,0,0,0|3,0,0]=4 1063 B7R0.2 CCC(N)NC(C)=O Amb25062531 [0,1,0,0,0,0|3,0,0]=4 1064 B7R0.2 CCC(O)=CC(C)O Amb24705890 [0,1,0,0,0,0|2,0,1]=4 1065 B7R0.2 CCC(O)CC(C)=C Amb24062975 [0,1,0,0,0,0|3,0,0]=4 1066 B7R0.2 CCC(O)CC(C)=O Amb25065181 [0,1,0,0,0,0|2,0,0]=3 1067 B7R0.2 CCC(O)CC(N)=O Amb24616660 [0,1,0,0,0,0|2,0,0]=3 1068 B7R0.2 CCC(O)CC(O)=O Amb22363067 [0,1,0,0,0,0|1,0,0]=2 1069 B7R0.2 CCC(O)C[N+]([O-])=O Amb25136685 [0,1,0,0,0,0|2,0,1]=4 1070 B7R0.2 CCC(S)CC(O)=O Amb18303084 [0,1,0,0,0,0|1,0,0]=2 1071 B7R0.2 CCN(C)CC(=C)Br Amb25333139 [0,1,0,0,0,0|3,0,0]=4 1072 B7R0.2 CCN(C)NC(C)=O Amb24675229 [0,1,0,0,0,0|3,0,0]=4 1073 B7R0.2 CCN(CC(C)C)N Amb17593207 [0,1,0,0,0,0|3,0,0]=4 1074 B7R0.2 CCN(CC(O)C)C Amb17334070 [0,1,0,0,0,0|2,0,1]=4 1075 B7R0.2 CCN(N)CC(O)=O Amb25738005 [0,1,0,0,0,0|2,0,0]=3 1076 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [0,1,0,0,0,0|2,0,0]=3 1077 B7R0.2 CCS(=O)CC(C)N Amb25678795 [0,1,0,0,0,0|3,0,0]=4 1078 B7R0.2 CCS(=O)CC(C)O Amb25687853 [0,1,0,0,0,0|3,0,0]=4 1079 B7R0.2 CC[C@@H](Br)CC(O)=O Amb24467852 [0,1,0,0,0,0|1,0,0]=2 1080 B7R0.2 CC[C@@H](C)CC(=O)Cl Amb23425123 [0,1,0,0,0,0|1,0,0]=2 1081 B7R0.2 CC[C@@H](C)CC(N)=O Amb25310922 [0,1,0,0,0,0|1,0,0]=2 1082 B7R0.2 CC[C@@H](C)NC(C)=O Amb25169508 [0,1,0,0,0,0|2,0,0]=3 1083 B7R0.2 CC[C@@H](N)CC(O)=O Amb22225305 [0,1,0,0,0,0|1,0,0]=2 1084 B7R0.2 CC[C@@H](O)CC(C)=C Amb25136335 [0,1,0,0,0,0|3,0,0]=4 1085 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [0,1,0,0,0,0|2,0,0]=3 1086 B7R0.2 CC[C@@H](O)CN(C)C Amb24446828 [0,1,0,0,0,0|2,0,1]=4 1087 B7R0.2 CC[C@@H](S)CC(O)=O Amb24481337 [0,1,0,0,0,0|1,0,0]=2 1088 B7R0.2 CC[C@H](C)CC(C)=O Amb24614519 [0,1,0,0,0,0|1,0,0]=2 1089 B7R0.2 CC[C@H](C)CC(C)N Amb25062813 [0,1,0,0,0,0|2,0,1]=4 1090 B7R0.2 CC[C@H](C)CC(N)=N Amb24409491 [0,1,0,0,0,0|2,0,0]=3 1091 B7R0.2 CC[C@H](C)NC(C)=O Amb25823467 [0,1,0,0,0,0|2,0,0]=3 1092 B7R0.2 CC[C@H](N)CC(O)=O Amb22226650 [0,1,0,0,0,0|1,0,0]=2 1093 B7R0.2 CC[C@H](O)CN(C)C Amb25749217 [0,1,0,0,0,0|2,0,1]=4 1094 B7R0.2 CC[C@H](O)C[N+]([O-])=O Amb25854053 [0,1,0,0,0,0|2,0,1]=4 1095 B7R0.2 CC[S+](C)CC(O)=O Amb24710040 [0,1,0,0,0,0|1,0,0]=2 1096 B7R0.2 CN(C)C=C(Br)C=O Amb20622479 [0,1,0,0,0,0|2,0,1]=4 1097 B7R0.2 CN(C)CC(=C)CN Amb25749157 [0,1,0,0,0,0|3,0,0]=4 1098 B7R0.2 CN(C)CC(=C)CS Amb25043686 [0,1,0,0,0,0|2,1,0]=4 1099 B7R0.2 CN(C)CC(=N)NO Amb21858419 [0,1,0,0,0,0|2,0,0]=3 1100 B7R0.2 CN(C)CC(=O)C=C Amb25733522 [0,1,0,0,0,0|2,0,0]=3 1101 B7R0.2 CN(C)CC(=O)C=O Amb25348685 [0,1,0,0,0,0|1,0,1]=3 1102 B7R0.2 CN(C)CC(=O)NN Amb19930184 [0,1,0,0,0,0|2,0,0]=3 1103 B7R0.2 CN(C)CC(=O)NO Amb25369208 [0,1,0,0,0,0|1,0,0]=2 1104 B7R0.2 CN(C)CC(N)=NN Amb25827563 [0,1,0,0,0,0|3,0,0]=4 1105 B7R0.2 CN(C)CC(N)CO Amb25742525 [0,1,0,0,0,0|2,0,1]=4 1106 B7R0.2 CN(C)CC(O)C=O Amb25233179 [0,1,0,0,0,0|1,0,1]=3 1107 B7R0.2 CN(C)CC(O)CBr Amb24694496 [0,1,0,0,0,0|2,0,1]=4 1108 B7R0.2 CN(C)CC(O)CF Amb25252831 [0,1,0,0,0,0|2,0,1]=4 1109 B7R0.2 CN(C)CC(O)CI Amb25118064 [0,1,0,0,0,0|2,0,1]=4 1110 B7R0.2 CN(C)CC(O)CN Amb21961658 [0,1,0,0,0,0|2,0,1]=4 1111 B7R0.2 CN(C)CC(O)CN Amb22587169 [0,1,0,0,0,0|2,0,1]=4 1112 B7R0.2 CN(C)C[C@@H](N)CO Amb24411936 [0,1,0,0,0,0|2,0,1]=4 1113 B7R0.2 CN(C)C[C@@H](O)CCl Amb25339384 [0,1,0,0,0,0|2,0,1]=4 1114 B7R0.2 CN(C)C[C@H](O)CCl Amb25062085 [0,1,0,0,0,0|2,0,1]=4 1115 B7R0.2 CN(C)NC(=O)C=C Amb25061001 [0,1,0,0,0,0|3,0,0]=4 1116 B7R0.2 CN(C)NC(=O)CBr Amb24523150 [0,1,0,0,0,0|3,0,0]=4 1117 B7R0.2 CN(C)NC(=O)CN Amb24558369 [0,1,0,0,0,0|3,0,0]=4 1118 B7R0.2 CN(C)NC(=O)CS Amb25110279 [0,1,0,0,0,0|2,1,0]=4 1119 B7R0.2 CN(C)\C=C(/F)\C=O Amb22491078 [0,1,0,0,0,0|2,0,1]=4 1120 B7R0.2 CN(C)\C=C(/N)\C=O Amb25305003 [0,1,0,0,0,0|2,0,1]=4 1121 B7R0.2 CN(C)\C=C(\Br)/C=O Amb25070734 [0,1,0,0,0,0|2,0,1]=4 1122 B7R0.2 CN(C)\C=C(\Cl)/C=O Amb25766556 [0,1,0,0,0,0|2,0,1]=4 1123 B7R0.2 CN(C)\C=C(\N)/C=O Amb24745775 [0,1,0,0,0,0|2,0,1]=4 1124 B7R0.2 CN(CC(N)=O)C#N Amb24457322 [0,1,0,0,0,0|2,0,1]=4 1125 B7R0.2 CN(CC(O)=O)C#N Amb25195711 [0,1,0,0,0,0|1,0,1]=3 1126 B7R0.2 CN(CC(O)=O)C=O Amb18951578 [0,1,0,0,0,0|1,0,1]=3 1127 B7R0.2 CN=C(C)NC(C)C Amb24402078 [0,1,0,0,0,0|3,0,0]=4 1128 B7R0.2 CNC(=N)CC(C)C Amb24658248 [0,1,0,0,0,0|2,0,0]=3 1129 B7R0.2 CNC(=N)NC(C)C Amb25081617 [0,1,0,0,0,0|3,0,0]=4 1130 B7R0.2 CNC(=O)CC(C)Br Amb25724971 [0,1,0,0,0,0|2,0,0]=3 1131 B7R0.2 CNC(=O)CC(C)N Amb18949898 [0,1,0,0,0,0|2,0,0]=3 1132 B7R0.2 CNC(=O)CC(C)N Amb21959391 [0,1,0,0,0,0|2,0,0]=3 1133 B7R0.2 CNC(=O)CC(C)O Amb24525315 [0,1,0,0,0,0|2,0,0]=3 1134 B7R0.2 CNC(=O)CC(N)=O Amb24400836 [0,1,0,0,0,0|2,0,1]=4 1135 B7R0.2 CNC(=O)CN(C)C Amb19978831 [0,1,0,0,0,0|2,0,0]=3 1136 B7R0.2 CNC(=O)C[C@@H](C)N Amb24428006 [0,1,0,0,0,0|2,0,0]=3 1137 B7R0.2 CNC(=O)NC(C)C Amb24525300 [0,1,0,0,0,0|2,0,0]=3 1138 B7R0.2 CNC(=O)OC(C)Cl Amb24680944 [0,1,0,0,0,0|3,0,0]=4 1139 B7R0.2 CNC(=O)SC(C)C Amb24518071 [0,1,0,0,0,0|2,0,0]=3 1140 B7R0.2 CNC(=S)CC(C)C Amb24685209 [0,1,0,0,0,0|1,1,0]=3 1141 B7R0.2 CNC(C)CC(N)=O Amb19960012 [0,1,0,0,0,0|1,0,0]=2 1142 B7R0.2 CNC(C)CC(O)=O Amb21959674 [0,1,0,0,0,0|0,0,0]=1 1143 B7R0.2 CNC(C)CN(C)C Amb18982416 [0,1,0,0,0,0|3,0,0]=4 1144 B7R0.2 CNC(C)CS(C)=O Amb24410768 [0,1,0,0,0,0|2,0,0]=3 1145 B7R0.2 CNC(C)C[N+]([O-])=O Amb25297025 [0,1,0,0,0,0|1,0,1]=3 1146 B7R0.2 CNC(CC(C)C)C Amb1119789 [0,1,0,0,0,0|2,0,1]=4 1147 B7R0.2 CNN(C)CC(C)O Amb25681467 [0,1,0,0,0,0|2,0,1]=4 1148 B7R0.2 CN[C@@H](C)CC(O)=O Amb25255193 [0,1,0,0,0,0|0,0,0]=1 1149 B7R0.2 CN[C@H](C)CC(O)=O Amb25339129 [0,1,0,0,0,0|0,0,0]=1 1150 B7R0.2 CN\C(=C/C(=O)C)\C Amb15691784 [0,1,0,0,0,0|1,0,2]=4 1151 B7R0.2 COC(=N)CN(C)C Amb23538532 [0,1,0,0,0,0|2,0,0]=3 1152 B7R0.2 COC(=N)NC(C)C Amb25328916 [0,1,0,0,0,0|2,0,0]=3 1153 B7R0.2 COC(=O)CC(=O)O Amb16232032 [0,1,0,0,0,0|1,0,1]=3 1154 B7R0.2 COC(=O)CC(Br)C Amb10603675 [0,1,0,0,0,0|1,0,0]=2 1155 B7R0.2 COC(=O)CC(C)S Amb19515267 [0,1,0,0,0,0|1,0,0]=2 1156 B7R0.2 COC(=O)CC(Cl)Cl Amb25227821 [0,1,0,0,0,0|2,0,0]=3 1157 B7R0.2 COC(=O)CC(N)=N Amb18831173 [0,1,0,0,0,0|2,0,1]=4 1158 B7R0.2 COC(=O)CC(N)=N Amb19516886 [0,1,0,0,0,0|2,0,1]=4 1159 B7R0.2 COC(=O)CC(N)=O Amb22043417 [0,1,0,0,0,0|2,0,1]=4 1160 B7R0.2 COC(=O)CC(N)C Amb2371489 [0,1,0,0,0,0|1,0,0]=2 1161 B7R0.2 COC(=O)CC(N)F Amb25267953 [0,1,0,0,0,0|2,0,0]=3 1162 B7R0.2 COC(=O)CN(=O)=O Amb20621013 [0,1,0,0,0,0|3,0,0]=4 1163 B7R0.2 COC(=O)CN(C)C Amb22167138 [0,1,0,0,0,0|1,0,0]=2 1164 B7R0.2 COC(=O)CS(C)=O Amb20626166 [0,1,0,0,0,0|2,0,0]=3 1165 B7R0.2 COC(=O)C[C@@H](C)N Amb22898912 [0,1,0,0,0,0|1,0,0]=2 1166 B7R0.2 COC(=O)C[C@H](C)N Amb25789928 [0,1,0,0,0,0|1,0,0]=2 1167 B7R0.2 COC(=O)NC(C)C Amb17861698 [0,1,0,0,0,0|1,0,0]=2 1168 B7R0.2 COC(=O)NC(C)O Amb25705192 [0,1,0,0,0,0|2,0,0]=3 1169 B7R0.2 COC(=O)NN(C)C Amb25173600 [0,1,0,0,0,0|2,0,0]=3 1170 B7R0.2 COC(=O)OC(C)C Amb22049510 [0,1,0,0,0,0|1,0,0]=2 1171 B7R0.2 COC(=O)\C=C(\N)/C Amb1157857 [0,1,0,0,0,0|1,0,2]=4 1172 B7R0.2 COC(=S)NC(C)C Amb10575029 [0,1,0,0,0,0|1,1,0]=3 1173 B7R0.2 COC(=S)SC(C)C Amb25144808 [0,1,0,0,0,0|1,1,0]=3 1174 B7R0.2 COC(C)=CC(C)O Amb25769416 [0,1,0,0,0,0|2,0,1]=4 1175 B7R0.2 COC(C)CC(N)=S Amb25782261 [0,1,0,0,0,0|1,1,0]=3 1176 B7R0.2 COC(C)CN(C)C Amb25686456 [0,1,0,0,0,0|2,0,1]=4 1177 B7R0.2 COC(C)CS([O-])=O Amb25690482 [0,1,0,0,0,0|1,0,1]=3 1178 B7R0.2 CON(C)CC(=C)Cl Amb24409735 [0,1,0,0,0,0|3,0,0]=4 1179 B7R0.2 CON(C)CC(C)=C Amb25198060 [0,1,0,0,0,0|3,0,0]=4 1180 B7R0.2 CON(C)CC(C)C Amb25132888 [0,1,0,0,0,0|2,0,0]=3 1181 B7R0.2 CON(C)CC(C)O Amb25285671 [0,1,0,0,0,0|2,0,1]=4 1182 B7R0.2 CON(C)CC(N)=O Amb24447118 [0,1,0,0,0,0|2,0,0]=3 1183 B7R0.2 CON(C)C[C@H](C)N Amb24380455 [0,1,0,0,0,0|3,0,0]=4 1184 B7R0.2 CO[C@@H](C)CC(O)=O Amb24481367 [0,1,0,0,0,0|0,0,0]=1 1185 B7R0.2 CO[C@@H](O)CC(C)=O Amb24450127 [0,1,0,0,0,0|2,0,0]=3 1186 B7R0.2 CS(=O)CC(O)CN Amb24482487 [0,1,0,0,0,0|3,0,0]=4 1187 B7R0.2 CS(=O)C[C@@H](O)CN Amb25284334 [0,1,0,0,0,0|3,0,0]=4 1188 B7R0.2 CS(=O)C[C@H](N)CO Amb24436533 [0,1,0,0,0,0|3,0,0]=4 1189 B7R0.2 CS(=O)C[C@H](O)CN Amb25811520 [0,1,0,0,0,0|3,0,0]=4 1190 B7R0.2 CS(C)=NC(=O)CCl Amb24481455 [0,1,0,0,0,0|3,0,0]=4 1191 B7R0.2 CSC(=O)CC(C)C Amb22168305 [0,1,0,0,0,0|0,1,0]=2 1192 B7R0.2 CSC(=O)OC(C)Cl Amb24650974 [0,1,0,0,0,0|2,1,0]=4 1193 B7R0.2 CSC(=S)OC(C)C Amb25134818 [0,1,0,0,0,0|1,2,0]=4 1194 B7R0.2 CSC(C)CC(C)=O Amb25714199 [0,1,0,0,0,0|1,0,0]=2 1195 B7R0.2 CSC(C)CC(O)=O Amb18967824 [0,1,0,0,0,0|0,0,0]=1 1196 B7R0.2 C[C@@H](C#N)NC(C)=O Amb25142287 [0,1,0,0,0,0|2,0,1]=4 1197 B7R0.2 C[C@@H](C=C)NC(C)=O Amb25084335 [0,1,0,0,0,0|2,0,1]=4 1198 B7R0.2 C[C@@H](C=O)OC(C)=O Amb24724866 [0,1,0,0,0,0|2,0,1]=4 1199 B7R0.2 C[C@@H](CC(=C)Br)C=O Amb25325003 [0,1,0,0,0,0|2,0,1]=4 1200 B7R0.2 C[C@@H](CC(C)=C)C=O Amb24375353 [0,1,0,0,0,0|2,0,1]=4 1201 B7R0.2 C[C@@H](CC(C)=O)C#C Amb25721483 [0,1,0,0,0,0|1,0,1]=3 1202 B7R0.2 C[C@@H](CC(C)=O)C=O Amb24379584 [0,1,0,0,0,0|1,0,1]=3 1203 B7R0.2 C[C@@H](CC(O)=O)ON Amb25189045 [0,1,0,0,0,0|1,0,0]=2 1204 B7R0.2 C[C@@H](CCl)OC(C)=O Amb24419691 [0,1,0,0,0,0|2,0,0]=3 1205 B7R0.2 C[C@@H](CO)CC(C)=C Amb25845281 [0,1,0,0,0,0|2,0,0]=3 1206 B7R0.2 C[C@@H](CO)CC(C)=O Amb25072788 [0,1,0,0,0,0|1,0,0]=2 1207 B7R0.2 C[C@@H](CO)N=C(C)C Amb25343868 [0,1,0,0,0,0|3,0,0]=4 1208 B7R0.2 C[C@@H](CO)NC(N)=N Amb24724774 [0,1,0,0,0,0|3,0,0]=4 1209 B7R0.2 C[C@@H](CO)NC(N)=O Amb25315937 [0,1,0,0,0,0|2,0,0]=3 1210 B7R0.2 C[C@@H](CO)OC(C)=O Amb25681753 [0,1,0,0,0,0|2,0,0]=3 1211 B7R0.2 C[C@@H](C[C@@H](C)Cl)OC Amb25690472 [0,1,0,0,0,0|2,0,1]=4 1212 B7R0.2 C[C@@H](C[C@@H](C)O)NC Amb24505242 [0,1,0,0,0,0|1,0,1]=3 1213 B7R0.2 C[C@@H](C[C@H](C)O)C=C Amb25763927 [0,1,0,0,0,0|1,0,2]=4 1214 B7R0.2 C[C@@H](C[C@H](C)O)NC Amb25324434 [0,1,0,0,0,0|1,0,1]=3 1215 B7R0.2 C[C@@H](N)C[C@H](O)CO Amb24351981 [0,1,0,0,0,0|1,0,2]=4 1216 B7R0.2 C[C@@H](O)CC(O)C=C Amb25207943 [0,1,0,0,0,0|2,0,1]=4 1217 B7R0.2 C[C@@H](O)C[C@H](C)CO Amb24642405 [0,1,0,0,0,0|1,0,1]=3 1218 B7R0.2 C[C@@H](O)C[C@H](O)C=C Amb25381234 [0,1,0,0,0,0|2,0,1]=4 1219 B7R0.2 C[C@@H](O)\C=C(/C)\C=O Amb25827172 [0,1,0,0,0,0|2,0,1]=4 1220 B7R0.2 C[C@H](C#N)NC(C)=O Amb24481316 [0,1,0,0,0,0|2,0,1]=4 1221 B7R0.2 C[C@H](CBr)NC(C)=O Amb24690410 [0,1,0,0,0,0|2,0,0]=3 1222 B7R0.2 C[C@H](CC(O)=O)C=C Amb25791667 [0,1,0,0,0,0|0,0,1]=2 1223 B7R0.2 C[C@H](CO)C=C(C)C Amb25850751 [0,1,0,0,0,0|2,0,1]=4 1224 B7R0.2 C[C@H](CO)NC(C)=O Amb24426644 [0,1,0,0,0,0|2,0,0]=3 1225 B7R0.2 C[C@H](CO)NC(C)=S Amb24746025 [0,1,0,0,0,0|2,1,0]=4 1226 B7R0.2 C[C@H](CO)NC(N)=O Amb24682644 [0,1,0,0,0,0|2,0,0]=3 1227 B7R0.2 C[C@H](CO)\C=C(\C)/Br Amb25682034 [0,1,0,0,0,0|2,0,1]=4 1228 B7R0.2 C[C@H](C[C@H](C)Cl)OC Amb24634248 [0,1,0,0,0,0|2,0,1]=4 1229 B7R0.2 C[C@H](C[C@H](C)O)C#N Amb25135337 [0,1,0,0,0,0|1,0,2]=4 1230 B7R0.2 C[C@H](C[C@H](C)O)OC Amb24733201 [0,1,0,0,0,0|1,0,1]=3 1231 B7R0.2 C[C@H](N)CS(=O)CCl Amb25736299 [0,1,0,0,0,0|3,0,0]=4 1232 B7R0.2 C[C@H](O)CC(C)=C=C Amb25346210 [0,1,0,0,0,0|3,0,0]=4 1233 B7R0.2 C[C@H](O)C[C@@H](C)CO Amb25845280 [0,1,0,0,0,0|1,0,1]=3 1234 B7R0.2 C[C@H](O)C[C@@H](N)CO Amb25105060 [0,1,0,0,0,0|2,0,1]=4 1235 B7R0.2 C[C@H](O)\C=C(\C)/CO Amb24372060 [0,1,0,0,0,0|2,0,1]=4 1236 B7R0.2 C[C@H](S)C[C@@H](O)CC Amb25237174 [0,1,0,0,0,0|2,0,1]=4 1237 B7R0.2 C[S+](C)CC(O)CO Amb24493510 [0,1,0,0,0,0|1,0,2]=4 1238 B7R0.2 C\C(=C/C(C)=O)\OC Amb24332557 [0,1,0,0,0,0|1,0,2]=4 1239 B7R0.2 C\C(=C/C(O)=O)\C=O Amb25138216 [0,1,0,0,0,0|0,0,3]=4 1240 B7R0.2 C\C(=C\C(=C)O)\OC Amb24481460 [0,1,0,0,0,0|1,0,2]=4 1241 B7R0.2 C\C(=C\C(O)=O)\C=C Amb18641686 [0,1,0,0,0,0|0,0,3]=4 1242 B7R0.2 C\C(=C\C(O)=O)\C=O Amb24579433 [0,1,0,0,0,0|0,0,3]=4 1243 B7R0.2 C\C(=C\C)\NC(C)=O Amb24468210 [0,1,0,0,0,0|2,0,1]=4 1244 B7R0.2 C\C(\C=O)=C\N(C)C Amb19651322 [0,1,0,0,0,0|2,0,1]=4 1245 B7R0.2 C\C(\C=O)=N/N(C)C Amb24598256 [0,1,0,0,0,0|3,0,0]=4 1246 B7R0.2 C\C(\CBr)=C/C(O)=O Amb23538399 [0,1,0,0,0,0|0,0,2]=3 1247 B7R0.2 C\C(\CC(C)=O)=N/C Amb25093198 [0,1,0,0,0,0|1,0,1]=3 1248 B7R0.2 C\C(\CC(C)=O)=N\C Amb25285772 [0,1,0,0,0,0|1,0,1]=3 1249 B7R0.2 C\C(\CC(C)=O)=N\O Amb24457353 [0,1,0,0,0,0|2,0,1]=4 1250 B7R0.2 C\C(\CC(N)=O)=C\C Amb25055448 [0,1,0,0,0,0|1,0,1]=3 1251 B7R0.2 C\C(\CC(O)=O)=C\C Amb24481339 [0,1,0,0,0,0|0,0,1]=2 1252 B7R0.2 C\C(\CC(O)=O)=N/O Amb25064289 [0,1,0,0,0,0|1,0,1]=3 1253 B7R0.2 C\C(\CC)=C\C(O)=O Amb18281014 [0,1,0,0,0,0|0,0,2]=3 1254 B7R0.2 C\C(\CCl)=C\C(C)=O Amb25340485 [0,1,0,0,0,0|1,0,2]=4 1255 B7R0.2 C\C(\CN)=C\C(C)=O Amb20621518 [0,1,0,0,0,0|1,0,2]=4 1256 B7R0.2 C\C(\CO)=C/C(C)=O Amb25240045 [0,1,0,0,0,0|1,0,2]=4 1257 B7R0.2 C\C(\CO)=C/C(O)=O Amb18641871 [0,1,0,0,0,0|0,0,2]=3 1258 B7R0.2 C\C(\CO)=C\C(C)=O Amb24518297 [0,1,0,0,0,0|1,0,2]=4 1259 B7R0.2 C\C(\F)=C\C(=O)OC Amb22235113 [0,1,0,0,0,0|1,0,2]=4 1260 B7R0.2 C\C(\[O-])=C/C(=O)OC Amb22369282 [0,1,0,0,0,0|1,0,2]=4 1261 B7R0.2 C\C(\[O-])=C\C(=O)OC Amb22353144 [0,1,0,0,0,0|1,0,2]=4 1262 B7R0.2 C\C=C(/C)\CC(C)N Amb25076680 [0,1,0,0,0,0|3,0,0]=4 1263 B7R0.2 C\C=C(\C)/CC(C)Br Amb25194408 [0,1,0,0,0,0|3,0,0]=4 1264 B7R0.2 C\C=C(\C)/CC(C)C Amb24566930 [0,1,0,0,0,0|2,0,0]=3 1265 B7R0.2 C\C=C(\Cl)/CC(O)=O Amb25174797 [0,1,0,0,0,0|1,0,1]=3 1266 B7R0.2 C\[N+](\CC(N)=O)=N\[O-] Amb25131183 [0,1,0,0,0,0|3,0,0]=4 1267 B7R0.2 ClCC(=O)CC(=O)Cl Amb17593874 [0,1,0,0,0,0|2,0,1]=4 1268 B7R0.2 ClCC(=O)NC(C)C Amb1151852 [0,1,0,0,0,0|2,0,0]=3 1269 B7R0.2 ClCC(=O)OC(C)C Amb1153072 [0,1,0,0,0,0|2,0,0]=3 1270 B7R0.2 ClCC(CN(C)C)O Amb10068243 [0,1,0,0,0,0|2,0,1]=4 1271 B7R0.2 ICC(=O)NC(C)C Amb10608892 [0,1,0,0,0,0|2,0,0]=3 1272 B7R0.2 NC(=N)C[C@@H](O)CCl Amb24387966 [0,1,0,0,0,0|3,0,0]=4 1273 B7R0.2 NC(=O)CC(O)CO Amb25662216 [0,1,0,0,0,0|2,0,0]=3 1274 B7R0.2 NC(=O)C[C@H](O)CCl Amb25791271 [0,1,0,0,0,0|2,0,0]=3 1275 B7R0.2 NC(C#N)CC(C)C Amb10203324 [0,1,0,0,0,0|2,0,1]=4 1276 B7R0.2 NC(C#N)CC(C)C Amb1137462 [0,1,0,0,0,0|2,0,1]=4 1277 B7R0.2 NC(CC(N)=O)C#N Amb24122907 [0,1,0,0,0,0|2,0,1]=4 1278 B7R0.2 NC(CC(N)=O)C=O Amb24482471 [0,1,0,0,0,0|2,0,1]=4 1279 B7R0.2 NC(CF)CC(O)=O Amb24428065 [0,1,0,0,0,0|1,0,0]=2 1280 B7R0.2 NC(CO)=CC(O)=O Amb24628694 [0,1,0,0,0,0|1,0,2]=4 1281 B7R0.2 NC(CO)CC(N)=O Amb24384089 [0,1,0,0,0,0|2,0,0]=3 1282 B7R0.2 NC(CS)CC(O)=O Amb25090412 [0,1,0,0,0,0|1,0,0]=2 1283 B7R0.2 NCC(=O)OC(C)C Amb10807427 [0,1,0,0,0,0|2,0,0]=3 1284 B7R0.2 NCC(Br)=CC(O)=O Amb25288089 [0,1,0,0,0,0|1,0,2]=4 1285 B7R0.2 NCC(CN(C)C)O Amb1139269 [0,1,0,0,0,0|2,0,1]=4 1286 B7R0.2 NCC(Cl)=CC(O)=O Amb25368348 [0,1,0,0,0,0|1,0,2]=4 1287 B7R0.2 NCC(F)CC(O)=O Amb24550169 [0,1,0,0,0,0|1,0,0]=2 1288 B7R0.2 NCC(N)CC(O)=O Amb19515145 [0,1,0,0,0,0|1,0,0]=2 1289 B7R0.2 NCC(N)CC(O)=O Amb21858324 [0,1,0,0,0,0|1,0,0]=2 1290 B7R0.2 NCC(N)CC(O)=O Amb22751661 [0,1,0,0,0,0|1,0,0]=2 1291 B7R0.2 NCC(O)CC(N)=O Amb18641952 [0,1,0,0,0,0|2,0,0]=3 1292 B7R0.2 NCC(O)CP(=O)=O Amb24648320 [0,1,0,0,0,0|2,0,1]=4 1293 B7R0.2 NCC(O)CP(O)=O Amb24714285 [0,1,0,0,0,0|2,0,0]=3 1294 B7R0.2 NC[C@@H](F)CP(O)=O Amb24481490 [0,1,0,0,0,0|2,0,0]=3 1295 B7R0.2 NC[C@@H](N)CC(O)=O Amb22751651 [0,1,0,0,0,0|1,0,0]=2 1296 B7R0.2 NC[C@@H](N)CC(O)=O Amb25829509 [0,1,0,0,0,0|1,0,0]=2 1297 B7R0.2 NC[C@H](CC(=O)O)N Amb10603267 [0,1,0,0,0,0|1,0,0]=2 1298 B7R0.2 NC[C@H](F)CS(O)=O Amb25068064 [0,1,0,0,0,0|2,0,0]=3 1299 B7R0.2 NC[C@H](N)CC(O)=O Amb25378712 [0,1,0,0,0,0|1,0,0]=2 1300 B7R0.2 NC[C@H](O)CP(O)=O Amb25324060 [0,1,0,0,0,0|2,0,0]=3 1301 B7R0.2 NC\C(\Cl)=C\C(O)=O Amb24375873 [0,1,0,0,0,0|1,0,2]=4 1302 B7R0.2 NNC(=O)CC(C)C Amb1154207 [0,1,0,0,0,0|1,0,0]=2 1303 B7R0.2 NNC(=O)CC(O)=O Amb25073925 [0,1,0,0,0,0|2,0,1]=4 1304 B7R0.2 NNC(=S)NC(C)C Amb1104555 [0,1,0,0,0,0|2,1,0]=4 1305 B7R0.2 N[C@@H](CC(N)=O)C=O Amb24446454 [0,1,0,0,0,0|2,0,1]=4 1306 B7R0.2 N[C@@H](CC(O)=O)C#N Amb25757887 [0,1,0,0,0,0|1,0,1]=3 1307 B7R0.2 N[C@@H](CC([O-])=O)C=O Amb22800169 [0,1,0,0,0,0|1,0,2]=4 1308 B7R0.2 N[C@@H](CO)CC(N)=O Amb24704927 [0,1,0,0,0,0|2,0,0]=3 1309 B7R0.2 N[C@H](C#N)CC(C)C Amb17399794 [0,1,0,0,0,0|2,0,1]=4 1310 B7R0.2 N[C@H](CC(O)=O)C=O Amb24643781 [0,1,0,0,0,0|1,0,1]=3 1311 B7R0.2 N[C@H](CC(O)=O)CO Amb22388520 [0,1,0,0,0,0|1,0,0]=2 1312 B7R0.2 N[C@H](CO)CC(N)=O Amb24599306 [0,1,0,0,0,0|2,0,0]=3 1313 B7R0.2 N\C(\CC(O)=O)=N/N Amb25281098 [0,1,0,0,0,0|2,0,1]=4 1314 B7R0.2 O=C(CBr)CC(F)F Amb24583262 [0,1,0,0,0,0|3,0,0]=4 1315 B7R0.2 O=C(Cl)CC(Cl)CCl Amb25138703 [0,1,0,0,0,0|2,0,0]=3 1316 B7R0.2 O=C=C(Cl)CC(Cl)Cl Amb25730354 [0,1,0,0,0,0|3,0,0]=4 1317 B7R0.2 O=C=C(Cl)CC(F)Cl Amb25098961 [0,1,0,0,0,0|3,0,0]=4 1318 B7R0.2 O=NN(CC(=O)O)C Amb17618622 [0,1,0,0,0,0|2,0,0]=3 1319 B7R0.2 OC(=O)CC(=O)CCl Amb18124484 [0,1,0,0,0,0|1,0,1]=3 1320 B7R0.2 OC(=O)CC(=O)NO Amb24444078 [0,1,0,0,0,0|2,0,1]=4 1321 B7R0.2 OC(=O)CC(Br)CCl Amb25834578 [0,1,0,0,0,0|1,0,0]=2 1322 B7R0.2 OC(=O)CC(Cl)CCl Amb25335414 [0,1,0,0,0,0|1,0,0]=2 1323 B7R0.2 OC(=O)CC(F)C=O Amb25114270 [0,1,0,0,0,0|1,0,1]=3 1324 B7R0.2 OC(=O)CN(O)C=O Amb25367291 [0,1,0,0,0,0|2,0,1]=4 1325 B7R0.2 OC(=O)CN(O)N=O Amb25041862 [0,1,0,0,0,0|3,0,0]=4 1326 B7R0.2 OC(=O)\C=C(\Br)/CCl Amb24355885 [0,1,0,0,0,0|1,0,2]=4 1327 B7R0.2 OC(=O)\C=C(\Cl)/CBr Amb25336694 [0,1,0,0,0,0|1,0,2]=4 1328 B7R0.2 OC(CC(=O)Cl)CCl Amb25806118 [0,1,0,0,0,0|2,0,0]=3 1329 B7R0.2 OC(CCl)CC(O)=O Amb18643354 [0,1,0,0,0,0|1,0,0]=2 1330 B7R0.2 OCC(O)CP(O)=O Amb25316128 [0,1,0,0,0,0|2,0,0]=3 1331 B7R0.2 OC[C@@H](CC(=O)O)N Amb16184020 [0,1,0,0,0,0|1,0,0]=2 1332 B7R0.2 OC[C@H](O)CC(O)=O Amb25326979 [0,1,0,0,0,0|1,0,0]=2 1333 B7R0.2 ON=C(CN(C)C)N Amb13777254 [0,1,0,0,0,0|2,0,0]=3 1334 B7R0.2 O[C@H](CBr)CC(O)=O Amb22265826 [0,1,0,0,0,0|1,0,0]=2 1335 B7R0.2 [2H]OC(=O)CN([2H])[2H] Amb22363166 [0,1,0,0,0,0|3,0,0]=4 1336 B7R0.2 [C-]#[N+]C(C)CC(C)C Amb19944627 [0,1,0,0,0,0|2,0,1]=4 1337 B7R0.2 [O-]C(=O)CC(O)C=O Amb22733997 [0,1,0,0,0,0|1,0,2]=4 1338 B7R0.2 [O-]C(=O)CC(O)CO Amb24117078 [0,1,0,0,0,0|1,0,1]=3 1339 B7R0.2 [O-][N+](=O)CC(=O)OC Amb1101938 [0,1,0,0,0,0|3,0,0]=4 1340 B7R0.2 [O-][N+](=O)CC(Cl)CCl Amb22347684 [0,1,0,0,0,0|2,0,1]=4 1341 B7R0.9 CC(=C)CC(C)(C)O Amb22052674 [0,1,0,0,0,0|2,0,0]=3 1342 B7R0.9 CC(=C)C[Si](C)(C)C Amb19651088 [0,1,0,0,0,0|2,1,0]=4 1343 B7R0.9 CC(=C)C[Si](C)(C)Cl Amb25174267 [0,1,0,0,0,0|2,1,0]=4 1344 B7R0.9 CC(=O)C=P(C)(C)C Amb24481480 [0,1,0,0,0,0|2,0,1]=4 1345 B7R0.9 CC(=O)CC(C)(C)F Amb25758912 [0,1,0,0,0,0|1,0,0]=2 1346 B7R0.9 CC(=O)CC(C)(F)F Amb21951914 [0,1,0,0,0,0|2,0,0]=3 1347 B7R0.9 CC(=O)CC(C)(S)S Amb25767704 [0,1,0,0,0,0|2,0,0]=3 1348 B7R0.9 CC(=O)CC(Cl)(Cl)Cl Amb24750259 [0,1,0,0,0,0|3,0,0]=4 1349 B7R0.9 CC(=O)CC(S)(C)C Amb17593394 [0,1,0,0,0,0|1,0,0]=2 1350 B7R0.9 CC(=O)CP(C)(C)=O Amb25370726 [0,1,0,0,0,0|2,0,0]=3 1351 B7R0.9 CC(=O)CP(O)(O)=O Amb24706713 [0,1,0,0,0,0|2,0,1]=4 1352 B7R0.9 CC(=O)CS(O)(=O)=O Amb24751070 [0,1,0,0,0,0|2,0,1]=4 1353 B7R0.9 CC(=O)C[Si](C)(C)C Amb24411725 [0,1,0,0,0,0|1,1,0]=3 1354 B7R0.9 CC(=O)O[Pb](C)(C)C Amb22338591 [0,1,0,0,0,0|3,0,0]=4 1355 B7R0.9 CC(=O)SC(C)(C)C Amb22231459 [0,1,0,0,0,0|2,0,0]=3 1356 B7R0.9 CC(Br)CC(C)(C)Br Amb25832199 [0,1,0,0,0,0|2,0,1]=4 1357 B7R0.9 CC(Br)CC(C)(C)O Amb25857792 [0,1,0,0,0,0|2,0,1]=4 1358 B7R0.9 CC(C)(C)C=C(Cl)Cl Amb25350694 [0,1,0,0,0,0|2,0,1]=4 1359 B7R0.9 CC(C)(C)CC(N)=N Amb25336905 [0,1,0,0,0,0|2,0,0]=3 1360 B7R0.9 CC(C)(C)CP(Cl)Cl Amb22009461 [0,1,0,0,0,0|3,0,0]=4 1361 B7R0.9 CC(C)(C)CS(O)=O Amb24614665 [0,1,0,0,0,0|1,0,0]=2 1362 B7R0.9 CC(C)(C)NC(=O)Cl Amb25770497 [0,1,0,0,0,0|2,0,0]=3 1363 B7R0.9 CC(C)(C)NC(=O)F Amb25350572 [0,1,0,0,0,0|2,0,0]=3 1364 B7R0.9 CC(C)(C)NC(N)=N Amb22736568 [0,1,0,0,0,0|3,0,0]=4 1365 B7R0.9 CC(C)(C)NC(N)=N Amb25339377 [0,1,0,0,0,0|3,0,0]=4 1366 B7R0.9 CC(C)(C)NC(S)=S Amb24540569 [0,1,0,0,0,0|1,2,0]=4 1367 B7R0.9 CC(C)(C)OC(=O)F Amb25241785 [0,1,0,0,0,0|2,0,0]=3 1368 B7R0.9 CC(C)(C)OC(N)=N Amb25228221 [0,1,0,0,0,0|3,0,0]=4 1369 B7R0.9 CC(C)(C)OC([O-])=O Amb22731240 [0,1,0,0,0,0|1,0,1]=3 1370 B7R0.9 CC(C)(C)O[N+]([O-])=O Amb25746030 [0,1,0,0,0,0|2,0,1]=4 1371 B7R0.9 CC(C)(C)SC(=O)Cl Amb22353785 [0,1,0,0,0,0|2,0,0]=3 1372 B7R0.9 CC(C)(C)SC(N)=N Amb25188068 [0,1,0,0,0,0|3,0,0]=4 1373 B7R0.9 CC(C)(C)SC(N)=O Amb25365837 [0,1,0,0,0,0|2,0,0]=3 1374 B7R0.9 CC(C)(C)SC(N)=S Amb24640024 [0,1,0,0,0,0|2,1,0]=4 1375 B7R0.9 CC(C)(Cl)CC(Cl)Cl Amb24483110 [0,1,0,0,0,0|2,0,1]=4 1376 B7R0.9 CC(C)(N)CC(N)=O Amb23402094 [0,1,0,0,0,0|1,0,0]=2 1377 B7R0.9 CC(C)(N)CC(N)=O Amb24271090 [0,1,0,0,0,0|1,0,0]=2 1378 B7R0.9 CC(C)(N)CC(O)=O Amb19267108 [0,1,0,0,0,0|0,0,0]=1 1379 B7R0.9 CC(C)(O)CC(N)=S Amb24711517 [0,1,0,0,0,0|1,1,0]=3 1380 B7R0.9 CC(C)(O)CC(O)O Amb25115429 [0,1,0,0,0,0|0,0,2]=3 1381 B7R0.9 CC(C)(O)CC([O-])=O Amb17678748 [0,1,0,0,0,0|0,0,1]=2 1382 B7R0.9 CC(C)(O)CC([O-])=O Amb22729769 [0,1,0,0,0,0|0,0,1]=2 1383 B7R0.9 CC(C)(O)SC(N)=N Amb24605523 [0,1,0,0,0,0|3,0,0]=4 1384 B7R0.9 CC(C)=CC(C)(C)N Amb18641755 [0,1,0,0,0,0|2,0,1]=4 1385 B7R0.9 CC(C)=CC(C)(C)O Amb24382092 [0,1,0,0,0,0|2,0,1]=4 1386 B7R0.9 CC(C)CC(C)(C)N Amb22491280 [0,1,0,0,0,0|2,0,1]=4 1387 B7R0.9 CC(C)CC(F)(F)F Amb25065552 [0,1,0,0,0,0|2,0,1]=4 1388 B7R0.9 CC(C)CS(=O)(=O)Br Amb23555503 [0,1,0,0,0,0|1,0,1]=3 1389 B7R0.9 CC(C)CS(=O)(=O)F Amb19893332 [0,1,0,0,0,0|1,0,1]=3 1390 B7R0.9 CC(C)CS(C)(=O)=O Amb25106217 [0,1,0,0,0,0|1,0,1]=3 1391 B7R0.9 CC(C)CS([O-])(=O)=O Amb24423773 [0,1,0,0,0,0|1,0,1]=3 1392 B7R0.9 CC(C)C[Si](C)(C)C Amb24334587 [0,1,0,0,0,0|2,1,0]=4 1393 B7R0.9 CC(C)C[Si](C)(C)Cl Amb19893895 [0,1,0,0,0,0|2,1,0]=4 1394 B7R0.9 CC(C)C[Si](C)(Cl)Cl Amb19893907 [0,1,0,0,0,0|2,1,0]=4 1395 B7R0.9 CC(C)OP(C)(=O)Cl Amb25110250 [0,1,0,0,0,0|3,0,0]=4 1396 B7R0.9 CC(C)OP(O)(O)=O Amb22493772 [0,1,0,0,0,0|2,0,0]=3 1397 B7R0.9 CC(C)O[P@](C)(O)=S Amb25025723 [0,1,0,0,0,0|2,1,0]=4 1398 B7R0.9 CC(CS(=O)(=O)N)C Amb13951979 [0,1,0,0,0,0|1,0,1]=3 1399 B7R0.9 CC(CS(=O)(=O)O)O Amb17593541 [0,1,0,0,0,0|2,0,0]=3 1400 B7R0.9 CC(Cl)CC(C)(C)O Amb24483118 [0,1,0,0,0,0|2,0,1]=4 1401 B7R0.9 CC(Cl)CP(=O)(Cl)Cl Amb24373200 [0,1,0,0,0,0|3,0,0]=4 1402 B7R0.9 CC(Cl)CP(O)(O)=O Amb25169519 [0,1,0,0,0,0|2,0,0]=3 1403 B7R0.9 CC(Cl)CS(=O)(=O)Cl Amb24377686 [0,1,0,0,0,0|2,0,1]=4 1404 B7R0.9 CC(Cl)CS(=O)(=O)F Amb25232964 [0,1,0,0,0,0|2,0,1]=4 1405 B7R0.9 CC(Cl)CS(C)(=O)=O Amb24355393 [0,1,0,0,0,0|2,0,1]=4 1406 B7R0.9 CC(F)CC(C)(C)N Amb25681386 [0,1,0,0,0,0|2,0,1]=4 1407 B7R0.9 CC(F)CS(=O)(=O)Cl Amb25340385 [0,1,0,0,0,0|2,0,1]=4 1408 B7R0.9 CC(N)CC(C)(C)C Amb18202855 [0,1,0,0,0,0|2,0,1]=4 1409 B7R0.9 CC(N)CC(C)(C)N Amb18641911 [0,1,0,0,0,0|2,0,1]=4 1410 B7R0.9 CC(N)CC(C)(C)O Amb18641931 [0,1,0,0,0,0|2,0,1]=4 1411 B7R0.9 CC(N)CC(C)(C)S Amb25062807 [0,1,0,0,0,0|2,0,1]=4 1412 B7R0.9 CC(N)CP(C)(O)=O Amb24482995 [0,1,0,0,0,0|2,0,0]=3 1413 B7R0.9 CC(N)CS(C)(=O)=O Amb18963904 [0,1,0,0,0,0|2,0,1]=4 1414 B7R0.9 CC(N)CS(C)(=O)=O Amb19515149 [0,1,0,0,0,0|2,0,1]=4 1415 B7R0.9 CC(O)CC(C)(C)Br Amb25842064 [0,1,0,0,0,0|1,0,1]=3 1416 B7R0.9 CC(O)CC(C)(C)C Amb22337936 [0,1,0,0,0,0|1,0,1]=3 1417 B7R0.9 CC(O)CC(C)(C)Cl Amb25234407 [0,1,0,0,0,0|1,0,1]=3 1418 B7R0.9 CC(O)CC(C)(C)S Amb22047633 [0,1,0,0,0,0|1,0,1]=3 1419 B7R0.9 CC(O)CS(=O)(=O)Cl Amb25032356 [0,1,0,0,0,0|2,0,1]=4 1420 B7R0.9 CC(O)CS(C)(=O)=O Amb21988449 [0,1,0,0,0,0|2,0,1]=4 1421 B7R0.9 CC(O)C[N+](C)(C)C Amb22730751 [0,1,0,0,0,0|2,0,1]=4 1422 B7R0.9 CC(O)C[N+](C)(C)C Amb22732451 [0,1,0,0,0,0|2,0,1]=4 1423 B7R0.9 CC(O)NC(C)(C)C Amb25025703 [0,1,0,0,0,0|2,0,1]=4 1424 B7R0.9 CC(O)OC(C)(C)C Amb24474144 [0,1,0,0,0,0|2,0,1]=4 1425 B7R0.9 CC(OP(=O)(O)C)C Amb10842159 [0,1,0,0,0,0|2,0,0]=3 1426 B7R0.9 CC(S)CS(O)(=O)=O Amb24543740 [0,1,0,0,0,0|2,0,0]=3 1427 B7R0.9 CN(C)(C)CC(O)=O Amb22343422 [0,1,0,0,0,0|1,0,0]=2 1428 B7R0.9 CN(C)CC(C)(C)N Amb22587257 [0,1,0,0,0,0|3,0,0]=4 1429 B7R0.9 CN(C)CC(C)(C)S Amb24481461 [0,1,0,0,0,0|3,0,0]=4 1430 B7R0.9 CN(CC(C)(C)C)C Amb17231823 [0,1,0,0,0,0|3,0,0]=4 1431 B7R0.9 CN(CC(O)(C)C)C Amb17138367 [0,1,0,0,0,0|2,0,1]=4 1432 B7R0.9 CN(N)CC(C)(C)S Amb18124415 [0,1,0,0,0,0|3,0,0]=4 1433 B7R0.9 CP(C)(=O)CC(O)=O Amb25197683 [0,1,0,0,0,0|1,0,0]=2 1434 B7R0.9 CS(=O)NC(C)(C)C Amb25745583 [0,1,0,0,0,0|3,0,0]=4 1435 B7R0.9 CS(C)(=O)=NC(=O)Cl Amb25130459 [0,1,0,0,0,0|3,0,0]=4 1436 B7R0.9 CS(C)(Br)CC(O)=O Amb25829058 [0,1,0,0,0,0|1,0,0]=2 1437 B7R0.9 C[As+](C)(C)CC([O-])=O Amb22347917 [0,1,0,0,0,0|1,0,1]=3 1438 B7R0.9 C[C@@H](N)CP(C)(O)=O Amb24460368 [0,1,0,0,0,0|2,0,0]=3 1439 B7R0.9 C[C@@H](N)CP(O)(O)=O Amb25338674 [0,1,0,0,0,0|2,0,0]=3 1440 B7R0.9 C[C@@H](N)CS(O)(=O)=O Amb24670475 [0,1,0,0,0,0|2,0,0]=3 1441 B7R0.9 C[C@@H](O)CC(C)(C)C Amb24544035 [0,1,0,0,0,0|1,0,1]=3 1442 B7R0.9 C[C@@H](O)CC(C)(C)S Amb25333750 [0,1,0,0,0,0|1,0,1]=3 1443 B7R0.9 C[C@@H](O)CP(O)(O)=O Amb24334038 [0,1,0,0,0,0|2,0,0]=3 1444 B7R0.9 C[C@@H](O)C[N+](C)(C)C Amb25741401 [0,1,0,0,0,0|2,0,1]=4 1445 B7R0.9 C[C@H](CC(O)(C)C)O Amb10606102 [0,1,0,0,0,0|1,0,1]=3 1446 B7R0.9 C[C@H](N)CC(C)(C)C Amb25710523 [0,1,0,0,0,0|2,0,1]=4 1447 B7R0.9 C[C@H](N)CS(=O)(=O)Cl Amb25328940 [0,1,0,0,0,0|2,0,1]=4 1448 B7R0.9 C[C@H](N)CS(C)(=O)=O Amb24654003 [0,1,0,0,0,0|2,0,1]=4 1449 B7R0.9 C[C@H](N)CS(O)(=O)=O Amb25760668 [0,1,0,0,0,0|2,0,0]=3 1450 B7R0.9 C[C@H](O)CC(C)(C)C Amb24672407 [0,1,0,0,0,0|1,0,1]=3 1451 B7R0.9 C[C@H](O)CC(C)(C)O Amb20669803 [0,1,0,0,0,0|1,0,1]=3 1452 B7R0.9 C[C@H](O)CC(C)(C)S Amb24457778 [0,1,0,0,0,0|1,0,1]=3 1453 B7R0.9 C[C@H](O)CP(O)(O)=O Amb25715996 [0,1,0,0,0,0|2,0,0]=3 1454 B7R0.9 C[C@H](O)C[N+](C)(C)C Amb25823063 [0,1,0,0,0,0|2,0,1]=4 1455 B7R0.9 C[N+](C)(C)CC(O)=O Amb22734051 [0,1,0,0,0,0|1,0,0]=2 1456 B7R0.9 C[N+](C)(C)CC([O-])=O Amb22002454 [0,1,0,0,0,0|1,0,1]=3 1457 B7R0.9 C[N+](C)(C)CC([O-])=O Amb22167465 [0,1,0,0,0,0|1,0,1]=3 1458 B7R0.9 C[N+](C)(C)CC([O-])=O Amb22584414 [0,1,0,0,0,0|1,0,1]=3 1459 B7R0.9 C[N+](C)(N)CC(N)=O Amb25361686 [0,1,0,0,0,0|2,0,0]=3 1460 B7R0.9 C[P+](C)(C)CC(O)=O Amb24753800 [0,1,0,0,0,0|1,0,0]=2 1461 B7R0.9 C[S+](C)CC(C)(C)N Amb25032309 [0,1,0,0,0,0|3,0,0]=4 1462 B7R0.9 C[Si](C)(C)CB(O)O Amb21962888 [0,1,0,0,0,0|1,1,1]=4 1463 B7R0.9 C[Si](C)(C)CC(=C)Br Amb19893648 [0,1,0,0,0,0|2,1,0]=4 1464 B7R0.9 C[Si](C)(C)CC(N)=O Amb24574114 [0,1,0,0,0,0|1,1,0]=3 1465 B7R0.9 C[Si](C)(C)CC(O)=O Amb19894126 [0,1,0,0,0,0|0,1,0]=2 1466 B7R0.9 ClC(=C)C[N+](C)(C)C Amb10552683 [0,1,0,0,0,0|3,0,0]=4 1467 B7R0.9 ClC(CC(C)(C)C)Br Amb10568704 [0,1,0,0,0,0|2,0,1]=4 1468 B7R0.9 NC(=O)OC(C)(C)C Amb2236390 [0,1,0,0,0,0|2,0,0]=3 1469 B7R0.9 NC(=S)NC(C)(C)C Amb1152302 [0,1,0,0,0,0|2,1,0]=4 1470 B7R0.9 OB(CC(C)(C)C)O Amb13890355 [0,1,0,0,0,0|1,0,1]=3 1471 B7R0.9 OC(=O)CC(F)(F)Br Amb24373833 [0,1,0,0,0,0|2,0,0]=3 1472 B7R0.9 OC(=O)CC(O)(C)C Amb10605560 [0,1,0,0,0,0|0,0,0]=1 1473 B7R0.9 OC(=O)CS(=O)(=O)O Amb16232248 [0,1,0,0,0,0|3,0,0]=4 1474 B7R0.9 OC(=O)C[As+](C)(C)C Amb17608518 [0,1,0,0,0,0|1,0,0]=2 1475 B7R0.9 OC(=O)OC(F)(F)F Amb22387984 [0,1,0,0,0,0|3,0,0]=4 1476 B7R0.9 [2H]C([2H])([2H])CC(C)=O Amb22351764 [0,1,0,0,0,0|3,0,0]=4 1477 B7R0.9 [2H]C([2H])([2H])CC(O)=O Amb22338080 [0,1,0,0,0,0|2,0,0]=3 1478 B7R0.9 [O-]C(=O)C[N+](C)(C)C Amb10843741 [0,1,0,0,0,0|1,0,1]=3 1479 B7R0.16 BrC(C(=O)Cl)C(C)C Amb17569838 [0,1,0,0,0,0|1,0,0]=2 1480 B7R0.16 BrC(C(=O)O)C(=O)O Amb17594708 [0,1,0,0,0,0|2,0,1]=4 1481 B7R0.16 C=C(Br)C(O)C(O)=O Amb24692957 [0,1,0,0,0,0|1,0,2]=4 1482 B7R0.16 C=C(Br)[C@H](N)C(O)=O Amb24383876 [0,1,0,0,0,0|1,0,2]=4 1483 B7R0.16 C=C(C(F)F)C(O)=O Amb24117234 [0,1,0,0,0,0|2,0,1]=4 1484 B7R0.16 C=C(Cl)C(N)C(O)=O Amb18643039 [0,1,0,0,0,0|1,0,2]=4 1485 B7R0.16 C=C(F)C(N)C(O)=O Amb18641967 [0,1,0,0,0,0|1,0,2]=4 1486 B7R0.16 CC(=C(C(=O)O)Br)C Amb17594579 [0,1,0,0,0,0|0,0,2]=3 1487 B7R0.16 CC(=C(C(=O)O)C)C Amb17593186 [0,1,0,0,0,0|0,0,2]=3 1488 B7R0.16 CC(=C(C)C)C(=O)C Amb17593162 [0,1,0,0,0,0|1,0,2]=4 1489 B7R0.16 CC(=C)C(=O)C(C)C Amb25353284 [0,1,0,0,0,0|2,0,1]=4 1490 B7R0.16 CC(=C)C(C)C(O)=O Amb18641781 [0,1,0,0,0,0|0,0,2]=3 1491 B7R0.16 CC(=C)C(F)N(C)C Amb25758673 [0,1,0,0,0,0|3,0,0]=4 1492 B7R0.16 CC(=C)C(I)N(C)C Amb25144769 [0,1,0,0,0,0|3,0,0]=4 1493 B7R0.16 CC(=C)C(N)C(O)=O Amb18641831 [0,1,0,0,0,0|0,0,2]=3 1494 B7R0.16 CC(=C)[C@@H](C)C(O)=O Amb25355239 [0,1,0,0,0,0|0,0,2]=3 1495 B7R0.16 CC(=C)[C@@H](N)C(=C)O Amb25308010 [0,1,0,0,0,0|1,0,2]=4 1496 B7R0.16 CC(=O)C(=C)C(C)C Amb25713676 [0,1,0,0,0,0|1,0,1]=3 1497 B7R0.16 CC(=O)C(=C)N(C)C Amb24363792 [0,1,0,0,0,0|2,0,1]=4 1498 B7R0.16 CC(=O)C(=O)C(C)Br Amb24055325 [0,1,0,0,0,0|2,0,1]=4 1499 B7R0.16 CC(=O)C(=O)C(C)Cl Amb24483301 [0,1,0,0,0,0|2,0,1]=4 1500 B7R0.16 CC(=O)C(=O)C(C)O Amb25173440 [0,1,0,0,0,0|2,0,1]=4 1501 B7R0.16 CC(=O)C(=O)C(O)=O Amb24101563 [0,1,0,0,0,0|1,0,2]=4 1502 B7R0.16 CC(=O)C(Br)C(C)=C Amb24533829 [0,1,0,0,0,0|1,0,2]=4 1503 B7R0.16 CC(=O)C(Br)C(C)=O Amb22000680 [0,1,0,0,0,0|2,0,1]=4 1504 B7R0.16 CC(=O)C(Br)C(N)=O Amb24483263 [0,1,0,0,0,0|2,0,1]=4 1505 B7R0.16 CC(=O)C(C)C(=O)S Amb25094430 [0,1,0,0,0,0|1,1,1]=4 1506 B7R0.16 CC(=O)C(Cl)C(N)=O Amb24056422 [0,1,0,0,0,0|2,0,1]=4 1507 B7R0.16 CC(=O)C(F)C(C)=O Amb19889779 [0,1,0,0,0,0|2,0,1]=4 1508 B7R0.16 CC(=O)C(F)C(F)F Amb25697000 [0,1,0,0,0,0|3,0,0]=4 1509 B7R0.16 CC(=O)C(N)C(O)=O Amb21962887 [0,1,0,0,0,0|1,0,1]=3 1510 B7R0.16 CC(=O)C(O)C(C)=C Amb24614054 [0,1,0,0,0,0|1,0,2]=4 1511 B7R0.16 CC(Br)C(=O)C(O)=O Amb23400913 [0,1,0,0,0,0|1,0,1]=3 1512 B7R0.16 CC(Br)C(=O)C([O-])=O Amb19516024 [0,1,0,0,0,0|1,0,2]=4 1513 B7R0.16 CC(Br)C(Br)[N+]([O-])=O Amb24545947 [0,1,0,0,0,0|2,0,1]=4 1514 B7R0.16 CC(Br)C(Cl)C(C)O Amb25232311 [0,1,0,0,0,0|2,0,1]=4 1515 B7R0.16 CC(Br)C(N)C(O)=O Amb25775046 [0,1,0,0,0,0|1,0,0]=2 1516 B7R0.16 CC(C(=C)Br)C(O)=O Amb24483212 [0,1,0,0,0,0|1,0,2]=4 1517 B7R0.16 CC(C(=C)C(=O)O)C Amb17593189 [0,1,0,0,0,0|0,0,1]=2 1518 B7R0.16 CC(C(=O)C)C(=O)C Amb1152249 [0,1,0,0,0,0|2,0,1]=4 1519 B7R0.16 CC(C(=O)N)C(=O)C Amb10552518 [0,1,0,0,0,0|2,0,1]=4 1520 B7R0.16 CC(C(=O)O)C(=O)C Amb10601660 [0,1,0,0,0,0|1,0,1]=3 1521 B7R0.16 CC(C(=O)O)C(C)C Amb17087469 [0,1,0,0,0,0|0,0,0]=1 1522 B7R0.16 CC(C(C(=O)C)Br)C Amb2389580 [0,1,0,0,0,0|1,0,0]=2 1523 B7R0.16 CC(C(C(=O)C)C)O Amb17593202 [0,1,0,0,0,0|2,0,0]=3 1524 B7R0.16 CC(C(C(=O)O)Br)O Amb17594710 [0,1,0,0,0,0|1,0,0]=2 1525 B7R0.16 CC(C(C(=O)O)C)O Amb17615515 [0,1,0,0,0,0|1,0,0]=2 1526 B7R0.16 CC(C(C(=O)O)Cl)O Amb17593522 [0,1,0,0,0,0|1,0,0]=2 1527 B7R0.16 CC(C(C(=O)O)N)F Amb10838661 [0,1,0,0,0,0|1,0,0]=2 1528 B7R0.16 CC(C(C(=O)O)N)S Amb17593434 [0,1,0,0,0,0|1,0,0]=2 1529 B7R0.16 CC(C(C)=O)=S(C)C Amb25833593 [0,1,0,0,0,0|2,0,1]=4 1530 B7R0.16 CC(C(C)=O)S(C)=O Amb24481498 [0,1,0,0,0,0|3,0,0]=4 1531 B7R0.16 CC(C(C)Br)C(O)=O Amb25111271 [0,1,0,0,0,0|1,0,0]=2 1532 B7R0.16 CC(C(C)C)C(C)C Amb22045195 [0,1,0,0,0,0|2,0,1]=4 1533 B7R0.16 CC(C(C)Cl)C(N)=O Amb25785669 [0,1,0,0,0,0|2,0,0]=3 1534 B7R0.16 CC(C(C)N)C(C)=O Amb24411022 [0,1,0,0,0,0|2,0,0]=3 1535 B7R0.16 CC(C(C)N)C(C)O Amb25293031 [0,1,0,0,0,0|2,0,1]=4 1536 B7R0.16 CC(C(C)N)C(O)=O Amb18124261 [0,1,0,0,0,0|1,0,0]=2 1537 B7R0.16 CC(C(C)O)C(N)=O Amb24481579 [0,1,0,0,0,0|2,0,0]=3 1538 B7R0.16 CC(C(C)O)C(N)=S Amb24583963 [0,1,0,0,0,0|2,1,0]=4 1539 B7R0.16 CC(C(C)S)C(O)=O Amb25842057 [0,1,0,0,0,0|1,0,0]=2 1540 B7R0.16 CC(C(N)=O)N(C)C Amb25679024 [0,1,0,0,0,0|2,0,0]=3 1541 B7R0.16 CC(C(N)=S)C(O)=O Amb24745670 [0,1,0,0,0,0|2,0,1]=4 1542 B7R0.16 CC(C(O)=O)=C(C)Br Amb24557990 [0,1,0,0,0,0|1,0,2]=4 1543 B7R0.16 CC(C(O)=O)=C(C)Cl Amb24481381 [0,1,0,0,0,0|1,0,2]=4 1544 B7R0.16 CC(C(O)=O)=C(C)N Amb24527948 [0,1,0,0,0,0|1,0,2]=4 1545 B7R0.16 CC(C(O)=O)N(C)Br Amb24743147 [0,1,0,0,0,0|2,0,0]=3 1546 B7R0.16 CC(C(O)=O)N(C)C Amb21955631 [0,1,0,0,0,0|1,0,0]=2 1547 B7R0.16 CC(C(O)=O)N(C)N Amb22372039 [0,1,0,0,0,0|2,0,0]=3 1548 B7R0.16 CC(C(O)=O)N(C)O Amb24714002 [0,1,0,0,0,0|2,0,0]=3 1549 B7R0.16 CC(C(O)=O)S(C)=O Amb18950743 [0,1,0,0,0,0|2,0,0]=3 1550 B7R0.16 CC(C(O)=O)S(O)=O Amb25680146 [0,1,0,0,0,0|3,0,0]=4 1551 B7R0.16 CC(C(O)C)C(O)C Amb2583260 [0,1,0,0,0,0|2,0,1]=4 1552 B7R0.16 CC(C)=C(Br)C(C)=O Amb25792957 [0,1,0,0,0,0|1,0,2]=4 1553 B7R0.16 CC(C)=C(C)C(C)C Amb22347879 [0,1,0,0,0,0|2,0,1]=4 1554 B7R0.16 CC(C)=C(Cl)C(O)=O Amb18642954 [0,1,0,0,0,0|0,0,2]=3 1555 B7R0.16 CC(C)=C(F)C(N)=O Amb25075288 [0,1,0,0,0,0|1,0,2]=4 1556 B7R0.16 CC(C)=C(F)C(O)=O Amb20669103 [0,1,0,0,0,0|0,0,2]=3 1557 B7R0.16 CC(C)=C(S)C(O)=O Amb25360161 [0,1,0,0,0,0|0,0,2]=3 1558 B7R0.16 CC(C)C(=C)C(C)O Amb25781672 [0,1,0,0,0,0|1,0,2]=4 1559 B7R0.16 CC(C)C(=C)C(N)=O Amb24709685 [0,1,0,0,0,0|1,0,1]=3 1560 B7R0.16 CC(C)C(=O)C(=C)Br Amb24631595 [0,1,0,0,0,0|2,0,1]=4 1561 B7R0.16 CC(C)C(=O)C(=C)Cl Amb25707505 [0,1,0,0,0,0|2,0,1]=4 1562 B7R0.16 CC(C)C(=S)C(O)=O Amb25244596 [0,1,0,0,0,0|0,0,1]=2 1563 B7R0.16 CC(C)C(Br)C(Br)=O Amb17666947 [0,1,0,0,0,0|1,0,0]=2 1564 B7R0.16 CC(C)C(Br)C(C)Br Amb19930171 [0,1,0,0,0,0|2,0,1]=4 1565 B7R0.16 CC(C)C(Br)C(C)C Amb24529092 [0,1,0,0,0,0|2,0,1]=4 1566 B7R0.16 CC(C)C(Br)C(N)=S Amb24524277 [0,1,0,0,0,0|1,1,0]=3 1567 B7R0.16 CC(C)C(C)C(C)=C Amb24649761 [0,1,0,0,0,0|2,0,0]=3 1568 B7R0.16 CC(C)C(C)C(C)=O Amb17940267 [0,1,0,0,0,0|1,0,0]=2 1569 B7R0.16 CC(C)C(C)C(C)Br Amb18178621 [0,1,0,0,0,0|2,0,1]=4 1570 B7R0.16 CC(C)C(C)C(C)N Amb18523753 [0,1,0,0,0,0|2,0,1]=4 1571 B7R0.16 CC(C)C(C)C(C)O Amb24640694 [0,1,0,0,0,0|1,0,1]=3 1572 B7R0.16 CC(C)C(C)C(Cl)Cl Amb24441954 [0,1,0,0,0,0|2,0,1]=4 1573 B7R0.16 CC(C)C(C)C(N)=O Amb25810126 [0,1,0,0,0,0|1,0,0]=2 1574 B7R0.16 CC(C)C(C)N(C)C Amb24660887 [0,1,0,0,0,0|3,0,0]=4 1575 B7R0.16 CC(C)C(C)S(C)=O Amb24528110 [0,1,0,0,0,0|2,0,0]=3 1576 B7R0.16 CC(C)C(C)S([O-])=O Amb25685559 [0,1,0,0,0,0|1,0,1]=3 1577 B7R0.16 CC(C)C(Cl)C(=C)Cl Amb25360075 [0,1,0,0,0,0|2,0,0]=3 1578 B7R0.16 CC(C)C(Cl)C(=O)Cl Amb24483174 [0,1,0,0,0,0|1,0,0]=2 1579 B7R0.16 CC(C)C(Cl)C(C)=C Amb24483132 [0,1,0,0,0,0|2,0,0]=3 1580 B7R0.16 CC(C)C(Cl)C(C)=O Amb24483197 [0,1,0,0,0,0|1,0,0]=2 1581 B7R0.16 CC(C)C(Cl)C(C)O Amb25124794 [0,1,0,0,0,0|1,0,1]=3 1582 B7R0.16 CC(C)C(Cl)C(Cl)Cl Amb25205182 [0,1,0,0,0,0|2,0,1]=4 1583 B7R0.16 CC(C)C(Cl)C(N)=O Amb25337426 [0,1,0,0,0,0|1,0,0]=2 1584 B7R0.16 CC(C)C(Cl)S(C)=O Amb24482117 [0,1,0,0,0,0|2,0,0]=3 1585 B7R0.16 CC(C)C(F)C(=O)Cl Amb25142402 [0,1,0,0,0,0|1,0,0]=2 1586 B7R0.16 CC(C)C(F)C(C)N Amb25747428 [0,1,0,0,0,0|2,0,1]=4 1587 B7R0.16 CC(C)C(F)C(N)=O Amb24616703 [0,1,0,0,0,0|1,0,0]=2 1588 B7R0.16 CC(C)C(F)C(O)=O Amb19957386 [0,1,0,0,0,0|0,0,0]=1 1589 B7R0.16 CC(C)C(N)B(O)O Amb24482349 [0,1,0,0,0,0|1,0,1]=3 1590 B7R0.16 CC(C)C(N)C(=O)S Amb25064101 [0,1,0,0,0,0|0,1,0]=2 1591 B7R0.16 CC(C)C(N)C(C)=C Amb18641748 [0,1,0,0,0,0|2,0,0]=3 1592 B7R0.16 CC(C)C(N)C(C)=O Amb23536905 [0,1,0,0,0,0|1,0,0]=2 1593 B7R0.16 CC(C)C(N)C(C)C Amb20668320 [0,1,0,0,0,0|2,0,1]=4 1594 B7R0.16 CC(C)C(N)C(C)F Amb25339711 [0,1,0,0,0,0|2,0,1]=4 1595 B7R0.16 CC(C)C(N)C(C)O Amb18641932 [0,1,0,0,0,0|1,0,1]=3 1596 B7R0.16 CC(C)C(N)C(F)F Amb24054178 [0,1,0,0,0,0|2,0,1]=4 1597 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,1,0,0,0,0|1,0,0]=2 1598 B7R0.16 CC(C)C(N)C(N)=S Amb19148044 [0,1,0,0,0,0|1,1,0]=3 1599 B7R0.16 CC(C)C(N)[13C](O)=O Amb22338653 [0,1,0,0,0,0|0,0,0]=1 1600 B7R0.16 CC(C)C(O)C(C)=O Amb25087800 [0,1,0,0,0,0|1,0,0]=2 1601 B7R0.16 CC(C)C(O)C(N)=N Amb24447862 [0,1,0,0,0,0|2,0,0]=3 1602 B7R0.16 CC(C)C(O)C(N)=O Amb25124434 [0,1,0,0,0,0|1,0,0]=2 1603 B7R0.16 CC(C)C(S)C(C)C Amb25055458 [0,1,0,0,0,0|2,0,1]=4 1604 B7R0.16 CC(C)C(S)C(N)=O Amb25315643 [0,1,0,0,0,0|1,0,0]=2 1605 B7R0.16 CC(C)C(S)C(O)=O Amb18282761 [0,1,0,0,0,0|0,0,0]=1 1606 B7R0.16 CC(C)C([15NH2])C(O)=O Amb22363191 [0,1,0,0,0,0|0,0,0]=1 1607 B7R0.16 CC(C)N(C)C(=O)Cl Amb25807313 [0,1,0,0,0,0|2,0,0]=3 1608 B7R0.16 CC(C)N(C)C(C)=N Amb24402006 [0,1,0,0,0,0|3,0,0]=4 1609 B7R0.16 CC(C)N(C)C(N)=N Amb19514715 [0,1,0,0,0,0|3,0,0]=4 1610 B7R0.16 CC(C)N(N)C(N)=O Amb24679360 [0,1,0,0,0,0|2,0,0]=3 1611 B7R0.16 CC(C)N(O)C(N)=O Amb18202545 [0,1,0,0,0,0|2,0,0]=3 1612 B7R0.16 CC(C)[13CH](N)C(O)=O Amb22367349 [0,1,0,0,0,0|0,0,0]=1 1613 B7R0.16 CC(C)[C@@H](Br)C(=O)Cl Amb25708357 [0,1,0,0,0,0|1,0,0]=2 1614 B7R0.16 CC(C)[C@@H](C)C(C)=O Amb24753185 [0,1,0,0,0,0|1,0,0]=2 1615 B7R0.16 CC(C)[C@@H](Cl)B(O)O Amb25109627 [0,1,0,0,0,0|1,0,1]=3 1616 B7R0.16 CC(C)[C@@H](Cl)C(O)=O Amb22353101 [0,1,0,0,0,0|0,0,0]=1 1617 B7R0.16 CC(C)[C@@H](F)C(O)=O Amb25083215 [0,1,0,0,0,0|0,0,0]=1 1618 B7R0.16 CC(C)[C@@H](N)C(C)=O Amb25757023 [0,1,0,0,0,0|1,0,0]=2 1619 B7R0.16 CC(C)[C@@H](N)C(C)O Amb24575417 [0,1,0,0,0,0|1,0,1]=3 1620 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,1,0,0,0,0|1,0,0]=2 1621 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,1,0,0,0,0|1,0,0]=2 1622 B7R0.16 CC(C)[C@@H](N)C(O)=O Amb22746777 [0,1,0,0,0,0|0,0,0]=1 1623 B7R0.16 CC(C)[C@@H](N)[C@@H](C)O Amb24540375 [0,1,0,0,0,0|1,0,1]=3 1624 B7R0.16 CC(C)[C@@H](N)[C@H](C)N Amb24713159 [0,1,0,0,0,0|2,0,1]=4 1625 B7R0.16 CC(C)[C@@H](O)C(C)=O Amb24379445 [0,1,0,0,0,0|1,0,0]=2 1626 B7R0.16 CC(C)[C@@H](O)[C@@H](C)N Amb24679635 [0,1,0,0,0,0|2,0,1]=4 1627 B7R0.16 CC(C)[C@@H](O)[C@H](C)Cl Amb25144907 [0,1,0,0,0,0|2,0,1]=4 1628 B7R0.16 CC(C)[C@@H](O)[C@H](C)O Amb24332475 [0,1,0,0,0,0|1,0,1]=3 1629 B7R0.16 CC(C)[C@@H](S)C(O)=O Amb25320674 [0,1,0,0,0,0|0,0,0]=1 1630 B7R0.16 CC(C)[C@H](N)C(=O)Cl Amb25679283 [0,1,0,0,0,0|1,0,0]=2 1631 B7R0.16 CC(C)[C@H](N)C(=O)S Amb24427323 [0,1,0,0,0,0|0,1,0]=2 1632 B7R0.16 CC(C)[C@H](N)C(C)F Amb25325181 [0,1,0,0,0,0|2,0,1]=4 1633 B7R0.16 CC(C)[C@H](N)C(F)F Amb25291007 [0,1,0,0,0,0|2,0,1]=4 1634 B7R0.16 CC(C)[C@H](N)C(N)=S Amb24714667 [0,1,0,0,0,0|1,1,0]=3 1635 B7R0.16 CC(C)[C@H](N)C(O)=O Amb22351111 [0,1,0,0,0,0|0,0,0]=1 1636 B7R0.16 CC(C)[C@H](N)[13C](O)=O Amb22354046 [0,1,0,0,0,0|0,0,0]=1 1637 B7R0.16 CC(C)[C@H](N)[C@@H](C)O Amb24611787 [0,1,0,0,0,0|1,0,1]=3 1638 B7R0.16 CC(C)[C@H](O)C(=O)Cl Amb25285621 [0,1,0,0,0,0|1,0,0]=2 1639 B7R0.16 CC(C)[C@H](O)C(C)=O Amb25723739 [0,1,0,0,0,0|1,0,0]=2 1640 B7R0.16 CC(C)[C@H](O)[C@@H](C)O Amb24591386 [0,1,0,0,0,0|1,0,1]=3 1641 B7R0.16 CC(C)[C@H](O)[C@H](C)O Amb25043671 [0,1,0,0,0,0|1,0,1]=3 1642 B7R0.16 CC(C)[C@H](S)C(O)=O Amb25662094 [0,1,0,0,0,0|0,0,0]=1 1643 B7R0.16 CC(C)[N+]([O-])=C(C)C Amb24563492 [0,1,0,0,0,0|3,0,0]=4 1644 B7R0.16 CC(Cl)=C(Cl)C(O)=O Amb25272743 [0,1,0,0,0,0|1,0,2]=4 1645 B7R0.16 CC(Cl)C(=C)C(O)=O Amb24701921 [0,1,0,0,0,0|1,0,1]=3 1646 B7R0.16 CC(Cl)C(C)C(=O)Cl Amb25209986 [0,1,0,0,0,0|2,0,0]=3 1647 B7R0.16 CC(Cl)C(Cl)C(C)=O Amb25713717 [0,1,0,0,0,0|2,0,0]=3 1648 B7R0.16 CC(Cl)C(Cl)C(N)=O Amb24357982 [0,1,0,0,0,0|2,0,0]=3 1649 B7R0.16 CC(Cl)C(Cl)S(=O)Cl Amb25232963 [0,1,0,0,0,0|3,0,0]=4 1650 B7R0.16 CC(Cl)C(N)C(O)=O Amb25269614 [0,1,0,0,0,0|1,0,0]=2 1651 B7R0.16 CC(Cl)C(O)C(C)=C Amb25257975 [0,1,0,0,0,0|3,0,0]=4 1652 B7R0.16 CC(Cl)C(O)C(O)=O Amb25222028 [0,1,0,0,0,0|1,0,0]=2 1653 B7R0.16 CC(F)C(Br)C(O)=O Amb25304346 [0,1,0,0,0,0|1,0,0]=2 1654 B7R0.16 CC(F)C(F)C(O)=O Amb24687273 [0,1,0,0,0,0|1,0,0]=2 1655 B7R0.16 CC(F)C(O)C(O)=O Amb24385715 [0,1,0,0,0,0|1,0,0]=2 1656 B7R0.16 CC(N(C(=O)N)C)C Amb1132046 [0,1,0,0,0,0|2,0,0]=3 1657 B7R0.16 CC(N(C(=S)N)C)C Amb1131841 [0,1,0,0,0,0|2,1,0]=4 1658 B7R0.16 CC(N)C(N)C(O)=O Amb17678795 [0,1,0,0,0,0|1,0,0]=2 1659 B7R0.16 CC(N)C(N)C(O)=O Amb22728051 [0,1,0,0,0,0|1,0,0]=2 1660 B7R0.16 CC(N)C(O)C(C)=C Amb24525272 [0,1,0,0,0,0|3,0,0]=4 1661 B7R0.16 CC(N)C(O)C(O)=O Amb18641970 [0,1,0,0,0,0|1,0,0]=2 1662 B7R0.16 CC(N)[C@H](N)C(O)=O Amb25083113 [0,1,0,0,0,0|1,0,0]=2 1663 B7R0.16 CC(O)=C(O)C(C)O Amb25227909 [0,1,0,0,0,0|2,0,1]=4 1664 B7R0.16 CC(O)C(=C)C(N)=O Amb24694487 [0,1,0,0,0,0|2,0,1]=4 1665 B7R0.16 CC(O)C(=O)C(O)=O Amb24481396 [0,1,0,0,0,0|1,0,1]=3 1666 B7R0.16 CC(O)C(N)C(C)=O Amb25026434 [0,1,0,0,0,0|2,0,0]=3 1667 B7R0.16 CC(O)C(N)C(C)O Amb24374632 [0,1,0,0,0,0|2,0,1]=4 1668 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [0,1,0,0,0,0|2,0,0]=3 1669 B7R0.16 CC(O)C(N)P(O)=O Amb24428649 [0,1,0,0,0,0|2,0,0]=3 1670 B7R0.16 CC(O)C(N)P(O)O Amb25305040 [0,1,0,0,0,0|2,0,1]=4 1671 B7R0.16 CC(O)C(O)C(O)=O Amb18124272 [0,1,0,0,0,0|1,0,0]=2 1672 B7R0.16 CC(O)C(O)C(O)O Amb25792462 [0,1,0,0,0,0|1,0,2]=4 1673 B7R0.16 CC(O)N(C)C(O)=O Amb22641864 [0,1,0,0,0,0|2,0,0]=3 1674 B7R0.16 CC(O)[C@@H](C)C(O)=O Amb25857406 [0,1,0,0,0,0|1,0,0]=2 1675 B7R0.16 CC(S)C(Cl)C(N)=O Amb24483091 [0,1,0,0,0,0|2,0,0]=3 1676 B7R0.16 CC(S)[C@@H](N)C(O)=O Amb24606864 [0,1,0,0,0,0|1,0,0]=2 1677 B7R0.16 CC(S)[C@H](N)C(O)=O Amb25684204 [0,1,0,0,0,0|1,0,0]=2 1678 B7R0.16 CC([C@@H](C)N)C(O)=O Amb24680995 [0,1,0,0,0,0|1,0,0]=2 1679 B7R0.16 CN(C(=O)C(=O)C)C Amb17399799 [0,1,0,0,0,0|2,0,1]=4 1680 B7R0.16 CN(C)C(=N)C(O)=O Amb18641880 [0,1,0,0,0,0|1,0,1]=3 1681 B7R0.16 CN(C)C(=O)C(N)=O Amb24652690 [0,1,0,0,0,0|2,0,1]=4 1682 B7R0.16 CN(C)C(=S)C(N)=O Amb24101259 [0,1,0,0,0,0|2,0,1]=4 1683 B7R0.16 CN(C)C(=S)C(O)=O Amb24068793 [0,1,0,0,0,0|1,0,1]=3 1684 B7R0.16 CN(C)C(N)C(O)=O Amb24746695 [0,1,0,0,0,0|1,0,0]=2 1685 B7R0.16 CN(C)N(C)C(N)=O Amb25061983 [0,1,0,0,0,0|3,0,0]=4 1686 B7R0.16 C[C@@H](C(=O)O)C(C)C Amb10844600 [0,1,0,0,0,0|0,0,0]=1 1687 B7R0.16 C[C@@H](C(N)=O)N(C)C Amb25031426 [0,1,0,0,0,0|2,0,0]=3 1688 B7R0.16 C[C@@H](C(O)=O)N(C)C Amb22587534 [0,1,0,0,0,0|1,0,0]=2 1689 B7R0.16 C[C@@H](C(O)=O)N(C)Cl Amb24640409 [0,1,0,0,0,0|2,0,0]=3 1690 B7R0.16 C[C@@H](Cl)[C@@H](Br)C(O)=O Amb24526448 [0,1,0,0,0,0|1,0,0]=2 1691 B7R0.16 C[C@@H](Cl)[C@@H](O)C(O)=O Amb24445574 [0,1,0,0,0,0|1,0,0]=2 1692 B7R0.16 C[C@@H](F)[C@H](N)C(O)=O Amb25789807 [0,1,0,0,0,0|1,0,0]=2 1693 B7R0.16 C[C@@H](N)[C@@H](N)C(O)=O Amb22745396 [0,1,0,0,0,0|1,0,0]=2 1694 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb22745441 [0,1,0,0,0,0|1,0,0]=2 1695 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb24481409 [0,1,0,0,0,0|1,0,0]=2 1696 B7R0.16 C[C@@H](O)C(C)C(O)=O Amb24469914 [0,1,0,0,0,0|1,0,0]=2 1697 B7R0.16 C[C@@H](O)C(N)C(C)O Amb24394814 [0,1,0,0,0,0|2,0,1]=4 1698 B7R0.16 C[C@@H](O)[13C@H](N)[13C](O)=O Amb22336905 [0,1,0,0,0,0|1,0,0]=2 1699 B7R0.16 C[C@@H](O)[C@@H](C)C(O)=O Amb24481394 [0,1,0,0,0,0|1,0,0]=2 1700 B7R0.16 C[C@@H](O)[C@@H](N)C(C)=O Amb25238428 [0,1,0,0,0,0|2,0,0]=3 1701 B7R0.16 C[C@@H](O)[C@@H](O)C(C)=O Amb24701454 [0,1,0,0,0,0|2,0,0]=3 1702 B7R0.16 C[C@@H](O)[C@H](F)C(O)=O Amb24470562 [0,1,0,0,0,0|1,0,0]=2 1703 B7R0.16 C[C@@H](O)[C@H](N)C(C)O Amb25141789 [0,1,0,0,0,0|2,0,1]=4 1704 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [0,1,0,0,0,0|2,0,0]=3 1705 B7R0.16 C[C@@H](O)[C@H](N)C(O)=O Amb22351168 [0,1,0,0,0,0|1,0,0]=2 1706 B7R0.16 C[C@@H](O)[C@H](O)C(C)=O Amb24481484 [0,1,0,0,0,0|2,0,0]=3 1707 B7R0.16 C[C@@H](O)[C@H]([15NH2])C(O)=O Amb22353591 [0,1,0,0,0,0|1,0,0]=2 1708 B7R0.16 C[C@@H](S)[C@@H](N)C(O)=O Amb24333717 [0,1,0,0,0,0|1,0,0]=2 1709 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24117242 [0,1,0,0,0,0|1,0,0]=2 1710 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24726915 [0,1,0,0,0,0|1,0,0]=2 1711 B7R0.16 C[C@@H]([C@@H](C)N)C(O)=O Amb24410324 [0,1,0,0,0,0|1,0,0]=2 1712 B7R0.16 C[C@@H]([C@@H](C)O)C(=C)Br Amb25144623 [0,1,0,0,0,0|3,0,0]=4 1713 B7R0.16 C[C@@H]([C@H](C(=O)O)C)O Amb10844569 [0,1,0,0,0,0|1,0,0]=2 1714 B7R0.16 C[C@@H]([C@H](C)O)C(C)=C Amb25091688 [0,1,0,0,0,0|3,0,0]=4 1715 B7R0.16 C[C@H](Br)[C@H](N)C(O)=O Amb24711401 [0,1,0,0,0,0|1,0,0]=2 1716 B7R0.16 C[C@H](C(=O)O)C(C)C Amb10844601 [0,1,0,0,0,0|0,0,0]=1 1717 B7R0.16 C[C@H](C(N)=O)N(C)C Amb24687546 [0,1,0,0,0,0|2,0,0]=3 1718 B7R0.16 C[C@H](C(O)=O)N(C)C Amb22586633 [0,1,0,0,0,0|1,0,0]=2 1719 B7R0.16 C[C@H](F)[C@H](N)C(O)=O Amb25805291 [0,1,0,0,0,0|1,0,0]=2 1720 B7R0.16 C[C@H](N)C(=C)C(O)=O Amb24631906 [0,1,0,0,0,0|1,0,1]=3 1721 B7R0.16 C[C@H](N)C(O)C(N)=O Amb24431514 [0,1,0,0,0,0|2,0,0]=3 1722 B7R0.16 C[C@H](N)C(O)C(O)=O Amb24649032 [0,1,0,0,0,0|1,0,0]=2 1723 B7R0.16 C[C@H](N)[C@@H](F)C(N)=O Amb25825111 [0,1,0,0,0,0|2,0,0]=3 1724 B7R0.16 C[C@H](N)[C@@H](F)C(O)=O Amb25293984 [0,1,0,0,0,0|1,0,0]=2 1725 B7R0.16 C[C@H](N)[C@@H](N)C(O)=O Amb17678796 [0,1,0,0,0,0|1,0,0]=2 1726 B7R0.16 C[C@H](N)[C@H](F)C(N)=O Amb24483015 [0,1,0,0,0,0|2,0,0]=3 1727 B7R0.16 C[C@H](N)[C@H](N)C(O)=O Amb17678797 [0,1,0,0,0,0|1,0,0]=2 1728 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb19929490 [0,1,0,0,0,0|1,0,0]=2 1729 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb24407396 [0,1,0,0,0,0|1,0,0]=2 1730 B7R0.16 C[C@H](O)C(N)C(O)=O Amb24377632 [0,1,0,0,0,0|1,0,0]=2 1731 B7R0.16 C[C@H](O)[C@@H](O)C(C)=C Amb24719527 [0,1,0,0,0,0|3,0,0]=4 1732 B7R0.16 C[C@H](O)[C@@H](O)C(O)=O Amb25844932 [0,1,0,0,0,0|1,0,0]=2 1733 B7R0.16 C[C@H](O)[C@H](N)C(N)=O Amb25746274 [0,1,0,0,0,0|2,0,0]=3 1734 B7R0.16 C[C@H](O)[C@H](O)C(=C)Br Amb25333755 [0,1,0,0,0,0|3,0,0]=4 1735 B7R0.16 C[C@H](O)[C@H](O)C(C)=C Amb24688259 [0,1,0,0,0,0|3,0,0]=4 1736 B7R0.16 C[C@H](S)[C@H](N)C(O)=O Amb25131648 [0,1,0,0,0,0|1,0,0]=2 1737 B7R0.16 C[C@H]([C@@H](C(=O)N)N)O Amb16183845 [0,1,0,0,0,0|2,0,0]=3 1738 B7R0.16 C[C@H]([C@@H](C(=O)O)C)O Amb10844572 [0,1,0,0,0,0|1,0,0]=2 1739 B7R0.16 C[C@H]([C@@H](C)N)C(C)=O Amb25254240 [0,1,0,0,0,0|2,0,0]=3 1740 B7R0.16 C[C@H]([C@@H](C)N)C(O)=O Amb25679842 [0,1,0,0,0,0|1,0,0]=2 1741 B7R0.16 C[C@H]([C@@H](C)O)C(C)=O Amb25144117 [0,1,0,0,0,0|2,0,0]=3 1742 B7R0.16 C[C@H]([C@@H](C)O)N(C)C Amb25306535 [0,1,0,0,0,0|2,0,1]=4 1743 B7R0.16 C[C@H]([C@@H]([13C](=O)O)N)O Amb17620634 [0,1,0,0,0,0|1,0,0]=2 1744 B7R0.16 C[C@H]([C@H](C)N)[C@@H](C)O Amb25242605 [0,1,0,0,0,0|2,0,1]=4 1745 B7R0.16 C[C@H]([C@H](C)O)S(C)=O Amb24332098 [0,1,0,0,0,0|3,0,0]=4 1746 B7R0.16 C[C@H]([C@H](C)O)[C@@H](C)O Amb24445952 [0,1,0,0,0,0|2,0,1]=4 1747 B7R0.16 C[C@H]([C@H](C)S)C(O)=O Amb24481380 [0,1,0,0,0,0|1,0,0]=2 1748 B7R0.16 C\C(\C(O)=O)=C(\C)/Br Amb18124498 [0,1,0,0,0,0|1,0,2]=4 1749 B7R0.16 C\C(\O)=C(/O)\C(C)O Amb24364699 [0,1,0,0,0,0|2,0,1]=4 1750 B7R0.16 C\C(\O)=C(\N)/C(O)=O Amb25320750 [0,1,0,0,0,0|1,0,2]=4 1751 B7R0.16 Cl[C@H](C(=O)O)C(C)C Amb16232072 [0,1,0,0,0,0|0,0,0]=1 1752 B7R0.16 NC(=O)C(Cl)C(O)=O Amb25756168 [0,1,0,0,0,0|2,0,1]=4 1753 B7R0.16 NC(=O)C(F)C(O)=O Amb25376646 [0,1,0,0,0,0|2,0,1]=4 1754 B7R0.16 NC(=O)C(N)C(O)=O Amb24552728 [0,1,0,0,0,0|2,0,1]=4 1755 B7R0.16 NC(=O)C(O)C(O)=O Amb24548669 [0,1,0,0,0,0|2,0,1]=4 1756 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,1,0,0,0,0|2,0,1]=4 1757 B7R0.16 NC(C(Cl)Cl)C(O)=O Amb24433439 [0,1,0,0,0,0|2,0,0]=3 1758 B7R0.16 NC(C(F)F)C(O)=O Amb24713127 [0,1,0,0,0,0|2,0,0]=3 1759 B7R0.16 NC(C(O)=O)S(O)=O Amb24464759 [0,1,0,0,0,0|3,0,0]=4 1760 B7R0.16 NC(C(O)O)C(O)=O Amb25682498 [0,1,0,0,0,0|2,0,0]=3 1761 B7R0.16 N[C@@H](C(Cl)Cl)C(O)=O Amb25101008 [0,1,0,0,0,0|2,0,0]=3 1762 B7R0.16 N[C@@H](C(F)F)C(O)=O Amb24433723 [0,1,0,0,0,0|2,0,0]=3 1763 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16183986 [0,1,0,0,0,0|1,0,0]=2 1764 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16231400 [0,1,0,0,0,0|1,0,0]=2 1765 B7R0.16 N[C@H](C(F)F)C(O)=O Amb24659125 [0,1,0,0,0,0|2,0,0]=3 1766 B7R0.16 OC(=O)C(=O)C(Br)Br Amb24179214 [0,1,0,0,0,0|2,0,1]=4 1767 B7R0.16 OC(=O)C(=O)C(Cl)Cl Amb24652562 [0,1,0,0,0,0|2,0,1]=4 1768 B7R0.16 OC(=O)C(=O)C(F)Br Amb25111221 [0,1,0,0,0,0|2,0,1]=4 1769 B7R0.16 OC(=O)C(Cl)C(Cl)Cl Amb24426145 [0,1,0,0,0,0|2,0,0]=3 1770 B7R0.16 OC(=O)C(Cl)C(O)=O Amb18643353 [0,1,0,0,0,0|2,0,1]=4 1771 B7R0.16 OC(=O)C(F)C(O)=O Amb24055884 [0,1,0,0,0,0|2,0,1]=4 1772 B7R0.16 OC(C(=O)O)C(=O)O Amb1215315 [0,1,0,0,0,0|2,0,1]=4 1773 B7R0.16 OC(C(=O)O)C(C)C Amb2582547 [0,1,0,0,0,0|0,0,0]=1 1774 B7R0.16 OC(C(F)F)C(O)=O Amb25074883 [0,1,0,0,0,0|2,0,0]=3 1775 B7R0.16 OC(C(N)C)C(C)C Amb17470364 [0,1,0,0,0,0|2,0,1]=4 1776 B7R0.16 OC(C(O)=O)S(O)=O Amb24551214 [0,1,0,0,0,0|3,0,0]=4 1777 B7R0.16 O[C@@H](C(=O)O)C(C)C Amb10071589 [0,1,0,0,0,0|0,0,0]=1 1778 B7R0.16 [13CH3]C([13CH3])C(=O)C([O-])=O Amb22353581 [0,1,0,0,0,0|0,0,2]=3 1779 B7R0.16 [13CH3]C([13CH3])[13C](=O)[13C]([O-])=O Amb22338387 [0,1,0,0,0,0|0,0,2]=3 1780 B7R0.16 [13CH3][13C@@H](O)[13C@H]([15NH2])[13C](O)=O Amb22353590 [0,1,0,0,0,0|1,0,0]=2 1781 B7R0.16 [13CH3][13CH]([13CH3])[13C@H]([15NH2])[13C](O)=O Amb22338876 [0,1,0,0,0,0|0,0,0]=1 1782 B7R0.16 [14CH3][14CH](O)[14CH](N)[14C](O)=O Amb22352529 [0,1,0,0,0,0|1,0,0]=2 1783 B7R1.2 BrC1=CC(=O)OC1 Amb10067500 [0,0,0,1,0,0|1,0,2]=4 1784 B7R1.2 C=C1CC(=O)NC1 Amb25767177 [0,0,0,1,0,0|1,0,2]=4 1785 B7R1.2 C=C1CC(=O)OC1 Amb24589821 [0,0,0,1,0,0|0,0,2]=3 1786 B7R1.2 C=C1CC(Br)CC1 Amb25135798 [0,0,0,1,0,0|3,0,0]=4 1787 B7R1.2 C=C1CC(N)CC1 Amb24352464 [0,0,0,1,0,0|3,0,0]=4 1788 B7R1.2 C=C1CC(O)CC1 Amb25246529 [0,0,0,1,0,0|3,0,0]=4 1789 B7R1.2 C=C1COC(=O)N1 Amb24541155 [0,0,0,1,0,0|1,0,2]=4 1790 B7R1.2 C=C1COC(=O)O1 Amb20248769 [0,0,0,1,0,0|1,0,2]=4 1791 B7R1.2 CC1=COC(=O)O1 Amb24693155 [0,0,0,1,0,0|1,0,2]=4 1792 B7R1.2 CC1C=CC(=O)N1 Amb25248060 [0,0,0,1,0,0|2,0,1]=4 1793 B7R1.2 CC1C=CC(=O)O1 Amb24053964 [0,0,0,1,0,0|2,0,1]=4 1794 B7R1.2 CC1C=CC(=O)S1 Amb25746305 [0,0,0,1,0,0|2,0,1]=4 1795 B7R1.2 CC1C=NC(=O)S1 Amb20620625 [0,0,0,1,0,0|2,0,1]=4 1796 B7R1.2 CC1CC(=O)CS1 Amb23598370 [0,0,0,1,0,0|2,0,0]=3 1797 B7R1.2 CC1CC(=O)NC1 Amb10608004 [0,0,0,1,0,0|1,0,0]=2 1798 B7R1.2 CC1CC(Br)CO1 Amb25108601 [0,0,0,1,0,0|2,0,1]=4 1799 B7R1.2 CC1CC(Cl)CC1 Amb25129430 [0,0,0,1,0,0|2,0,1]=4 1800 B7R1.2 CC1CC(N)CC1 Amb20669202 [0,0,0,1,0,0|2,0,1]=4 1801 B7R1.2 CC1CC(N)CC1 Amb24062164 [0,0,0,1,0,0|2,0,1]=4 1802 B7R1.2 CC1CC(O)CN1 Amb20668139 [0,0,0,1,0,0|2,0,1]=4 1803 B7R1.2 CC1CC(O)CS1 Amb24660406 [0,0,0,1,0,0|2,0,1]=4 1804 B7R1.2 CC1CC(S)CC1 Amb25829470 [0,0,0,1,0,0|1,1,1]=4 1805 B7R1.2 CC1CC=C(C)C1 Amb17674172 [0,0,0,1,0,0|2,0,0]=3 1806 B7R1.2 CC1CCC(=N)N1 Amb24479850 [0,0,0,1,0,0|3,0,0]=4 1807 B7R1.2 CC1CCC(=O)N1 Amb19267101 [0,0,0,1,0,0|2,0,0]=3 1808 B7R1.2 CC1CCC(=S)O1 Amb25361484 [0,0,0,1,0,0|2,1,0]=4 1809 B7R1.2 CC1CCC(C)=C1 Amb24479860 [0,0,0,1,0,0|2,0,1]=4 1810 B7R1.2 CC1CCC(C)=N1 Amb24598049 [0,0,0,1,0,0|3,0,0]=4 1811 B7R1.2 CC1CCC(O)O1 Amb22295909 [0,0,0,1,0,0|2,0,1]=4 1812 B7R1.2 CC1CN(N)CC1 Amb24385963 [0,0,0,1,0,0|3,0,0]=4 1813 B7R1.2 CC1CN=C(C)O1 Amb25360042 [0,0,0,1,0,0|3,0,0]=4 1814 B7R1.2 CC1CN=C(S)O1 Amb25196024 [0,0,0,1,0,0|2,1,0]=4 1815 B7R1.2 CC1CNC(=N)S1 Amb24684074 [0,0,0,1,0,0|3,0,0]=4 1816 B7R1.2 CC1CNC(=O)N1 Amb17506853 [0,0,0,1,0,0|2,0,0]=3 1817 B7R1.2 CC1CNC(=O)O1 Amb19651732 [0,0,0,1,0,0|2,0,0]=3 1818 B7R1.2 CC1CNC(=O)S1 Amb25367335 [0,0,0,1,0,0|2,0,0]=3 1819 B7R1.2 CC1CNC(=S)S1 Amb17845151 [0,0,0,1,0,0|2,1,0]=4 1820 B7R1.2 CC1CNC(C)=C1 Amb25806978 [0,0,0,1,0,0|2,0,1]=4 1821 B7R1.2 CC1CNC(C)=N1 Amb22733191 [0,0,0,1,0,0|3,0,0]=4 1822 B7R1.2 CC1CNC(C)C1 Amb19335336 [0,0,0,1,0,0|2,0,1]=4 1823 B7R1.2 CC1CNC(N)=N1 Amb25186469 [0,0,0,1,0,0|3,0,0]=4 1824 B7R1.2 CC1COC(=O)C1 Amb22231914 [0,0,0,1,0,0|0,0,0]=1 1825 B7R1.2 CC1COC(=O)N1 Amb19517037 [0,0,0,1,0,0|1,0,0]=2 1826 B7R1.2 CC1COC(=S)N1 Amb24479649 [0,0,0,1,0,0|1,1,0]=3 1827 B7R1.2 CC1COC(N)=N1 Amb23449369 [0,0,0,1,0,0|2,0,0]=3 1828 B7R1.2 CC1COC(O)O1 Amb25204639 [0,0,0,1,0,0|1,0,2]=4 1829 B7R1.2 CC1COS(=O)O1 Amb22346070 [0,0,0,1,0,0|2,0,0]=3 1830 B7R1.2 CC1CS(=O)CC1 Amb24333540 [0,0,0,1,0,0|2,0,0]=3 1831 B7R1.2 CC1CSC(=O)C1 Amb25136024 [0,0,0,1,0,0|0,1,0]=2 1832 B7R1.2 CC1CSC(=O)S1 Amb22055765 [0,0,0,1,0,0|1,1,0]=3 1833 B7R1.2 CC1CSC(=S)N1 Amb25849326 [0,0,0,1,0,0|1,2,0]=4 1834 B7R1.2 CC1CSC(Cl)=N1 Amb25811136 [0,0,0,1,0,0|2,1,0]=4 1835 B7R1.2 CC1CSC(N)=N1 Amb25076082 [0,0,0,1,0,0|2,1,0]=4 1836 B7R1.2 CC1NCC(C1)C Amb17593077 [0,0,0,1,0,0|2,0,1]=4 1837 B7R1.2 CC1NNC(=O)C1 Amb2371659 [0,0,0,1,0,0|2,0,0]=3 1838 B7R1.2 CC1NNC(=O)O1 Amb25832289 [0,0,0,1,0,0|3,0,0]=4 1839 B7R1.2 CC1OC(=O)CS1 Amb25314322 [0,0,0,1,0,0|3,0,0]=4 1840 B7R1.2 CC1OCC(C)O1 Amb24074042 [0,0,0,1,0,0|2,0,1]=4 1841 B7R1.2 CC1OCC(N1)C Amb17506156 [0,0,0,1,0,0|2,0,1]=4 1842 B7R1.2 CC1[N-]OC(=O)N1 Amb24481515 [0,0,0,1,0,0|2,0,0]=3 1843 B7R1.2 CC=1CC(=O)CC1 Amb25319016 [0,0,0,1,0,0|1,0,2]=4 1844 B7R1.2 CC=1CC(=O)ON1 Amb22274079 [0,0,0,1,0,0|1,0,1]=3 1845 B7R1.2 CC=1CNC(=O)C1 Amb24479892 [0,0,0,1,0,0|1,0,2]=4 1846 B7R1.2 CC=1COC(=O)C1 Amb22002703 [0,0,0,1,0,0|0,0,2]=3 1847 B7R1.2 CC=1NOC(=O)N1 Amb22491279 [0,0,0,1,0,0|2,0,1]=4 1848 B7R1.2 CN1CC(=O)CC1 Amb22236123 [0,0,0,1,0,0|2,0,0]=3 1849 B7R1.2 CN1CCC(=O)N1 Amb24064860 [0,0,0,1,0,0|3,0,0]=4 1850 B7R1.2 CN1CCC(O)=C1 Amb24079726 [0,0,0,1,0,0|2,0,1]=4 1851 B7R1.2 CN1CC[C@@H](C1)O Amb10070789 [0,0,0,1,0,0|2,0,1]=4 1852 B7R1.2 CN1CNC(=O)C1 Amb24733801 [0,0,0,1,0,0|2,0,0]=3 1853 B7R1.2 CN1C[C@@H](O)CC1 Amb22748868 [0,0,0,1,0,0|2,0,1]=4 1854 B7R1.2 CP1CC(O)CC1 Amb24661188 [0,0,0,1,0,0|2,0,1]=4 1855 B7R1.2 C[C@@H]1C=CC(=O)O1 Amb25114434 [0,0,0,1,0,0|2,0,1]=4 1856 B7R1.2 C[C@@H]1CC(=O)CC1 Amb22801305 [0,0,0,1,0,0|1,0,0]=2 1857 B7R1.2 C[C@@H]1CC(O)OC1 Amb25795468 [0,0,0,1,0,0|0,0,2]=3 1858 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [0,0,0,1,0,0|1,0,0]=2 1859 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [0,0,0,1,0,0|2,0,0]=3 1860 B7R1.2 C[C@@H]1CCC(O)O1 Amb25369337 [0,0,0,1,0,0|2,0,1]=4 1861 B7R1.2 C[C@@H]1CC[C@@H](O)O1 Amb25176141 [0,0,0,1,0,0|2,0,1]=4 1862 B7R1.2 C[C@@H]1CC[C@H](O)O1 Amb25175220 [0,0,0,1,0,0|2,0,1]=4 1863 B7R1.2 C[C@@H]1CN=C(N)S1 Amb24479897 [0,0,0,1,0,0|3,0,0]=4 1864 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [0,0,0,1,0,0|1,0,0]=2 1865 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [0,0,0,1,0,0|2,0,0]=3 1866 B7R1.2 C[C@@H]1CNC(=S)S1 Amb25686959 [0,0,0,1,0,0|2,1,0]=4 1867 B7R1.2 C[C@@H]1CN[C@@H](C)C1 Amb25026729 [0,0,0,1,0,0|2,0,1]=4 1868 B7R1.2 C[C@@H]1CN[C@H](C)C1 Amb18195964 [0,0,0,1,0,0|2,0,1]=4 1869 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [0,0,0,1,0,0|0,0,0]=1 1870 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [0,0,0,1,0,0|1,0,0]=2 1871 B7R1.2 C[C@@H]1COC(=S)N1 Amb25823566 [0,0,0,1,0,0|1,1,0]=3 1872 B7R1.2 C[C@@H]1COC(C)=N1 Amb24480955 [0,0,0,1,0,0|2,0,0]=3 1873 B7R1.2 C[C@@H]1CSC(=S)N1 Amb24641156 [0,0,0,1,0,0|1,2,0]=4 1874 B7R1.2 C[C@@H]1C[C@@H](C)CC1 Amb22747863 [0,0,0,1,0,0|2,0,1]=4 1875 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22745222 [0,0,0,1,0,0|2,0,1]=4 1876 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22746400 [0,0,0,1,0,0|2,0,1]=4 1877 B7R1.2 C[C@@H]1C[C@H](Br)CC1 Amb25026616 [0,0,0,1,0,0|2,0,1]=4 1878 B7R1.2 C[C@@H]1C[C@H](C)CC1 Amb22230412 [0,0,0,1,0,0|2,0,1]=4 1879 B7R1.2 C[C@@H]1C[C@H](I)CC1 Amb24561074 [0,0,0,1,0,0|2,0,1]=4 1880 B7R1.2 C[C@@H]1C[C@H](N)CC1 Amb25179651 [0,0,0,1,0,0|2,0,1]=4 1881 B7R1.2 C[C@@H]1C[C@H](O)CC1 Amb25241408 [0,0,0,1,0,0|1,0,1]=3 1882 B7R1.2 C[C@@H]1C[C@H](O)CN1 Amb22886268 [0,0,0,1,0,0|2,0,1]=4 1883 B7R1.2 C[C@@H]1N[C@@H](C)CO1 Amb25366562 [0,0,0,1,0,0|2,0,1]=4 1884 B7R1.2 C[C@H]1C=CC(=O)O1 Amb13887292 [0,0,0,1,0,0|2,0,1]=4 1885 B7R1.2 C[C@H]1CC(=O)CN1 Amb25746539 [0,0,0,1,0,0|2,0,0]=3 1886 B7R1.2 C[C@H]1CCC(O)O1 Amb25796315 [0,0,0,1,0,0|2,0,1]=4 1887 B7R1.2 C[C@H]1CN=C(N)S1 Amb24479830 [0,0,0,1,0,0|3,0,0]=4 1888 B7R1.2 C[C@H]1CNC(=O)O1 Amb24480854 [0,0,0,1,0,0|2,0,0]=3 1889 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [0,0,0,1,0,0|0,0,0]=1 1890 B7R1.2 C[C@H]1COC(=S)N1 Amb24480906 [0,0,0,1,0,0|1,1,0]=3 1891 B7R1.2 C[C@H]1COC(N)=N1 Amb24654801 [0,0,0,1,0,0|2,0,0]=3 1892 B7R1.2 C[C@H]1C[C@@H](O)CN1 Amb24560197 [0,0,0,1,0,0|2,0,1]=4 1893 B7R1.2 C[C@H]1C[C@H](C)CC1 Amb25176920 [0,0,0,1,0,0|2,0,1]=4 1894 B7R1.2 C[C@H]1C[C@H](I)CC1 Amb25338105 [0,0,0,1,0,0|2,0,1]=4 1895 B7R1.2 C[C@H]1C[C@H](O)CC1 Amb25241604 [0,0,0,1,0,0|1,0,1]=3 1896 B7R1.2 C[C@H]1C[C@H](O)CN1 Amb24523959 [0,0,0,1,0,0|2,0,1]=4 1897 B7R1.2 C[C@H]1C[C@H](O)CO1 Amb25212245 [0,0,0,1,0,0|2,0,1]=4 1898 B7R1.2 C[N+]=1[CH-]C(=O)ON1 Amb21876186 [0,0,0,1,0,0|2,0,1]=4 1899 B7R1.2 ClC1COC(=O)O1 Amb10842117 [0,0,0,1,0,0|2,0,0]=3 1900 B7R1.2 FC1COC(=O)O1 Amb10841016 [0,0,0,1,0,0|2,0,0]=3 1901 B7R1.2 IC1=CC(=O)OC1 Amb2455617 [0,0,0,1,0,0|1,0,2]=4 1902 B7R1.2 NC1CC(=O)CC1 Amb22236085 [0,0,0,1,0,0|2,0,0]=3 1903 B7R1.2 NC1CC(=O)CC1 Amb22494268 [0,0,0,1,0,0|2,0,0]=3 1904 B7R1.2 NC1CC(=O)CS1 Amb25090377 [0,0,0,1,0,0|3,0,0]=4 1905 B7R1.2 NC1CC(=O)NN1 Amb24071024 [0,0,0,1,0,0|3,0,0]=4 1906 B7R1.2 NC1CC(=O)NO1 Amb24640844 [0,0,0,1,0,0|3,0,0]=4 1907 B7R1.2 NC1CC(O)CC1 Amb18561405 [0,0,0,1,0,0|2,0,1]=4 1908 B7R1.2 NC1CC(O)CC1 Amb19958405 [0,0,0,1,0,0|2,0,1]=4 1909 B7R1.2 NC1CCC(=O)N1 Amb24480433 [0,0,0,1,0,0|3,0,0]=4 1910 B7R1.2 NC1CCC(=O)O1 Amb17593085 [0,0,0,1,0,0|3,0,0]=4 1911 B7R1.2 NC1CCC(=O)S1 Amb24479819 [0,0,0,1,0,0|3,0,0]=4 1912 B7R1.2 NC1CNC(=O)C1 Amb17760661 [0,0,0,1,0,0|2,0,0]=3 1913 B7R1.2 NC1COC(=O)N1 Amb23590649 [0,0,0,1,0,0|2,0,0]=3 1914 B7R1.2 NC1CS(=O)CC1 Amb19149072 [0,0,0,1,0,0|3,0,0]=4 1915 B7R1.2 NC1CS(=O)CC1 Amb25133789 [0,0,0,1,0,0|3,0,0]=4 1916 B7R1.2 NC=1COC(=O)N1 Amb24576517 [0,0,0,1,0,0|2,0,1]=4 1917 B7R1.2 N[C@@H]1CC(=O)C=C1 Amb24579377 [0,0,0,1,0,0|2,0,1]=4 1918 B7R1.2 N[C@@H]1CC[C@@H](C1)O Amb10066973 [0,0,0,1,0,0|2,0,1]=4 1919 B7R1.2 N[C@@H]1CC[C@H](C1)O Amb10066961 [0,0,0,1,0,0|2,0,1]=4 1920 B7R1.2 N[C@@H]1CC[C@H](C1)O Amb16233749 [0,0,0,1,0,0|2,0,1]=4 1921 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [0,0,0,1,0,0|2,0,0]=3 1922 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [0,0,0,1,0,0|2,0,0]=3 1923 B7R1.2 N[C@@H]1COS(=O)C1 Amb24612429 [0,0,0,1,0,0|2,0,0]=3 1924 B7R1.2 N[C@@H]1C[C@@H](O)CC1 Amb22386861 [0,0,0,1,0,0|2,0,1]=4 1925 B7R1.2 N[C@@H]1C[C@@H](O)CC1 Amb22746957 [0,0,0,1,0,0|2,0,1]=4 1926 B7R1.2 N[C@@H]1C[C@H](O)CC1 Amb22274622 [0,0,0,1,0,0|2,0,1]=4 1927 B7R1.2 N[C@H]1CC(=O)C=C1 Amb24605966 [0,0,0,1,0,0|2,0,1]=4 1928 B7R1.2 N[C@H]1CC(=O)OC1 Amb16233747 [0,0,0,1,0,0|1,0,0]=2 1929 B7R1.2 N[C@H]1CC[C@@H](C1)O Amb10066972 [0,0,0,1,0,0|2,0,1]=4 1930 B7R1.2 N[C@H]1CC[C@H](C1)O Amb10066971 [0,0,0,1,0,0|2,0,1]=4 1931 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [0,0,0,1,0,0|2,0,0]=3 1932 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [0,0,0,1,0,0|1,0,0]=2 1933 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [0,0,0,1,0,0|1,0,0]=2 1934 B7R1.2 N[C@H]1C[C@@H](O)CC1 Amb22406236 [0,0,0,1,0,0|2,0,1]=4 1935 B7R1.2 O=C1C=C(Cl)CO1 Amb25241116 [0,0,0,1,0,0|1,0,2]=4 1936 B7R1.2 O=C1CC(Br)CC1 Amb24334292 [0,0,0,1,0,0|2,0,0]=3 1937 B7R1.2 O=C1CC(Br)CO1 Amb25803413 [0,0,0,1,0,0|1,0,0]=2 1938 B7R1.2 O=C1CC(Cl)C=C1 Amb25240609 [0,0,0,1,0,0|2,0,1]=4 1939 B7R1.2 O=C1CC(Cl)CO1 Amb24608923 [0,0,0,1,0,0|1,0,0]=2 1940 B7R1.2 O=C1CC(F)CC1 Amb21963553 [0,0,0,1,0,0|2,0,0]=3 1941 B7R1.2 O=C1CC(F)CO1 Amb24431109 [0,0,0,1,0,0|1,0,0]=2 1942 B7R1.2 O=C1CC(I)C=C1 Amb24666810 [0,0,0,1,0,0|2,0,1]=4 1943 B7R1.2 O=C1CC(I)CC1 Amb22001809 [0,0,0,1,0,0|2,0,0]=3 1944 B7R1.2 O=C1CC(S)CN1 Amb25685875 [0,0,0,1,0,0|2,0,0]=3 1945 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [0,0,0,1,0,0|3,0,0]=4 1946 B7R1.2 O=C1CCC(Cl)N1 Amb24689591 [0,0,0,1,0,0|3,0,0]=4 1947 B7R1.2 O=C1CC[C@@H](Cl)O1 Amb24710047 [0,0,0,1,0,0|3,0,0]=4 1948 B7R1.2 O=C1CN(Br)CN1 Amb25112148 [0,0,0,1,0,0|3,0,0]=4 1949 B7R1.2 O=C1CNC(=O)C1 Amb18202984 [0,0,0,1,0,0|2,0,1]=4 1950 B7R1.2 O=C1CSC(=O)C1 Amb22731927 [0,0,0,1,0,0|1,1,1]=4 1951 B7R1.2 O=C1C[C@@H](Br)C=C1 Amb25724437 [0,0,0,1,0,0|2,0,1]=4 1952 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [0,0,0,1,0,0|2,0,0]=3 1953 B7R1.2 O=C1C[C@H](Cl)C=C1 Amb25088364 [0,0,0,1,0,0|2,0,1]=4 1954 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [0,0,0,1,0,0|2,0,0]=3 1955 B7R1.2 O=C1OC=C(C1)O Amb17621628 [0,0,0,1,0,0|1,0,2]=4 1956 B7R1.2 O=C1OCC(=O)N1 Amb1625991 [0,0,0,1,0,0|2,0,1]=4 1957 B7R1.2 O=C1OCC(I)O1 Amb25681787 [0,0,0,1,0,0|2,0,0]=3 1958 B7R1.2 OC1CC(=O)CC1 Amb22057378 [0,0,0,1,0,0|2,0,0]=3 1959 B7R1.2 OC1CC(Br)CC1 Amb25275238 [0,0,0,1,0,0|2,0,1]=4 1960 B7R1.2 OC1CC(S)CC1 Amb25051687 [0,0,0,1,0,0|2,0,1]=4 1961 B7R1.2 OC1CC=C(Br)C1 Amb25662365 [0,0,0,1,0,0|3,0,0]=4 1962 B7R1.2 OC1CC=C(Cl)C1 Amb25215432 [0,0,0,1,0,0|3,0,0]=4 1963 B7R1.2 OC1CCC(=O)N1 Amb21963236 [0,0,0,1,0,0|3,0,0]=4 1964 B7R1.2 OC1CCC(=O)O1 Amb22740957 [0,0,0,1,0,0|3,0,0]=4 1965 B7R1.2 OC1CNC(=O)C1 Amb19958404 [0,0,0,1,0,0|2,0,0]=3 1966 B7R1.2 OC1COC(=O)N1 Amb24428770 [0,0,0,1,0,0|2,0,0]=3 1967 B7R1.2 OC1CSS(=O)C1 Amb25169570 [0,0,0,1,0,0|2,1,0]=4 1968 B7R1.2 O[C@@H]1CC(=O)NC1 Amb15691722 [0,0,0,1,0,0|2,0,0]=3 1969 B7R1.2 O[C@@H]1CN(O)CC1 Amb25025106 [0,0,0,1,0,0|3,0,0]=4 1970 B7R1.2 O[C@H]1CSS(=O)C1 Amb25317551 [0,0,0,1,0,0|2,1,0]=4 1971 B7R1.2 O[C@H]1C[C@H](O)CC1 Amb24519755 [0,0,0,1,0,0|2,0,1]=4 1972 B7R1.2 S[C@@H]1CNC(=S)C1 Amb25215986 [0,0,0,1,0,0|2,1,0]=4 1973 B7R1.2 S[C@H]1CNC(=S)C1 Amb25789949 [0,0,0,1,0,0|2,1,0]=4 1974 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [0,0,0,1,0,0|2,0,0]=3 1975 B7R1.12 C=C1C[C@@H]1C(O)=O Amb24683036 [0,0,0,1,0,0|0,0,2]=3 1976 B7R1.12 C=C1C[C@H]1C(O)=O Amb24368112 [0,0,0,1,0,0|0,0,2]=3 1977 B7R1.12 CC(=O)C1CC1Br Amb24426068 [0,0,0,1,0,0|2,0,0]=3 1978 B7R1.12 CC(=O)C1CC1Cl Amb25321894 [0,0,0,1,0,0|2,0,0]=3 1979 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Br Amb25745820 [0,0,0,1,0,0|2,0,0]=3 1980 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Cl Amb24595358 [0,0,0,1,0,0|2,0,0]=3 1981 B7R1.12 CC(=O)[C@@H]1C[C@H]1Br Amb25110221 [0,0,0,1,0,0|2,0,0]=3 1982 B7R1.12 CC(=O)[C@@H]1C[C@H]1Cl Amb25179033 [0,0,0,1,0,0|2,0,0]=3 1983 B7R1.12 CC(C)C1CC1N Amb18280885 [0,0,0,1,0,0|2,0,1]=4 1984 B7R1.12 CC(C)C1CC1O Amb25355248 [0,0,0,1,0,0|1,0,1]=3 1985 B7R1.12 CC(C)C1OC1Cl Amb24479293 [0,0,0,1,0,0|1,0,1]=3 1986 B7R1.12 CC(C)C1ON1C Amb24479796 [0,0,0,1,0,0|2,0,0]=3 1987 B7R1.12 CC(C)[C@@H]1C[C@H]1N Amb24470295 [0,0,0,1,0,0|2,0,1]=4 1988 B7R1.12 CC1=CC1C(C)=O Amb24736062 [0,0,0,1,0,0|1,0,2]=4 1989 B7R1.12 CC1CC1C(C)=C Amb25694889 [0,0,0,1,0,0|2,0,0]=3 1990 B7R1.12 CC1CC1C(C)=O Amb25720437 [0,0,0,1,0,0|1,0,0]=2 1991 B7R1.12 CC1CC1C(C)N Amb24592597 [0,0,0,1,0,0|2,0,1]=4 1992 B7R1.12 CC1CC1C(C)O Amb25849677 [0,0,0,1,0,0|1,0,1]=3 1993 B7R1.12 CC1CC1C(C)S Amb25102055 [0,0,0,1,0,0|1,1,1]=4 1994 B7R1.12 CC1CC1C(Cl)Cl Amb24595481 [0,0,0,1,0,0|2,0,1]=4 1995 B7R1.12 CC1CC1C(N)=N Amb25139920 [0,0,0,1,0,0|2,0,0]=3 1996 B7R1.12 CC1CC1C(N)=S Amb25302556 [0,0,0,1,0,0|1,1,0]=3 1997 B7R1.12 CC1CC1[C@@H](C)O Amb24683424 [0,0,0,1,0,0|1,0,1]=3 1998 B7R1.12 CC1CC1[C@H](C)N Amb25687220 [0,0,0,1,0,0|2,0,1]=4 1999 B7R1.12 CC1CC1[C@H](C)O Amb25271040 [0,0,0,1,0,0|1,0,1]=3 2000 B7R1.12 CC1OC1C(=O)O Amb17593088 [0,0,0,1,0,0|1,0,0]=2 2001 B7R1.12 CC1OC1C(C)O Amb24687071 [0,0,0,1,0,0|2,0,1]=4 2002 B7R1.12 CC1OC1[C@H](C)O Amb24529514 [0,0,0,1,0,0|2,0,1]=4 2003 B7R1.12 CC1SC1C(C)=O Amb24333031 [0,0,0,1,0,0|2,0,0]=3 2004 B7R1.12 C[C@@H]1C[C@@H]1B(O)O Amb24329037 [0,0,0,1,0,0|1,0,1]=3 2005 B7R1.12 C[C@@H]1C[C@@H]1C(C)=O Amb24670522 [0,0,0,1,0,0|1,0,0]=2 2006 B7R1.12 C[C@@H]1C[C@@H]1C(N)=O Amb25745425 [0,0,0,1,0,0|1,0,0]=2 2007 B7R1.12 C[C@@H]1C[C@@H]1C(O)=O Amb25851678 [0,0,0,1,0,0|0,0,0]=1 2008 B7R1.12 C[C@@H]1C[C@H]1B(O)O Amb24330179 [0,0,0,1,0,0|1,0,1]=3 2009 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [0,0,0,1,0,0|1,0,0]=2 2010 B7R1.12 C[C@@H]1C[C@H]1C(C)N Amb24120602 [0,0,0,1,0,0|2,0,1]=4 2011 B7R1.12 C[C@@H]1C[C@H]1C(C)O Amb24714696 [0,0,0,1,0,0|1,0,1]=3 2012 B7R1.12 C[C@@H]1C[C@H]1C(O)=O Amb22735875 [0,0,0,1,0,0|0,0,0]=1 2013 B7R1.12 C[C@@H]1N[C@H]1C(O)=O Amb24120621 [0,0,0,1,0,0|1,0,0]=2 2014 B7R1.12 C[C@@H]1O[C@@H]1[C@@H](C)O Amb24630796 [0,0,0,1,0,0|2,0,1]=4 2015 B7R1.12 C[C@@H]1O[C@@H]1[C@H](C)O Amb25176663 [0,0,0,1,0,0|2,0,1]=4 2016 B7R1.12 C[C@@H]1O[C@H]1C(C)Br Amb25179247 [0,0,0,1,0,0|2,0,1]=4 2017 B7R1.12 C[C@@H]1O[C@H]1C(O)=O Amb25738149 [0,0,0,1,0,0|1,0,0]=2 2018 B7R1.12 C[C@@H]1O[C@H]1[C@@H](C)O Amb24570001 [0,0,0,1,0,0|2,0,1]=4 2019 B7R1.12 C[C@@H]1S[C@H]1C(C)=O Amb24374150 [0,0,0,1,0,0|2,0,0]=3 2020 B7R1.12 C[C@H]1C[C@@H]1B(O)O Amb24608885 [0,0,0,1,0,0|1,0,1]=3 2021 B7R1.12 C[C@H]1C[C@@H]1C(O)=O Amb22735974 [0,0,0,1,0,0|0,0,0]=1 2022 B7R1.12 C[C@H]1C[C@H]1B(O)O Amb24515113 [0,0,0,1,0,0|1,0,1]=3 2023 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [0,0,0,1,0,0|0,0,0]=1 2024 B7R1.12 C[C@H]1C[C@H]1C(C)=O Amb25236374 [0,0,0,1,0,0|1,0,0]=2 2025 B7R1.12 C[C@H]1C[C@H]1C(C)O Amb24593507 [0,0,0,1,0,0|1,0,1]=3 2026 B7R1.12 C[C@H]1C[C@H]1[C@@H](C)O Amb25026747 [0,0,0,1,0,0|1,0,1]=3 2027 B7R1.12 C[C@H]1O[C@@H]1C(C)O Amb25173891 [0,0,0,1,0,0|2,0,1]=4 2028 B7R1.12 C[C@H]1O[C@H]1C(C)Br Amb24710261 [0,0,0,1,0,0|2,0,1]=4 2029 B7R1.12 C[C@H]1O[C@H]1C(C)O Amb24597224 [0,0,0,1,0,0|2,0,1]=4 2030 B7R1.12 C[C@H]1O[C@H]1[C@H](C)O Amb24671875 [0,0,0,1,0,0|2,0,1]=4 2031 B7R1.12 NC(=O)[C@@H]1C[C@@H]1Br Amb24519223 [0,0,0,1,0,0|2,0,0]=3 2032 B7R1.12 NC1CC1C(N)=O Amb18279694 [0,0,0,1,0,0|2,0,0]=3 2033 B7R1.12 N[C@@H]1C[C@@H]1C(O)=O Amb25708637 [0,0,0,1,0,0|1,0,0]=2 2034 B7R1.12 N[C@@H]1C[C@H]1C(=O)O Amb2372566 [0,0,0,1,0,0|1,0,0]=2 2035 B7R1.12 N[C@H]1C[C@@H]1C(O)=O Amb25204284 [0,0,0,1,0,0|1,0,0]=2 2036 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1Cl Amb25320863 [0,0,0,1,0,0|2,0,0]=3 2037 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1F Amb24403332 [0,0,0,1,0,0|2,0,0]=3 2038 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [0,0,0,1,0,0|2,0,0]=3 2039 B7R1.12 OB(O)C1CC1Br Amb24314265 [0,0,0,1,0,0|2,0,1]=4 2040 B7R1.12 OC(=O)C1CC1F Amb22490547 [0,0,0,1,0,0|1,0,0]=2 2041 B7R1.12 OC(=O)C1CC1S Amb20246988 [0,0,0,1,0,0|1,0,0]=2 2042 B7R1.12 OC(=O)[C@@H]1C[C@@H]1Cl Amb25209184 [0,0,0,1,0,0|1,0,0]=2 2043 B7R1.12 OC(=O)[C@@H]1C[C@@H]1F Amb22737600 [0,0,0,1,0,0|1,0,0]=2 2044 B7R1.12 OC(=O)[C@@H]1C[C@@H]1I Amb22756600 [0,0,0,1,0,0|1,0,0]=2 2045 B7R1.12 OC(=O)[C@@H]1C[C@H]1Br Amb24570997 [0,0,0,1,0,0|1,0,0]=2 2046 B7R1.12 OC(=O)[C@@H]1C[C@H]1F Amb22737604 [0,0,0,1,0,0|1,0,0]=2 2047 B7R1.12 OC(=O)[C@H]1C[C@@H]1F Amb22736113 [0,0,0,1,0,0|1,0,0]=2 2048 B7R1.12 OC(=O)[C@H]1C[C@H]1F Amb22738580 [0,0,0,1,0,0|1,0,0]=2 2049 B7R1.12 OC(=O)[C@H]1C[C@H]1I Amb22736654 [0,0,0,1,0,0|1,0,0]=2 2050 B7R1.12 OC1CC1C(O)=O Amb24360896 [0,0,0,1,0,0|1,0,0]=2 2051 B7R1.16 BrC1CS(=O)(=O)C1 Amb13883571 [0,0,0,1,0,0|2,0,1]=4 2052 B7R1.16 CC1(C)CC(=O)C1 Amb24117921 [0,0,0,1,0,0|1,0,0]=2 2053 B7R1.16 CC1(C)CC(=O)N1 Amb19515692 [0,0,0,1,0,0|1,0,0]=2 2054 B7R1.16 CC1(C)CC(=O)O1 Amb17940813 [0,0,0,1,0,0|0,0,0]=1 2055 B7R1.16 CC1(C)CC(Br)C1 Amb22236115 [0,0,0,1,0,0|2,0,1]=4 2056 B7R1.16 CC1(C)CC(Cl)C1 Amb24624327 [0,0,0,1,0,0|2,0,1]=4 2057 B7R1.16 CC1(C)CC(N)C1 Amb19516467 [0,0,0,1,0,0|2,0,1]=4 2058 B7R1.16 CC1(C)CC(N)C1 Amb22387483 [0,0,0,1,0,0|2,0,1]=4 2059 B7R1.16 CC1(C)CC(O)S1 Amb24431332 [0,0,0,1,0,0|0,1,1]=3 2060 B7R1.16 CC1(C)CC(S)C1 Amb24576282 [0,0,0,1,0,0|1,1,1]=4 2061 B7R1.16 CC1(N)CC(O)C1 Amb23440245 [0,0,0,1,0,0|2,0,1]=4 2062 B7R1.16 CC1CC(C)(N)C1 Amb23449254 [0,0,0,1,0,0|2,0,1]=4 2063 B7R1.16 CC1CC(C)(O)C1 Amb25769307 [0,0,0,1,0,0|1,0,1]=3 2064 B7R1.16 CC1CC(N1)(C)C Amb10609593 [0,0,0,1,0,0|2,0,1]=4 2065 B7R1.16 C[C@@]1(N)C[C@@H](O)C1 Amb23440262 [0,0,0,1,0,0|2,0,1]=4 2066 B7R1.16 C[C@@]1(N)C[C@@H](O)C1 Amb25025191 [0,0,0,1,0,0|2,0,1]=4 2067 B7R1.16 C[C@@]1(N)C[C@H](O)C1 Amb23440261 [0,0,0,1,0,0|2,0,1]=4 2068 B7R1.16 C[C@@]1(O)C[C@@H](N)C1 Amb22746076 [0,0,0,1,0,0|2,0,1]=4 2069 B7R1.16 C[C@@]1(O)C[C@@H](N)C1 Amb22748724 [0,0,0,1,0,0|2,0,1]=4 2070 B7R1.16 C[C@@]1(O)C[C@H](N)C1 Amb23440021 [0,0,0,1,0,0|2,0,1]=4 2071 B7R1.16 ClC1CS(=O)(=O)C1 Amb13883570 [0,0,0,1,0,0|2,0,1]=4 2072 B7R1.16 NC1CS(=O)(=O)C1 Amb22174135 [0,0,0,1,0,0|2,0,1]=4 2073 B7R1.16 NC1CS(=O)(=O)C1 Amb23439808 [0,0,0,1,0,0|2,0,1]=4 2074 B7R1.16 O=C1CC(F)(F)C1 Amb22388689 [0,0,0,1,0,0|3,0,0]=4 2075 B7R1.16 O=S1(=O)CC(I)C1 Amb25303538 [0,0,0,1,0,0|2,0,1]=4 2076 B7R1.16 OC1CP(O)(=O)C1 Amb25811046 [0,0,0,1,0,0|2,0,0]=3 2077 B7R1.16 OC1CS(=O)(=O)C1 Amb22229261 [0,0,0,1,0,0|2,0,1]=4 2078 B7R1.20 BrC(=CC1CC1)Br Amb17612546 [0,0,0,1,0,0|2,0,1]=4 2079 B7R1.20 CC(=N)NC1CC1 Amb25369501 [0,0,0,1,0,0|3,0,0]=4 2080 B7R1.20 CC(=O)CC1CC1 Amb10603417 [0,0,0,1,0,0|1,0,0]=2 2081 B7R1.20 CC(=O)CC1CO1 Amb25718439 [0,0,0,1,0,0|2,0,0]=3 2082 B7R1.20 CC(=O)OC1CC1 Amb24334499 [0,0,0,1,0,0|2,0,0]=3 2083 B7R1.20 CC(=O)OC1CO1 Amb25261586 [0,0,0,1,0,0|3,0,0]=4 2084 B7R1.20 CC(C)CC1CN1 Amb22228397 [0,0,0,1,0,0|2,0,1]=4 2085 B7R1.20 CC(C)CC1CO1 Amb24631080 [0,0,0,1,0,0|1,0,1]=3 2086 B7R1.20 CC(CN1CC1)O Amb17334047 [0,0,0,1,0,0|2,0,1]=4 2087 B7R1.20 CC(Cl)CC1CC1 Amb24635709 [0,0,0,1,0,0|2,0,1]=4 2088 B7R1.20 CC(N)CC1CC1 Amb18958998 [0,0,0,1,0,0|2,0,1]=4 2089 B7R1.20 CC(O)CC1CO1 Amb25745084 [0,0,0,1,0,0|2,0,1]=4 2090 B7R1.20 CN(C)C[C@H]1CO1 Amb24449903 [0,0,0,1,0,0|2,0,1]=4 2091 B7R1.20 CN(CC1CC1)C Amb1795989 [0,0,0,1,0,0|3,0,0]=4 2092 B7R1.20 CN(CC1OC1)C Amb1139214 [0,0,0,1,0,0|2,0,1]=4 2093 B7R1.20 CS(=O)CC1CO1 Amb25060906 [0,0,0,1,0,0|3,0,0]=4 2094 B7R1.20 CS(=O)C[C@H]1CO1 Amb24431713 [0,0,0,1,0,0|3,0,0]=4 2095 B7R1.20 CS(=O)NC1CC1 Amb25231505 [0,0,0,1,0,0|3,0,0]=4 2096 B7R1.20 C[C@@H](O)CC1CC1 Amb22896775 [0,0,0,1,0,0|1,0,1]=3 2097 B7R1.20 C[C@@H](O)CC1CO1 Amb24644146 [0,0,0,1,0,0|2,0,1]=4 2098 B7R1.20 C[C@@H](O)C[C@@H]1CO1 Amb24630371 [0,0,0,1,0,0|2,0,1]=4 2099 B7R1.20 C[C@H](O)CC1CO1 Amb25687860 [0,0,0,1,0,0|2,0,1]=4 2100 B7R1.20 ClC(Cl)CC1CC1 Amb25115823 [0,0,0,1,0,0|2,0,1]=4 2101 B7R1.20 NC(=N)CC1CC1 Amb21964664 [0,0,0,1,0,0|2,0,0]=3 2102 B7R1.20 NC(=N)NC1CC1 Amb21955694 [0,0,0,1,0,0|3,0,0]=4 2103 B7R1.20 NC(=N)NC1CC1 Amb22492366 [0,0,0,1,0,0|3,0,0]=4 2104 B7R1.20 NC(=N)NC1CC1 Amb22587163 [0,0,0,1,0,0|3,0,0]=4 2105 B7R1.20 NC(=O)CC1CO1 Amb24654802 [0,0,0,1,0,0|2,0,0]=3 2106 B7R1.20 NC(=O)NC1CC1 Amb1152776 [0,0,0,1,0,0|2,0,0]=3 2107 B7R1.20 NC(N)=NC1CC1 Amb19374402 [0,0,0,1,0,0|3,0,0]=4 2108 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [0,0,0,1,0,0|1,0,0]=2 2109 B7R1.20 O=C(Cl)OC1CC1 Amb25251789 [0,0,0,1,0,0|2,0,0]=3 2110 B7R1.20 OC(=O)CC1CO1 Amb25244347 [0,0,0,1,0,0|1,0,0]=2 2111 B7R1.20 [O-][N+](=O)CC1CC1 Amb23589308 [0,0,0,1,0,0|1,0,1]=3 2112 B7R1.20 [O-][N+](=O)CC1CO1 Amb23589333 [0,0,0,1,0,0|2,0,1]=4 2113 B7R1.20 [S-]C(=S)NC1CC1 Amb24645667 [0,0,0,1,0,0|1,2,0]=4 2114 B7R1.32 CC1(C)CC1(C)N Amb25836222 [0,0,0,1,0,0|2,0,1]=4 2115 B5R0.5 BrC(C(=O)C)Br Amb16234148 [0,0,0,0,1,0|3,0,0]=4 2116 B5R0.5 C(=O)([2H])N(C)C Amb16185565 [0,0,0,0,1,0|2,0,0]=3 2117 B5R0.5 C=C(Br)C(O)=O Amb20620403 [0,0,0,0,1,0|1,0,2]=4 2118 B5R0.5 C=C(Cl)C(O)=O Amb17933971 [0,0,0,0,1,0|1,0,2]=4 2119 B5R0.5 CC(=C)C(=O)F Amb22230833 [0,0,0,0,1,0|1,0,2]=4 2120 B5R0.5 CC(=C)C(O)=O Amb22230681 [0,0,0,0,1,0|0,0,2]=3 2121 B5R0.5 CC(=C)C(O)=O Amb22337777 [0,0,0,0,1,0|0,0,2]=3 2122 B5R0.5 CC(=C)C(O)=O Amb22351305 [0,0,0,0,1,0|0,0,2]=3 2123 B5R0.5 CC(=C)C(O)=O Amb22351871 [0,0,0,0,1,0|0,0,2]=3 2124 B5R0.5 CC(=C)C(O)=O Amb22351927 [0,0,0,0,1,0|0,0,2]=3 2125 B5R0.5 CC(=C)C([O-])=O Amb17943044 [0,0,0,0,1,0|0,0,3]=4 2126 B5R0.5 CC(=C)C([O-])=O Amb20240542 [0,0,0,0,1,0|0,0,3]=4 2127 B5R0.5 CC(=C)C([O-])=O Amb20240585 [0,0,0,0,1,0|0,0,3]=4 2128 B5R0.5 CC(=C)C([O-])=O Amb22045782 [0,0,0,0,1,0|0,0,3]=4 2129 B5R0.5 CC(=C)C([O-])=O Amb22045789 [0,0,0,0,1,0|0,0,3]=4 2130 B5R0.5 CC(=C)C([O-])=O Amb22229881 [0,0,0,0,1,0|0,0,3]=4 2131 B5R0.5 CC(=C)C([O-])=O Amb22230829 [0,0,0,0,1,0|0,0,3]=4 2132 B5R0.5 CC(=C)C([O-])=O Amb22231309 [0,0,0,0,1,0|0,0,3]=4 2133 B5R0.5 CC(=C)C([O-])=O Amb22730162 [0,0,0,0,1,0|0,0,3]=4 2134 B5R0.5 CC(=C)C([O-])=O Amb22730173 [0,0,0,0,1,0|0,0,3]=4 2135 B5R0.5 CC(=C)C([O-])=O Amb22730220 [0,0,0,0,1,0|0,0,3]=4 2136 B5R0.5 CC(=C)C([O-])=O Amb22730616 [0,0,0,0,1,0|0,0,3]=4 2137 B5R0.5 CC(=C)C([O-])=O Amb22732008 [0,0,0,0,1,0|0,0,3]=4 2138 B5R0.5 CC(=C)C([O-])=O Amb22732130 [0,0,0,0,1,0|0,0,3]=4 2139 B5R0.5 CC(=C)C([O-])=O Amb22732965 [0,0,0,0,1,0|0,0,3]=4 2140 B5R0.5 CC(=C)C([O-])=O Amb22733010 [0,0,0,0,1,0|0,0,3]=4 2141 B5R0.5 CC(=C)C([O-])=O Amb22733228 [0,0,0,0,1,0|0,0,3]=4 2142 B5R0.5 CC(=C)C([O-])=O Amb22733283 [0,0,0,0,1,0|0,0,3]=4 2143 B5R0.5 CC(=C)C([O-])=O Amb22733711 [0,0,0,0,1,0|0,0,3]=4 2144 B5R0.5 CC(=C)C([O-])=O Amb22734514 [0,0,0,0,1,0|0,0,3]=4 2145 B5R0.5 CC(=N)N(C)C Amb20634458 [0,0,0,0,1,0|3,0,0]=4 2146 B5R0.5 CC(=N)N(C)C Amb22059214 [0,0,0,0,1,0|3,0,0]=4 2147 B5R0.5 CC(=O)C(=C)C Amb17593021 [0,0,0,0,1,0|1,0,2]=4 2148 B5R0.5 CC(=O)C(=O)[13CH3] Amb10072163 [0,0,0,0,1,0|2,0,1]=4 2149 B5R0.5 CC(=O)C(Cl)Br Amb25784019 [0,0,0,0,1,0|3,0,0]=4 2150 B5R0.5 CC(=O)C(F)C Amb10841897 [0,0,0,0,1,0|2,0,0]=3 2151 B5R0.5 CC(=O)C(N)C Amb17593029 [0,0,0,0,1,0|2,0,0]=3 2152 B5R0.5 CC(=O)C(N)N Amb25810479 [0,0,0,0,1,0|3,0,0]=4 2153 B5R0.5 CC(=O)C(O)O Amb22436762 [0,0,0,0,1,0|3,0,0]=4 2154 B5R0.5 CC(=O)C([O-])=O Amb22043412 [0,0,0,0,1,0|1,0,2]=4 2155 B5R0.5 CC(=O)C([O-])=O Amb22053857 [0,0,0,0,1,0|1,0,2]=4 2156 B5R0.5 CC(=O)C([O-])=O Amb22167358 [0,0,0,0,1,0|1,0,2]=4 2157 B5R0.5 CC(=O)C([O-])=O Amb22733838 [0,0,0,0,1,0|1,0,2]=4 2158 B5R0.5 CC(=O)N(C)O Amb24066817 [0,0,0,0,1,0|3,0,0]=4 2159 B5R0.5 CC(=O)N(N)C Amb17593037 [0,0,0,0,1,0|3,0,0]=4 2160 B5R0.5 CC(=O)P(O)=O Amb25368211 [0,0,0,0,1,0|2,0,1]=4 2161 B5R0.5 CC(=O)[13C]([O-])=O Amb22351546 [0,0,0,0,1,0|1,0,2]=4 2162 B5R0.5 CC(Br)C(=C)Br Amb25255854 [0,0,0,0,1,0|3,0,0]=4 2163 B5R0.5 CC(Br)C(N)=O Amb22491874 [0,0,0,0,1,0|2,0,0]=3 2164 B5R0.5 CC(Br)[13C](O)=O Amb22351913 [0,0,0,0,1,0|1,0,0]=2 2165 B5R0.5 CC(Br)[N+]([O-])=O Amb24078354 [0,0,0,0,1,0|2,0,1]=4 2166 B5R0.5 CC(C(=O)N)C Amb1153145 [0,0,0,0,1,0|1,0,0]=2 2167 B5R0.5 CC(C(=O)N)Cl Amb1151918 [0,0,0,0,1,0|2,0,0]=3 2168 B5R0.5 CC(C(=O)O)F Amb10605770 [0,0,0,0,1,0|1,0,0]=2 2169 B5R0.5 CC(C(O)C)Br Amb17593818 [0,0,0,0,1,0|2,0,1]=4 2170 B5R0.5 CC(C)=C(C)Br Amb22228669 [0,0,0,0,1,0|2,0,1]=4 2171 B5R0.5 CC(C)C(=C)Br Amb22583736 [0,0,0,0,1,0|2,0,0]=3 2172 B5R0.5 CC(C)C(=O)Br Amb22731066 [0,0,0,0,1,0|1,0,0]=2 2173 B5R0.5 CC(C)C(=O)F Amb25848493 [0,0,0,0,1,0|1,0,0]=2 2174 B5R0.5 CC(C)C(O)O Amb25662421 [0,0,0,0,1,0|0,0,2]=3 2175 B5R0.5 CC(C)C(S)=S Amb25200225 [0,0,0,0,1,0|0,2,0]=3 2176 B5R0.5 CC(C)C([O-])=O Amb22045473 [0,0,0,0,1,0|0,0,1]=2 2177 B5R0.5 CC(C)C([O-])=O Amb22730398 [0,0,0,0,1,0|0,0,1]=2 2178 B5R0.5 CC(C)C([O-])=O Amb22734686 [0,0,0,0,1,0|0,0,1]=2 2179 B5R0.5 CC(C)N(C)C Amb22167402 [0,0,0,0,1,0|3,0,0]=4 2180 B5R0.5 CC(C)N(C)N Amb24760101 [0,0,0,0,1,0|3,0,0]=4 2181 B5R0.5 CC(C)S(N)=O Amb25675545 [0,0,0,0,1,0|2,0,0]=3 2182 B5R0.5 CC(C)S([O-])=O Amb19929129 [0,0,0,0,1,0|1,0,1]=3 2183 B5R0.5 CC(C)[SiH](C)C Amb19892309 [0,0,0,0,1,0|2,1,0]=4 2184 B5R0.5 CC(Cl)C(=C)Br Amb25189813 [0,0,0,0,1,0|3,0,0]=4 2185 B5R0.5 CC(Cl)C(=O)Br Amb24602442 [0,0,0,0,1,0|2,0,0]=3 2186 B5R0.5 CC(Cl)C(C)=C Amb24407204 [0,0,0,0,1,0|3,0,0]=4 2187 B5R0.5 CC(Cl)C(N)=N Amb20622290 [0,0,0,0,1,0|3,0,0]=4 2188 B5R0.5 CC(Cl)S(=O)Cl Amb24442859 [0,0,0,0,1,0|3,0,0]=4 2189 B5R0.5 CC(Cl)S(C)=O Amb24478540 [0,0,0,0,1,0|3,0,0]=4 2190 B5R0.5 CC(Cl)[C@H](C)O Amb24442994 [0,0,0,0,1,0|2,0,1]=4 2191 B5R0.5 CC(Cl)[N+]([O-])=O Amb22732426 [0,0,0,0,1,0|2,0,1]=4 2192 B5R0.5 CC(F)C(=O)Cl Amb24472500 [0,0,0,0,1,0|2,0,0]=3 2193 B5R0.5 CC(F)C(C)O Amb25278462 [0,0,0,0,1,0|2,0,1]=4 2194 B5R0.5 CC(I)C(=O)Cl Amb24559615 [0,0,0,0,1,0|2,0,0]=3 2195 B5R0.5 CC(I)C(N)=O Amb25684673 [0,0,0,0,1,0|2,0,0]=3 2196 B5R0.5 CC(N)B(O)O Amb25844423 [0,0,0,0,1,0|2,0,1]=4 2197 B5R0.5 CC(N)C(=O)Br Amb25184851 [0,0,0,0,1,0|2,0,0]=3 2198 B5R0.5 CC(N)C(C)=C Amb23536625 [0,0,0,0,1,0|3,0,0]=4 2199 B5R0.5 CC(N)C(C)=O Amb19148817 [0,0,0,0,1,0|2,0,0]=3 2200 B5R0.5 CC(N)C(N)=N Amb25771576 [0,0,0,0,1,0|3,0,0]=4 2201 B5R0.5 CC(N)C(N)=O Amb21958673 [0,0,0,0,1,0|2,0,0]=3 2202 B5R0.5 CC(N)C(N)=S Amb19374914 [0,0,0,0,1,0|2,1,0]=4 2203 B5R0.5 CC(N)C(O)O Amb24369611 [0,0,0,0,1,0|1,0,2]=4 2204 B5R0.5 CC(N)P(O)=O Amb25147710 [0,0,0,0,1,0|2,0,0]=3 2205 B5R0.5 CC(N)S([O-])=O Amb25825173 [0,0,0,0,1,0|2,0,1]=4 2206 B5R0.5 CC(N)[13C](O)=O Amb22336671 [0,0,0,0,1,0|1,0,0]=2 2207 B5R0.5 CC(O)C(=C)F Amb25695653 [0,0,0,0,1,0|3,0,0]=4 2208 B5R0.5 CC(O)C(=C)I Amb24736518 [0,0,0,0,1,0|3,0,0]=4 2209 B5R0.5 CC(O)C(=O)Cl Amb25045690 [0,0,0,0,1,0|2,0,0]=3 2210 B5R0.5 CC(O)C(N)=N Amb22587521 [0,0,0,0,1,0|3,0,0]=4 2211 B5R0.5 CC(O)C(N)=S Amb23449309 [0,0,0,0,1,0|2,1,0]=4 2212 B5R0.5 CC(O)C(O)=O Amb22350027 [0,0,0,0,1,0|1,0,0]=2 2213 B5R0.5 CC(O)C(O)Br Amb25274110 [0,0,0,0,1,0|2,0,1]=4 2214 B5R0.5 CC(O)C(O)Cl Amb25147284 [0,0,0,0,1,0|2,0,1]=4 2215 B5R0.5 CC(O)C(O)O Amb24531370 [0,0,0,0,1,0|1,0,2]=4 2216 B5R0.5 CC(O)C([O-])=O Amb17942960 [0,0,0,0,1,0|1,0,1]=3 2217 B5R0.5 CC(O)C([O-])=O Amb17943079 [0,0,0,0,1,0|1,0,1]=3 2218 B5R0.5 CC(O)C([O-])=O Amb20246816 [0,0,0,0,1,0|1,0,1]=3 2219 B5R0.5 CC(O)C([O-])=O Amb21936112 [0,0,0,0,1,0|1,0,1]=3 2220 B5R0.5 CC(O)C([O-])=O Amb22002445 [0,0,0,0,1,0|1,0,1]=3 2221 B5R0.5 CC(O)C([O-])=O Amb22054134 [0,0,0,0,1,0|1,0,1]=3 2222 B5R0.5 CC(O)C([O-])=O Amb22055552 [0,0,0,0,1,0|1,0,1]=3 2223 B5R0.5 CC(O)C([O-])=O Amb22167842 [0,0,0,0,1,0|1,0,1]=3 2224 B5R0.5 CC(O)C([O-])=O Amb22350448 [0,0,0,0,1,0|1,0,1]=3 2225 B5R0.5 CC(O)C([O-])=O Amb22730128 [0,0,0,0,1,0|1,0,1]=3 2226 B5R0.5 CC(O)C([O-])=O Amb22730326 [0,0,0,0,1,0|1,0,1]=3 2227 B5R0.5 CC(O)C([O-])=O Amb22731947 [0,0,0,0,1,0|1,0,1]=3 2228 B5R0.5 CC(O)C([O-])=O Amb22732237 [0,0,0,0,1,0|1,0,1]=3 2229 B5R0.5 CC(O)C([O-])=O Amb22732420 [0,0,0,0,1,0|1,0,1]=3 2230 B5R0.5 CC(O)C([O-])=O Amb22732487 [0,0,0,0,1,0|1,0,1]=3 2231 B5R0.5 CC(O)C([O-])=O Amb22732889 [0,0,0,0,1,0|1,0,1]=3 2232 B5R0.5 CC(O)C([O-])=O Amb22733874 [0,0,0,0,1,0|1,0,1]=3 2233 B5R0.5 CC(O)C([O-])=O Amb22733995 [0,0,0,0,1,0|1,0,1]=3 2234 B5R0.5 CC(O)P(O)=O Amb24333635 [0,0,0,0,1,0|2,0,0]=3 2235 B5R0.5 CC(O)[14C]([O-])=O Amb22362798 [0,0,0,0,1,0|1,0,1]=3 2236 B5R0.5 CC(P(Cl)Cl)C Amb10607047 [0,0,0,0,1,0|3,0,0]=4 2237 B5R0.5 CC(P)C(N)=O Amb24715877 [0,0,0,0,1,0|2,0,0]=3 2238 B5R0.5 CC(S)C(C)=S Amb24478514 [0,0,0,0,1,0|2,1,0]=4 2239 B5R0.5 CC([15NH2])C(O)=O Amb22353286 [0,0,0,0,1,0|1,0,0]=2 2240 B5R0.5 CC([C@@H](O)C)O Amb10068424 [0,0,0,0,1,0|2,0,1]=4 2241 B5R0.5 CC([C@H](O)C)O Amb10068423 [0,0,0,0,1,0|2,0,1]=4 2242 B5R0.5 CC([O-])C([O-])=O Amb22045882 [0,0,0,0,1,0|1,0,1]=3 2243 B5R0.5 CN(C(=S)N)C Amb1105826 [0,0,0,0,1,0|2,1,0]=4 2244 B5R0.5 CN(C(=S)[S-])C Amb10552380 [0,0,0,0,1,0|1,2,0]=4 2245 B5R0.5 CN(C(=S)[S-])C Amb10552527 [0,0,0,0,1,0|1,2,0]=4 2246 B5R0.5 CN(C)C(=O)F Amb24660451 [0,0,0,0,1,0|2,0,0]=3 2247 B5R0.5 CN(C)C(C)=O Amb24323347 [0,0,0,0,1,0|2,0,0]=3 2248 B5R0.5 CN(C)C(N)=N Amb22227685 [0,0,0,0,1,0|3,0,0]=4 2249 B5R0.5 CN(C)C(N)=O Amb22739731 [0,0,0,0,1,0|2,0,0]=3 2250 B5R0.5 CN(C)C(O)=O Amb22348477 [0,0,0,0,1,0|1,0,0]=2 2251 B5R0.5 CN(C)C(O)=S Amb24477978 [0,0,0,0,1,0|1,1,0]=3 2252 B5R0.5 CN(C)C([S-])=S Amb21868021 [0,0,0,0,1,0|1,2,0]=4 2253 B5R0.5 CN(C)C([S-])=S Amb21961876 [0,0,0,0,1,0|1,2,0]=4 2254 B5R0.5 CN(C)C([S-])=S Amb22167891 [0,0,0,0,1,0|1,2,0]=4 2255 B5R0.5 CN(C)C([S-])=S Amb22167919 [0,0,0,0,1,0|1,2,0]=4 2256 B5R0.5 CN(C)C([S-])=S Amb22360776 [0,0,0,0,1,0|1,2,0]=4 2257 B5R0.5 CN(C)C([S-])=S Amb22363094 [0,0,0,0,1,0|1,2,0]=4 2258 B5R0.5 CN(C)C([S-])=S Amb22432644 [0,0,0,0,1,0|1,2,0]=4 2259 B5R0.5 CN(C)C([S-])=S Amb22486651 [0,0,0,0,1,0|1,2,0]=4 2260 B5R0.5 CN(C)C([S-])=S Amb22486840 [0,0,0,0,1,0|1,2,0]=4 2261 B5R0.5 CN(C)C([S-])=S Amb22730337 [0,0,0,0,1,0|1,2,0]=4 2262 B5R0.5 CN(C)C([S-])=S Amb22730563 [0,0,0,0,1,0|1,2,0]=4 2263 B5R0.5 CN(C)S(=O)=O Amb20621751 [0,0,0,0,1,0|2,0,1]=4 2264 B5R0.5 CN(C)[13C]([13CH3])=O Amb22367402 [0,0,0,0,1,0|2,0,0]=3 2265 B5R0.5 CN(O)C(N)=O Amb22055740 [0,0,0,0,1,0|3,0,0]=4 2266 B5R0.5 CN([No])C(N)=O Amb20621701 [0,0,0,0,1,0|3,0,0]=4 2267 B5R0.5 C[13C@@H]([15NH2])C(O)=O Amb22363357 [0,0,0,0,1,0|1,0,0]=2 2268 B5R0.5 C[13CH](N)C(O)=O Amb22367246 [0,0,0,0,1,0|1,0,0]=2 2269 B5R0.5 C[13C](=O)C([O-])=O Amb22056112 [0,0,0,0,1,0|1,0,2]=4 2270 B5R0.5 C[13C](=O)[13C](=O)C Amb17610135 [0,0,0,0,1,0|2,0,1]=4 2271 B5R0.5 C[C@@H](Cl)B(O)O Amb25662385 [0,0,0,0,1,0|2,0,1]=4 2272 B5R0.5 C[C@@H](Cl)C(=O)F Amb25811184 [0,0,0,0,1,0|2,0,0]=3 2273 B5R0.5 C[C@@H](Cl)[C@@H](C)O Amb24478541 [0,0,0,0,1,0|2,0,1]=4 2274 B5R0.5 C[C@@H](Cl)[C@H](C)O Amb25295417 [0,0,0,0,1,0|2,0,1]=4 2275 B5R0.5 C[C@@H](F)C(O)=O Amb24376099 [0,0,0,0,1,0|1,0,0]=2 2276 B5R0.5 C[C@@H](F)[C@@H](C)O Amb25221029 [0,0,0,0,1,0|2,0,1]=4 2277 B5R0.5 C[C@@H](N)C(C)=O Amb22748924 [0,0,0,0,1,0|2,0,0]=3 2278 B5R0.5 C[C@@H](N)C(C)=O Amb22748925 [0,0,0,0,1,0|2,0,0]=3 2279 B5R0.5 C[C@@H](N)C(N)=O Amb22746786 [0,0,0,0,1,0|2,0,0]=3 2280 B5R0.5 C[C@@H](N)C(N)=S Amb24680806 [0,0,0,0,1,0|2,1,0]=4 2281 B5R0.5 C[C@@H](N)P(O)=O Amb24640370 [0,0,0,0,1,0|2,0,0]=3 2282 B5R0.5 C[C@@H](O)C(C)=C Amb25834912 [0,0,0,0,1,0|3,0,0]=4 2283 B5R0.5 C[C@@H](O)C(C)=O Amb25120774 [0,0,0,0,1,0|2,0,0]=3 2284 B5R0.5 C[C@@H](O)C(N)=N Amb22587056 [0,0,0,0,1,0|3,0,0]=4 2285 B5R0.5 C[C@@H](O)C(O)=O Amb22799466 [0,0,0,0,1,0|1,0,0]=2 2286 B5R0.5 C[C@@H](O)C([O-])=O Amb22350432 [0,0,0,0,1,0|1,0,1]=3 2287 B5R0.5 C[C@@H](O)C([O-])=O Amb22801669 [0,0,0,0,1,0|1,0,1]=3 2288 B5R0.5 C[C@@H](O)P(O)=O Amb25129822 [0,0,0,0,1,0|2,0,0]=3 2289 B5R0.5 C[C@@H](O)[C@H](C)N Amb25234072 [0,0,0,0,1,0|2,0,1]=4 2290 B5R0.5 C[C@@H](S)C(N)=O Amb25065854 [0,0,0,0,1,0|2,0,0]=3 2291 B5R0.5 C[C@@H](S)[C@H](C)O Amb22757247 [0,0,0,0,1,0|2,0,1]=4 2292 B5R0.5 C[C@@H]([15NH2])C(O)=O Amb22800337 [0,0,0,0,1,0|1,0,0]=2 2293 B5R0.5 C[C@H](Br)C(=O)Br Amb25780155 [0,0,0,0,1,0|2,0,0]=3 2294 B5R0.5 C[C@H](Br)C(=O)Cl Amb24449131 [0,0,0,0,1,0|2,0,0]=3 2295 B5R0.5 C[C@H](Br)[C@H](C)O Amb25772841 [0,0,0,0,1,0|2,0,1]=4 2296 B5R0.5 C[C@H](C(C)C)N Amb10844612 [0,0,0,0,1,0|2,0,1]=4 2297 B5R0.5 C[C@H](C(C)C)O Amb13952942 [0,0,0,0,1,0|1,0,1]=3 2298 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [0,0,0,0,1,0|2,0,0]=3 2299 B5R0.5 C[C@H](Cl)C(O)=O Amb17776586 [0,0,0,0,1,0|1,0,0]=2 2300 B5R0.5 C[C@H](Cl)S(=O)Cl Amb25025573 [0,0,0,0,1,0|3,0,0]=4 2301 B5R0.5 C[C@H](Cl)[C@@H](C)O Amb24332606 [0,0,0,0,1,0|2,0,1]=4 2302 B5R0.5 C[C@H](I)C(O)=O Amb25724908 [0,0,0,0,1,0|1,0,0]=2 2303 B5R0.5 C[C@H](I)[C@H](C)O Amb24390416 [0,0,0,0,1,0|2,0,1]=4 2304 B5R0.5 C[C@H](N)C(=O)Cl Amb24333765 [0,0,0,0,1,0|2,0,0]=3 2305 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [0,0,0,0,1,0|2,0,0]=3 2306 B5R0.5 C[C@H](N)C(N)=S Amb24746259 [0,0,0,0,1,0|2,1,0]=4 2307 B5R0.5 C[C@H](N)P(O)=O Amb25101926 [0,0,0,0,1,0|2,0,0]=3 2308 B5R0.5 C[C@H](O)C(C)=C Amb25294556 [0,0,0,0,1,0|3,0,0]=4 2309 B5R0.5 C[C@H](O)C(C)=O Amb24625154 [0,0,0,0,1,0|2,0,0]=3 2310 B5R0.5 C[C@H](O)C(N)=N Amb22587541 [0,0,0,0,1,0|3,0,0]=4 2311 B5R0.5 C[C@H](O)C([O-])=O Amb17772234 [0,0,0,0,1,0|1,0,1]=3 2312 B5R0.5 C[C@H](O)C([O-])=O Amb22338062 [0,0,0,0,1,0|1,0,1]=3 2313 B5R0.5 C[C@H](O)C([O-])=O Amb22369005 [0,0,0,0,1,0|1,0,1]=3 2314 B5R0.5 C[C@H](O)[13C]([O-])=O Amb22353664 [0,0,0,0,1,0|1,0,1]=3 2315 B5R0.5 C[C@H](O)[C@@H](C)N Amb24683375 [0,0,0,0,1,0|2,0,1]=4 2316 B5R0.5 C[C@H](S)C(O)=O Amb25147510 [0,0,0,0,1,0|1,0,0]=2 2317 B5R0.5 C[C@H](S)[C@H](C)O Amb25145514 [0,0,0,0,1,0|2,0,1]=4 2318 B5R0.5 C[C@H]([15NH2])C(O)=O Amb22351686 [0,0,0,0,1,0|1,0,0]=2 2319 B5R0.5 ClC(=O)C(=O)C Amb17593107 [0,0,0,0,1,0|2,0,1]=4 2320 B5R0.5 ClC(=O)C(Cl)F Amb10839908 [0,0,0,0,1,0|3,0,0]=4 2321 B5R0.5 FC(=O)C(Cl)F Amb10839909 [0,0,0,0,1,0|3,0,0]=4 2322 B5R0.5 FC(=O)C(F)F Amb10845766 [0,0,0,0,1,0|3,0,0]=4 2323 B5R0.5 FC(C(=O)Cl)F Amb10841735 [0,0,0,0,1,0|3,0,0]=4 2324 B5R0.5 FC(C(=O)N)F Amb2222272 [0,0,0,0,1,0|3,0,0]=4 2325 B5R0.5 FC(C(=O)O)F Amb1953492 [0,0,0,0,1,0|2,0,0]=3 2326 B5R0.5 IC(C(=O)O)I Amb17612865 [0,0,0,0,1,0|2,0,0]=3 2327 B5R0.5 N=C(S)C(O)=O Amb18640468 [0,0,0,0,1,0|2,0,1]=4 2328 B5R0.5 NC(=N)C(=O)O Amb10549353 [0,0,0,0,1,0|2,0,1]=4 2329 B5R0.5 NC(=O)C(=O)C Amb17593028 [0,0,0,0,1,0|2,0,1]=4 2330 B5R0.5 NC(=O)C(Br)F Amb10841902 [0,0,0,0,1,0|3,0,0]=4 2331 B5R0.5 NC(=O)C(Br)I Amb24592920 [0,0,0,0,1,0|3,0,0]=4 2332 B5R0.5 NC(=O)C(Cl)Br Amb25288934 [0,0,0,0,1,0|3,0,0]=4 2333 B5R0.5 NC(=O)C(Cl)F Amb10839936 [0,0,0,0,1,0|3,0,0]=4 2334 B5R0.5 NC(=O)C(Cl)I Amb24640391 [0,0,0,0,1,0|3,0,0]=4 2335 B5R0.5 NC(=O)C(I)F Amb10840454 [0,0,0,0,1,0|3,0,0]=4 2336 B5R0.5 NC(=O)C(I)I Amb25744737 [0,0,0,0,1,0|3,0,0]=4 2337 B5R0.5 NC(=O)C(N)C Amb1156937 [0,0,0,0,1,0|2,0,0]=3 2338 B5R0.5 NC(=O)C(O)O Amb24680574 [0,0,0,0,1,0|3,0,0]=4 2339 B5R0.5 NC(=O)C([SiH3])[SiH3] Amb25811724 [0,0,0,0,1,0|1,2,0]=4 2340 B5R0.5 NC(=O)[C@@H](N)C Amb2371522 [0,0,0,0,1,0|2,0,0]=3 2341 B5R0.5 NC(=O)[C@H](N)C Amb2371905 [0,0,0,0,1,0|2,0,0]=3 2342 B5R0.5 NC(Br)C(O)=O Amb25724348 [0,0,0,0,1,0|2,0,0]=3 2343 B5R0.5 NC(O)C(N)=O Amb24478450 [0,0,0,0,1,0|3,0,0]=4 2344 B5R0.5 NC(O)C(O)=O Amb24663706 [0,0,0,0,1,0|2,0,0]=3 2345 B5R0.5 N[C@@H](O)C(N)=O Amb25338621 [0,0,0,0,1,0|3,0,0]=4 2346 B5R0.5 N[C@H](S)C(O)=O Amb25289119 [0,0,0,0,1,0|2,0,0]=3 2347 B5R0.5 O=C(Cl)[13CH](Cl)Cl Amb22353479 [0,0,0,0,1,0|3,0,0]=4 2348 B5R0.5 O=C(F)C(F)Br Amb24558399 [0,0,0,0,1,0|3,0,0]=4 2349 B5R0.5 O=C(P)C(Cl)Cl Amb25288016 [0,0,0,0,1,0|3,0,0]=4 2350 B5R0.5 OB(C(C)C)O Amb2447044 [0,0,0,0,1,0|1,0,1]=3 2351 B5R0.5 OC(=O)C(=O)O Amb10608980 [0,0,0,0,1,0|2,0,1]=4 2352 B5R0.5 OC(=O)C(=O)O Amb19134307 [0,0,0,0,1,0|2,0,1]=4 2353 B5R0.5 OC(=O)C(=O)S Amb25375340 [0,0,0,0,1,0|2,0,1]=4 2354 B5R0.5 OC(=O)C(Br)F Amb10841090 [0,0,0,0,1,0|2,0,0]=3 2355 B5R0.5 OC(=O)C(Cl)Br Amb22002468 [0,0,0,0,1,0|2,0,0]=3 2356 B5R0.5 OC(=O)C(Cl)Cl Amb22338543 [0,0,0,0,1,0|2,0,0]=3 2357 B5R0.5 OC(=O)C(Cl)F Amb10838714 [0,0,0,0,1,0|2,0,0]=3 2358 B5R0.5 OC(=O)C(F)S Amb25272480 [0,0,0,0,1,0|2,0,0]=3 2359 B5R0.5 OC(=O)C(I)Br Amb17610018 [0,0,0,0,1,0|2,0,0]=3 2360 B5R0.5 OC(=O)C(I)Cl Amb17610937 [0,0,0,0,1,0|2,0,0]=3 2361 B5R0.5 OC(=O)C(I)F Amb10838458 [0,0,0,0,1,0|2,0,0]=3 2362 B5R0.5 OC(=O)C(O)=O Amb19374136 [0,0,0,0,1,0|2,0,1]=4 2363 B5R0.5 OC(=O)C(O)=O Amb22002537 [0,0,0,0,1,0|2,0,1]=4 2364 B5R0.5 OC(=O)C(O)=O Amb22231343 [0,0,0,0,1,0|2,0,1]=4 2365 B5R0.5 OC(=O)C(O)=O Amb22352057 [0,0,0,0,1,0|2,0,1]=4 2366 B5R0.5 OC(=O)C(O)=O Amb22353291 [0,0,0,0,1,0|2,0,1]=4 2367 B5R0.5 OC(=O)C(O)=O Amb22360650 [0,0,0,0,1,0|2,0,1]=4 2368 B5R0.5 OC(=O)C(O)=O Amb22360667 [0,0,0,0,1,0|2,0,1]=4 2369 B5R0.5 OC(=O)C(O)=O Amb22363275 [0,0,0,0,1,0|2,0,1]=4 2370 B5R0.5 OC(=O)C(O)=O Amb22363302 [0,0,0,0,1,0|2,0,1]=4 2371 B5R0.5 OC(=O)C(O)=O Amb22394874 [0,0,0,0,1,0|2,0,1]=4 2372 B5R0.5 OC(=O)C(O)=O Amb22436461 [0,0,0,0,1,0|2,0,1]=4 2373 B5R0.5 OC(=O)C(O)=O Amb22731645 [0,0,0,0,1,0|2,0,1]=4 2374 B5R0.5 OC(=O)C(O)=O Amb22731888 [0,0,0,0,1,0|2,0,1]=4 2375 B5R0.5 OC(=O)C(O)=O Amb22897045 [0,0,0,0,1,0|2,0,1]=4 2376 B5R0.5 OC(=O)C(O)=O Amb23412252 [0,0,0,0,1,0|2,0,1]=4 2377 B5R0.5 OC(=O)C(S)=S Amb25695615 [0,0,0,0,1,0|2,0,1]=4 2378 B5R0.5 OC(=O)[13CH](Cl)Cl Amb22336527 [0,0,0,0,1,0|2,0,0]=3 2379 B5R0.5 OC(=O)[C@@H](F)Br Amb25147695 [0,0,0,0,1,0|2,0,0]=3 2380 B5R0.5 OC(=O)[C@H](Cl)Br Amb25857711 [0,0,0,0,1,0|2,0,0]=3 2381 B5R0.5 OC(=O)[C@H](F)I Amb24561039 [0,0,0,0,1,0|2,0,0]=3 2382 B5R0.5 OC(Cl)C(=O)Cl Amb24470096 [0,0,0,0,1,0|3,0,0]=4 2383 B5R0.5 OS(=O)C(Cl)Cl Amb24355376 [0,0,0,0,1,0|3,0,0]=4 2384 B5R0.5 OS(=O)C(F)F Amb25756691 [0,0,0,0,1,0|3,0,0]=4 2385 B5R0.5 O[13C](=O)C(Br)Br Amb22367565 [0,0,0,0,1,0|2,0,0]=3 2386 B5R0.5 O[13C](=O)C(Cl)Br Amb22367326 [0,0,0,0,1,0|2,0,0]=3 2387 B5R0.5 O[13C](=O)[13C](O)=O Amb22369747 [0,0,0,0,1,0|2,0,1]=4 2388 B5R0.5 O[14C](=O)[14C](O)=O Amb22349945 [0,0,0,0,1,0|2,0,1]=4 2389 B5R0.5 [12CH3][12C@H](N)[12C](O)=O Amb22367004 [0,0,0,0,1,0|1,0,0]=2 2390 B5R0.5 [13CH3]C(=O)C([O-])=O Amb22353396 [0,0,0,0,1,0|1,0,2]=4 2391 B5R0.5 [13CH3]C(N)C(O)=O Amb22351250 [0,0,0,0,1,0|1,0,0]=2 2392 B5R0.5 [13CH3][13CH](N)C(O)=O Amb22338584 [0,0,0,0,1,0|1,0,0]=2 2393 B5R0.5 [13CH3][13CH](N)[13C](O)=O Amb22353501 [0,0,0,0,1,0|1,0,0]=2 2394 B5R0.5 [13CH3][C@@H](O)C([O-])=O Amb22350379 [0,0,0,0,1,0|1,0,1]=3 2395 B5R0.5 [O-]C(=O)C(Br)F Amb10839585 [0,0,0,0,1,0|2,0,1]=4 2396 B5R0.5 [O-]C(=O)C(Cl)F Amb10839586 [0,0,0,0,1,0|2,0,1]=4 2397 B5R0.5 [O-]C(=O)C(F)F Amb22008196 [0,0,0,0,1,0|2,0,1]=4 2398 B5R0.5 [O-]C(=O)C(F)F Amb22357599 [0,0,0,0,1,0|2,0,1]=4 2399 B5R0.5 [O-]C(=O)C(I)F Amb10839587 [0,0,0,0,1,0|2,0,1]=4 2400 B5R0.5 [O-]C(=O)C(O)=O Amb20246604 [0,0,0,0,1,0|2,0,1]=4 2401 B5R0.5 [O-]C(=O)C(O)=O Amb22055985 [0,0,0,0,1,0|2,0,1]=4 2402 B5R0.5 [O-]C(=O)C(O)=O Amb22167952 [0,0,0,0,1,0|2,0,1]=4 2403 B5R0.5 [O-]C(=O)C(O)=O Amb22231328 [0,0,0,0,1,0|2,0,1]=4 2404 B7R0.6 C=C(Br)CCC(O)=O Amb18648212 [0,0,0,0,0,1|1,0,2]=4 2405 B7R0.6 C=C(Cl)CCC(O)=O Amb18642971 [0,0,0,0,0,1|1,0,2]=4 2406 B7R0.6 C=C(F)CCC(O)=O Amb25141041 [0,0,0,0,0,1|1,0,2]=4 2407 B7R0.6 CC(=C)CCC(=O)Cl Amb24640436 [0,0,0,0,0,1|1,0,2]=4 2408 B7R0.6 CC(=C)CCC(O)=O Amb18641793 [0,0,0,0,0,1|0,0,2]=3 2409 B7R0.6 CC(=C)CNC(C)C Amb17308679 [0,0,0,0,0,1|2,0,0]=3 2410 B7R0.6 CC(=C)CNN(C)C Amb24710720 [0,0,0,0,0,1|3,0,0]=4 2411 B7R0.6 CC(=C)\C=C\C(=O)O Amb17593153 [0,0,0,0,0,1|0,0,3]=4 2412 B7R0.6 CC(=CCC(=O)C)C Amb17593170 [0,0,0,0,0,1|1,0,1]=3 2413 B7R0.6 CC(=N)SCC(O)=O Amb25704672 [0,0,0,0,0,1|1,0,1]=3 2414 B7R0.6 CC(=NNC(=O)C)C Amb1047247 [0,0,0,0,0,1|2,0,1]=4 2415 B7R0.6 CC(=O)CCC(=O)Cl Amb17142859 [0,0,0,0,0,1|2,0,1]=4 2416 B7R0.6 CC(=O)CCC(=O)N Amb17142854 [0,0,0,0,0,1|2,0,1]=4 2417 B7R0.6 CC(=O)CCC(Cl)Cl Amb25724918 [0,0,0,0,0,1|3,0,0]=4 2418 B7R0.6 CC(=O)CCC([O-])=O Amb22350071 [0,0,0,0,0,1|1,0,2]=4 2419 B7R0.6 CC(=O)CCP(O)=O Amb24647699 [0,0,0,0,0,1|2,0,1]=4 2420 B7R0.6 CC(=O)CNC(N)=O Amb24697691 [0,0,0,0,0,1|2,0,1]=4 2421 B7R0.6 CC(=O)CSC(C)=C Amb25809979 [0,0,0,0,0,1|1,0,2]=4 2422 B7R0.6 CC(=O)CSC(C)=N Amb24634756 [0,0,0,0,0,1|2,0,1]=4 2423 B7R0.6 CC(=O)NCC(=O)N Amb17231824 [0,0,0,0,0,1|2,0,1]=4 2424 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [0,0,0,0,0,1|1,0,1]=3 2425 B7R0.6 CC(=O)NCC(C)=C Amb25126091 [0,0,0,0,0,1|1,0,2]=4 2426 B7R0.6 CC(=O)NCC(O)O Amb25378443 [0,0,0,0,0,1|3,0,0]=4 2427 B7R0.6 CC(=O)OCC(=C)C Amb16187121 [0,0,0,0,0,1|1,0,2]=4 2428 B7R0.6 CC(=O)OCC(=O)Br Amb25032214 [0,0,0,0,0,1|2,0,1]=4 2429 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [0,0,0,0,0,1|1,0,1]=3 2430 B7R0.6 CC(=O)OCC(F)Cl Amb25116212 [0,0,0,0,0,1|3,0,0]=4 2431 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [0,0,0,0,0,1|2,0,1]=4 2432 B7R0.6 CC(=O)OCS(C)=O Amb24667100 [0,0,0,0,0,1|3,0,0]=4 2433 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [0,0,0,0,0,1|2,0,1]=4 2434 B7R0.6 CC(=O)SCC(=O)O Amb17607669 [0,0,0,0,0,1|1,0,1]=3 2435 B7R0.6 CC(=O)SCC(C)=O Amb25131248 [0,0,0,0,0,1|2,0,1]=4 2436 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [0,0,0,0,0,1|2,0,1]=4 2437 B7R0.6 CC(=O)\C=C/C(O)=O Amb24662475 [0,0,0,0,0,1|1,0,2]=4 2438 B7R0.6 CC(=S)NCC(O)=O Amb24325138 [0,0,0,0,0,1|1,0,1]=3 2439 B7R0.6 CC(Br)CCC(=O)Cl Amb24483133 [0,0,0,0,0,1|2,0,0]=3 2440 B7R0.6 CC(Br)CCC(N)=O Amb24065438 [0,0,0,0,0,1|2,0,0]=3 2441 B7R0.6 CC(Br)CCC(O)=O Amb18124528 [0,0,0,0,0,1|1,0,0]=2 2442 B7R0.6 CC(Br)CNC(C)=O Amb24727885 [0,0,0,0,0,1|2,0,0]=3 2443 B7R0.6 CC(Br)COC(C)=O Amb25360690 [0,0,0,0,0,1|2,0,0]=3 2444 B7R0.6 CC(Br)\C=C\C(=O)Cl Amb24602252 [0,0,0,0,0,1|2,0,1]=4 2445 B7R0.6 CC(Br)\C=C\C(C)=O Amb25334067 [0,0,0,0,0,1|2,0,1]=4 2446 B7R0.6 CC(Br)\C=C\C(O)=O Amb18648210 [0,0,0,0,0,1|1,0,1]=3 2447 B7R0.6 CC(C)=C=CC(C)=O Amb25189061 [0,0,0,0,0,1|1,0,2]=4 2448 B7R0.6 CC(C)=CCC([O-])=O Amb22491058 [0,0,0,0,0,1|0,0,2]=3 2449 B7R0.6 CC(C)=COC(=O)Cl Amb25174283 [0,0,0,0,0,1|1,0,2]=4 2450 B7R0.6 CC(C)=COC(C)=O Amb25349708 [0,0,0,0,0,1|1,0,2]=4 2451 B7R0.6 CC(C)=NCC(O)=O Amb24481383 [0,0,0,0,0,1|0,0,1]=2 2452 B7R0.6 CC(C)C#CC(C)O Amb25134603 [0,0,0,0,0,1|1,0,2]=4 2453 B7R0.6 CC(C)C#C[C@H](C)O Amb24333163 [0,0,0,0,0,1|1,0,2]=4 2454 B7R0.6 CC(C)CC=C(C)C Amb22731329 [0,0,0,0,0,1|2,0,0]=3 2455 B7R0.6 CC(C)CCB(F)F Amb24655127 [0,0,0,0,0,1|3,0,0]=4 2456 B7R0.6 CC(C)CCC(C)=C Amb22734286 [0,0,0,0,0,1|2,0,0]=3 2457 B7R0.6 CC(C)CCC(Cl)Cl Amb24483247 [0,0,0,0,0,1|2,0,1]=4 2458 B7R0.6 CC(C)CCC(N)=N Amb19890005 [0,0,0,0,0,1|2,0,0]=3 2459 B7R0.6 CC(C)CCN(C)C Amb25761687 [0,0,0,0,0,1|3,0,0]=4 2460 B7R0.6 CC(C)CCN(C)N Amb25344743 [0,0,0,0,0,1|3,0,0]=4 2461 B7R0.6 CC(C)CCS(C)=O Amb24369501 [0,0,0,0,0,1|2,0,0]=3 2462 B7R0.6 CC(C)CC[13C](O)=O Amb22337922 [0,0,0,0,0,1|0,0,0]=1 2463 B7R0.6 CC(C)CC[13C]([O-])=O Amb22369748 [0,0,0,0,0,1|0,0,1]=2 2464 B7R0.6 CC(C)CC[N+]([O-])=O Amb17672612 [0,0,0,0,0,1|1,0,1]=3 2465 B7R0.6 CC(C)CC[S+](C)C Amb24581198 [0,0,0,0,0,1|3,0,0]=4 2466 B7R0.6 CC(C)CNN(C)C Amb24739829 [0,0,0,0,0,1|3,0,0]=4 2467 B7R0.6 CC(C)COB(O)O Amb24711780 [0,0,0,0,0,1|1,0,1]=3 2468 B7R0.6 CC(C)COC(C)Cl Amb25337737 [0,0,0,0,0,1|2,0,1]=4 2469 B7R0.6 CC(C)COC(N)=N Amb25789367 [0,0,0,0,0,1|2,0,0]=3 2470 B7R0.6 CC(C)COC(N)=S Amb25117523 [0,0,0,0,0,1|1,1,0]=3 2471 B7R0.6 CC(C)COC([S-])=S Amb22730882 [0,0,0,0,0,1|0,2,0]=3 2472 B7R0.6 CC(C)COC([S-])=S Amb22733535 [0,0,0,0,0,1|0,2,0]=3 2473 B7R0.6 CC(C)CO[N+]([O-])=O Amb22348027 [0,0,0,0,0,1|1,0,1]=3 2474 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [0,0,0,0,0,1|1,0,0]=2 2475 B7R0.6 CC(C)CSC(C)Cl Amb25242506 [0,0,0,0,0,1|2,0,1]=4 2476 B7R0.6 CC(C)CSC(F)F Amb24520712 [0,0,0,0,0,1|2,0,1]=4 2477 B7R0.6 CC(C)CSC(N)=N Amb20676000 [0,0,0,0,0,1|2,0,0]=3 2478 B7R0.6 CC(C)N=CC(O)=O Amb25243501 [0,0,0,0,0,1|0,0,1]=2 2479 B7R0.6 CC(C)NC=C(C)C Amb24568899 [0,0,0,0,0,1|2,0,1]=4 2480 B7R0.6 CC(C)NCC(=C)Br Amb18969561 [0,0,0,0,0,1|2,0,0]=3 2481 B7R0.6 CC(C)NCC(=C)Cl Amb18969179 [0,0,0,0,0,1|2,0,0]=3 2482 B7R0.6 CC(C)NCC(C)F Amb24518861 [0,0,0,0,0,1|2,0,1]=4 2483 B7R0.6 CC(C)NCC(C)N Amb18523807 [0,0,0,0,0,1|2,0,1]=4 2484 B7R0.6 CC(C)NCC(C)S Amb18124379 [0,0,0,0,0,1|1,1,1]=4 2485 B7R0.6 CC(C)NCC(Cl)Cl Amb24620020 [0,0,0,0,0,1|2,0,1]=4 2486 B7R0.6 CC(C)NCC(F)F Amb20626958 [0,0,0,0,0,1|2,0,1]=4 2487 B7R0.6 CC(C)NC[C@@H](C)N Amb24641462 [0,0,0,0,0,1|2,0,1]=4 2488 B7R0.6 CC(C)NC[C@H](C)N Amb24681286 [0,0,0,0,0,1|2,0,1]=4 2489 B7R0.6 CC(C)NC[C@H](C)O Amb25141479 [0,0,0,0,0,1|1,0,1]=3 2490 B7R0.6 CC(C)NNC(C)=O Amb22233621 [0,0,0,0,0,1|2,0,0]=3 2491 B7R0.6 CC(C)NNC(N)=N Amb25305047 [0,0,0,0,0,1|3,0,0]=4 2492 B7R0.6 CC(C)NNC(N)=S Amb24434718 [0,0,0,0,0,1|2,1,0]=4 2493 B7R0.6 CC(C)N\N=C(\C)/N Amb25063841 [0,0,0,0,0,1|3,0,0]=4 2494 B7R0.6 CC(C)OCC(C)Br Amb24053045 [0,0,0,0,0,1|2,0,1]=4 2495 B7R0.6 CC(C)OCC(C)Cl Amb24693935 [0,0,0,0,0,1|2,0,1]=4 2496 B7R0.6 CC(C)OCC(N)=N Amb22094742 [0,0,0,0,0,1|2,0,0]=3 2497 B7R0.6 CC(C)OCC([O-])=O Amb22754781 [0,0,0,0,0,1|0,0,1]=2 2498 B7R0.6 CC(C)OC[C@@H](C)N Amb18016635 [0,0,0,0,0,1|2,0,1]=4 2499 B7R0.6 CC(C)OC[C@@H](C)O Amb24689920 [0,0,0,0,0,1|1,0,1]=3 2500 B7R0.6 CC(C)OC[C@H](C)O Amb24449028 [0,0,0,0,0,1|1,0,1]=3 2501 B7R0.6 CC(C)ONC(C)=O Amb25091857 [0,0,0,0,0,1|2,0,0]=3 2502 B7R0.6 CC(C)ONC(N)=N Amb25168665 [0,0,0,0,0,1|3,0,0]=4 2503 B7R0.6 CC(C)ONS(C)=O Amb24551355 [0,0,0,0,0,1|3,0,0]=4 2504 B7R0.6 CC(C)SCC(=C)Br Amb25847364 [0,0,0,0,0,1|2,0,0]=3 2505 B7R0.6 CC(C)SCC(=C)Cl Amb25204248 [0,0,0,0,0,1|2,0,0]=3 2506 B7R0.6 CC(C)SCC(C)=C Amb25058431 [0,0,0,0,0,1|2,0,0]=3 2507 B7R0.6 CC(C)SCC(C)=O Amb22549127 [0,0,0,0,0,1|1,0,0]=2 2508 B7R0.6 CC(C)SCC(C)N Amb24481360 [0,0,0,0,0,1|2,0,1]=4 2509 B7R0.6 CC(C)SCC(C)O Amb24382860 [0,0,0,0,0,1|1,0,1]=3 2510 B7R0.6 CC(C)SCC(N)=N Amb25337291 [0,0,0,0,0,1|2,0,0]=3 2511 B7R0.6 CC(C)SC[C@@H](C)O Amb25283005 [0,0,0,0,0,1|1,0,1]=3 2512 B7R0.6 CC(C)SSC(N)=N Amb25744921 [0,0,0,0,0,1|3,0,0]=4 2513 B7R0.6 CC(C)\C=C/C(O)=O Amb24481395 [0,0,0,0,0,1|0,0,1]=2 2514 B7R0.6 CC(C)\C=C\C(=O)Cl Amb24481563 [0,0,0,0,0,1|1,0,1]=3 2515 B7R0.6 CC(C)\C=C\C(C)O Amb25746608 [0,0,0,0,0,1|1,0,2]=4 2516 B7R0.6 CC(C)\C=C\C(N)=O Amb24473783 [0,0,0,0,0,1|1,0,1]=3 2517 B7R0.6 CC(C)\C=C\[N+]([O-])=O Amb22886991 [0,0,0,0,0,1|1,0,2]=4 2518 B7R0.6 CC(CCB(O)O)C Amb13890540 [0,0,0,0,0,1|1,0,1]=3 2519 B7R0.6 CC(CCC(=O)O)C Amb1153016 [0,0,0,0,0,1|0,0,0]=1 2520 B7R0.6 CC(CCC(=O)O)N Amb17593212 [0,0,0,0,0,1|1,0,0]=2 2521 B7R0.6 CC(CNC(=O)N)C Amb1151241 [0,0,0,0,0,1|1,0,0]=2 2522 B7R0.6 CC(CNC(=S)N)C Amb2370605 [0,0,0,0,0,1|1,1,0]=3 2523 B7R0.6 CC(Cl)=C=CC(O)=O Amb25321565 [0,0,0,0,0,1|1,0,2]=4 2524 B7R0.6 CC(Cl)=CCC(N)=O Amb25324975 [0,0,0,0,0,1|2,0,1]=4 2525 B7R0.6 CC(Cl)C=NC(N)=O Amb24612038 [0,0,0,0,0,1|2,0,1]=4 2526 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [0,0,0,0,0,1|2,0,0]=3 2527 B7R0.6 CC(Cl)CCC(C)O Amb25136164 [0,0,0,0,0,1|2,0,1]=4 2528 B7R0.6 CC(Cl)CCC(N)=O Amb24469692 [0,0,0,0,0,1|2,0,0]=3 2529 B7R0.6 CC(Cl)CCC(O)=O Amb18124448 [0,0,0,0,0,1|1,0,0]=2 2530 B7R0.6 CC(Cl)CNC(C)=O Amb25702921 [0,0,0,0,0,1|2,0,0]=3 2531 B7R0.6 CC(Cl)CNC(N)=O Amb25068414 [0,0,0,0,0,1|2,0,0]=3 2532 B7R0.6 CC(Cl)COC(=O)F Amb24470183 [0,0,0,0,0,1|2,0,0]=3 2533 B7R0.6 CC(Cl)COC(C)=O Amb25783984 [0,0,0,0,0,1|2,0,0]=3 2534 B7R0.6 CC(Cl)CSC(=O)Cl Amb24456190 [0,0,0,0,0,1|2,0,0]=3 2535 B7R0.6 CC(Cl)CSC(C)=O Amb24530194 [0,0,0,0,0,1|2,0,0]=3 2536 B7R0.6 CC(Cl)\C=C\C(=O)Cl Amb24579654 [0,0,0,0,0,1|2,0,1]=4 2537 B7R0.6 CC(Cl)\C=C\C(C)=O Amb25782801 [0,0,0,0,0,1|2,0,1]=4 2538 B7R0.6 CC(F)CCC(O)=O Amb24682772 [0,0,0,0,0,1|1,0,0]=2 2539 B7R0.6 CC(N)CCC(C)=C Amb18641752 [0,0,0,0,0,1|3,0,0]=4 2540 B7R0.6 CC(N)CCC(C)=O Amb24698356 [0,0,0,0,0,1|2,0,0]=3 2541 B7R0.6 CC(N)CCC(N)=O Amb18641901 [0,0,0,0,0,1|2,0,0]=3 2542 B7R0.6 CC(N)CCC(O)=O Amb19515603 [0,0,0,0,0,1|1,0,0]=2 2543 B7R0.6 CC(N)CCS(C)=O Amb19337158 [0,0,0,0,0,1|3,0,0]=4 2544 B7R0.6 CC(N)CCS(C)=O Amb22059582 [0,0,0,0,0,1|3,0,0]=4 2545 B7R0.6 CC(N)CNC(C)=O Amb18631377 [0,0,0,0,0,1|2,0,0]=3 2546 B7R0.6 CC(N)CNC(N)=O Amb18202688 [0,0,0,0,0,1|2,0,0]=3 2547 B7R0.6 CC(N)CSC(N)=N Amb24423533 [0,0,0,0,0,1|3,0,0]=4 2548 B7R0.6 CC(N)\C=C\C(O)=O Amb18641827 [0,0,0,0,0,1|1,0,1]=3 2549 B7R0.6 CC(NCC(=O)N)C Amb2370772 [0,0,0,0,0,1|1,0,0]=2 2550 B7R0.6 CC(NCC(=O)O)C Amb2372347 [0,0,0,0,0,1|0,0,0]=1 2551 B7R0.6 CC(NCC(=S)N)C Amb17231884 [0,0,0,0,0,1|1,1,0]=3 2552 B7R0.6 CC(O)CC=C(C)C Amb24645341 [0,0,0,0,0,1|1,0,2]=4 2553 B7R0.6 CC(O)CC=C(Cl)Cl Amb25169372 [0,0,0,0,0,1|3,0,0]=4 2554 B7R0.6 CC(O)CCB(O)O Amb24594819 [0,0,0,0,0,1|2,0,1]=4 2555 B7R0.6 CC(O)CCC(C)=C Amb24062974 [0,0,0,0,0,1|3,0,0]=4 2556 B7R0.6 CC(O)CCC(C)=O Amb25829594 [0,0,0,0,0,1|2,0,0]=3 2557 B7R0.6 CC(O)CCC(C)N Amb18641930 [0,0,0,0,0,1|2,0,1]=4 2558 B7R0.6 CC(O)CCC(O)=O Amb18294804 [0,0,0,0,0,1|1,0,0]=2 2559 B7R0.6 CC(O)CN=C(C)N Amb24370924 [0,0,0,0,0,1|3,0,0]=4 2560 B7R0.6 CC(O)CNN(C)C Amb25773279 [0,0,0,0,0,1|2,0,1]=4 2561 B7R0.6 CC(O)CNS(C)=O Amb24536649 [0,0,0,0,0,1|3,0,0]=4 2562 B7R0.6 CC(O)COC(C)=O Amb24056158 [0,0,0,0,0,1|2,0,0]=3 2563 B7R0.6 CC(O)COP(O)=O Amb24591406 [0,0,0,0,0,1|2,0,0]=3 2564 B7R0.6 CC(O)COP(O)O Amb24475185 [0,0,0,0,0,1|2,0,1]=4 2565 B7R0.6 CC(O)CSC(N)=N Amb25168714 [0,0,0,0,0,1|3,0,0]=4 2566 B7R0.6 CC(O)CSC(N)=S Amb24652391 [0,0,0,0,0,1|2,1,0]=4 2567 B7R0.6 CC(O)NCC(O)=O Amb25141558 [0,0,0,0,0,1|1,0,0]=2 2568 B7R0.6 CC(O)OCC(C)=C Amb24333382 [0,0,0,0,0,1|3,0,0]=4 2569 B7R0.6 CC(O)\C=C\C(C)=O Amb25334941 [0,0,0,0,0,1|2,0,1]=4 2570 B7R0.6 CC(O)\C=C\C(N)=O Amb24597646 [0,0,0,0,0,1|2,0,1]=4 2571 B7R0.6 CC(O)\C=C\C(O)=O Amb18641876 [0,0,0,0,0,1|1,0,1]=3 2572 B7R0.6 CC(OC[C@@H](N)C)C Amb17061649 [0,0,0,0,0,1|2,0,1]=4 2573 B7R0.6 CC(S)CNC(C)=O Amb24695989 [0,0,0,0,0,1|2,0,0]=3 2574 B7R0.6 CC(S)\C=C\C(O)=O Amb18124362 [0,0,0,0,0,1|1,0,1]=3 2575 B7R0.6 CC(SCC(=O)O)C Amb1128460 [0,0,0,0,0,1|0,0,0]=1 2576 B7R0.6 CN(C)CCC(O)=O Amb19888182 [0,0,0,0,0,1|1,0,0]=2 2577 B7R0.6 CN(C)CNC(S)=S Amb24068964 [0,0,0,0,0,1|1,2,0]=4 2578 B7R0.6 CN(C)COC(S)=S Amb24760765 [0,0,0,0,0,1|1,2,0]=4 2579 B7R0.6 CN(C)CSC(N)=N Amb24377148 [0,0,0,0,0,1|3,0,0]=4 2580 B7R0.6 CN(C)N=CS(O)=O Amb25211020 [0,0,0,0,0,1|2,0,1]=4 2581 B7R0.6 CN(C)NCC(N)=O Amb24634715 [0,0,0,0,0,1|2,0,0]=3 2582 B7R0.6 CN(C)NCC(O)=O Amb24481366 [0,0,0,0,0,1|1,0,0]=2 2583 B7R0.6 CN(C)SCC(N)=O Amb22492532 [0,0,0,0,0,1|2,0,0]=3 2584 B7R0.6 CN(C)\C=C\C(N)=O Amb24581127 [0,0,0,0,0,1|2,0,1]=4 2585 B7R0.6 CN(C)\C=C\C(O)=O Amb25273624 [0,0,0,0,0,1|1,0,1]=3 2586 B7R0.6 CN(CCC(=N)N)C Amb13951664 [0,0,0,0,0,1|3,0,0]=4 2587 B7R0.6 CN(CCC(=O)C)C Amb1129203 [0,0,0,0,0,1|2,0,0]=3 2588 B7R0.6 CN(CCC(=O)N)C Amb17231825 [0,0,0,0,0,1|2,0,0]=3 2589 B7R0.6 CS(=O)CCC(N)=O Amb24475802 [0,0,0,0,0,1|3,0,0]=4 2590 B7R0.6 CS(=O)CCC(O)=O Amb18523762 [0,0,0,0,0,1|2,0,0]=3 2591 B7R0.6 CS(=O)NCC(N)=O Amb24589713 [0,0,0,0,0,1|3,0,0]=4 2592 B7R0.6 CS(=O)NCC(O)=O Amb25237322 [0,0,0,0,0,1|2,0,0]=3 2593 B7R0.6 CS(=O)\C=C\C(O)=O Amb18642965 [0,0,0,0,0,1|2,0,1]=4 2594 B7R0.6 C[C@@H](COC(=O)O)O Amb16232417 [0,0,0,0,0,1|1,0,0]=2 2595 B7R0.6 C[C@@H](O)C#CC(O)=O Amb24334413 [0,0,0,0,0,1|1,0,1]=3 2596 B7R0.6 C[C@@H](O)CCB(O)O Amb25683632 [0,0,0,0,0,1|2,0,1]=4 2597 B7R0.6 C[C@@H](O)CCC(C)=C Amb22896943 [0,0,0,0,0,1|3,0,0]=4 2598 B7R0.6 C[C@@H](O)CCC(C)=O Amb22351150 [0,0,0,0,0,1|2,0,0]=3 2599 B7R0.6 C[C@@H](O)CCC(C)O Amb25846912 [0,0,0,0,0,1|2,0,1]=4 2600 B7R0.6 C[C@@H](O)CN=C(C)N Amb25026449 [0,0,0,0,0,1|3,0,0]=4 2601 B7R0.6 C[C@@H](O)CNC(C)=O Amb25133822 [0,0,0,0,0,1|2,0,0]=3 2602 B7R0.6 C[C@@H](O)CNN(C)C Amb24733710 [0,0,0,0,0,1|2,0,1]=4 2603 B7R0.6 C[C@@H](O)COC(C)=O Amb25832756 [0,0,0,0,0,1|2,0,0]=3 2604 B7R0.6 C[C@@H](S)CCC(O)=O Amb24587370 [0,0,0,0,0,1|1,0,0]=2 2605 B7R0.6 C[C@H](N)CCC(O)=O Amb25047328 [0,0,0,0,0,1|1,0,0]=2 2606 B7R0.6 C[C@H](O)CNC(N)=N Amb24501581 [0,0,0,0,0,1|3,0,0]=4 2607 B7R0.6 C[C@H](O)CNC(N)=O Amb24384732 [0,0,0,0,0,1|2,0,0]=3 2608 B7R0.6 C[C@H](O)CSC(C)=O Amb25256687 [0,0,0,0,0,1|2,0,0]=3 2609 B7R0.6 C[S+](C)CCC(O)=O Amb22730539 [0,0,0,0,0,1|1,0,0]=2 2610 B7R0.6 C[S+](C)CCC([O-])=O Amb20247306 [0,0,0,0,0,1|1,0,1]=3 2611 B7R0.6 FC(COC(=O)C)F Amb10839327 [0,0,0,0,0,1|3,0,0]=4 2612 B7R0.6 NC(=N)CCC(O)=O Amb25736788 [0,0,0,0,0,1|2,0,1]=4 2613 B7R0.6 NC(=N)NCC(=O)O Amb16231404 [0,0,0,0,0,1|2,0,1]=4 2614 B7R0.6 NC(=N)N[13CH2][13C](=O)O Amb17614848 [0,0,0,0,0,1|2,0,1]=4 2615 B7R0.6 NC(=N)OCC(O)=O Amb24394884 [0,0,0,0,0,1|2,0,1]=4 2616 B7R0.6 NC(=N)SCC(O)=O Amb21955777 [0,0,0,0,0,1|2,0,1]=4 2617 B7R0.6 NC(=O)CCC(F)F Amb25271130 [0,0,0,0,0,1|3,0,0]=4 2618 B7R0.6 NC(=O)CNC(O)=O Amb24705097 [0,0,0,0,0,1|2,0,1]=4 2619 B7R0.6 NC(=O)NCC(=O)O Amb16205895 [0,0,0,0,0,1|2,0,1]=4 2620 B7R0.6 NC(=O)OCC(Cl)Cl Amb25111164 [0,0,0,0,0,1|3,0,0]=4 2621 B7R0.6 NC(=O)OCC(O)=O Amb25777061 [0,0,0,0,0,1|2,0,1]=4 2622 B7R0.6 NC(=O)SCC(O)=O Amb24640543 [0,0,0,0,0,1|2,0,1]=4 2623 B7R0.6 NC(=S)CCC(O)=O Amb18102382 [0,0,0,0,0,1|2,0,1]=4 2624 B7R0.6 NC(=S)OCC(O)=O Amb25340403 [0,0,0,0,0,1|2,0,1]=4 2625 B7R0.6 NC(=S)SCC(O)=O Amb25108057 [0,0,0,0,0,1|2,0,1]=4 2626 B7R0.6 O=C(Cl)CCC(Cl)Cl Amb24441999 [0,0,0,0,0,1|3,0,0]=4 2627 B7R0.6 OB(O)CCC(O)=O Amb24640288 [0,0,0,0,0,1|3,0,0]=4 2628 B7R0.6 OC(=O)C#CC(F)F Amb24455798 [0,0,0,0,0,1|2,0,1]=4 2629 B7R0.6 OC(=O)CC=C(Cl)Cl Amb17593875 [0,0,0,0,0,1|2,0,1]=4 2630 B7R0.6 OC(=O)CC=C(F)F Amb25127059 [0,0,0,0,0,1|2,0,1]=4 2631 B7R0.6 OC(=O)CCC(=O)Cl Amb17593468 [0,0,0,0,0,1|2,0,1]=4 2632 B7R0.6 OC(=O)CCC(Cl)Cl Amb25059214 [0,0,0,0,0,1|2,0,0]=3 2633 B7R0.6 OC(=O)CCC(F)F Amb20623135 [0,0,0,0,0,1|2,0,0]=3 2634 B7R0.6 OC(=O)CCC(O)=O Amb22168124 [0,0,0,0,0,1|2,0,1]=4 2635 B7R0.6 OC(=O)CCC(O)=O Amb22349196 [0,0,0,0,0,1|2,0,1]=4 2636 B7R0.6 OC(=O)CCC(O)=O Amb22353352 [0,0,0,0,0,1|2,0,1]=4 2637 B7R0.6 OC(=O)CCC(O)=O Amb22360649 [0,0,0,0,0,1|2,0,1]=4 2638 B7R0.6 OC(=O)CNC(=O)Cl Amb25277149 [0,0,0,0,0,1|2,0,1]=4 2639 B7R0.6 OC(=O)CNC(S)=S Amb24739663 [0,0,0,0,0,1|2,0,1]=4 2640 B7R0.6 OC(=O)COC(S)=S Amb24739791 [0,0,0,0,0,1|2,0,1]=4 2641 B7R0.6 OC(=O)COS(=O)=O Amb25064798 [0,0,0,0,0,1|3,0,0]=4 2642 B7R0.6 OC(=O)CSC(S)=S Amb24608205 [0,0,0,0,0,1|2,0,1]=4 2643 B7R0.6 OC(=O)C[13CH2][13C](O)=O Amb22353421 [0,0,0,0,0,1|2,0,1]=4 2644 B7R0.6 OC(=O)C\C=C(\F)/Cl Amb24599232 [0,0,0,0,0,1|2,0,1]=4 2645 B7R0.6 OC(=O)SCC(O)=O Amb24699018 [0,0,0,0,0,1|2,0,1]=4 2646 B7R0.6 OC(=O)[13CH2][13CH2]C(O)=O Amb22338081 [0,0,0,0,0,1|2,0,1]=4 2647 B7R0.6 OC(=O)[14CH2][14CH2]C(O)=O Amb22337597 [0,0,0,0,0,1|2,0,1]=4 2648 B7R0.6 OC(=O)\C=C\C(F)F Amb24340205 [0,0,0,0,0,1|2,0,1]=4 2649 B7R0.6 OC(=S)CCC(O)=O Amb24586272 [0,0,0,0,0,1|2,0,1]=4 2650 B7R0.6 OC(O)CCC(O)=O Amb25762802 [0,0,0,0,0,1|2,0,0]=3 2651 B7R0.6 O[13C](=O)CC[13C](O)=O Amb22056173 [0,0,0,0,0,1|2,0,1]=4 2652 B7R0.6 O[13C](=O)[13CH2][13CH2][13C](O)=O Amb22056172 [0,0,0,0,0,1|2,0,1]=4 2653 B7R0.6 O[14C](=O)CC[14C](O)=O Amb22352661 [0,0,0,0,0,1|2,0,1]=4 2654 B7R0.6 [13CH3][13C](=O)[13CH2]CC(O)=O Amb22056002 [0,0,0,0,0,1|1,0,1]=3 2655 B7R0.6 [O-]C(=O)CCC(O)=O Amb22730137 [0,0,0,0,0,1|2,0,1]=4 2656 B7R0.6 [O-]C(=O)CCC(O)=O Amb22733837 [0,0,0,0,0,1|2,0,1]=4 2657 B7R0.6 [O-][N+](=O)CCC(=O)O Amb10843224 [0,0,0,0,0,1|3,0,0]=4 2658 B4R0.1 BC(=O)OC Amb22337865 [2,0,0,0,0,0|2,0,0]=4 2659 B4R0.1 BC(=O)OC Amb25199772 [2,0,0,0,0,0|2,0,0]=4 2660 B4R0.1 BCC(C)=O Amb25024392 [2,0,0,0,0,0|2,0,0]=4 2661 B4R0.1 BrC=C(C)C Amb10067297 [2,0,0,0,0,0|1,0,1]=4 2662 B4R0.1 C=CC(O)=O Amb22227738 [2,0,0,0,0,0|0,0,2]=4 2663 B4R0.1 C=CC(O)=O Amb22336305 [2,0,0,0,0,0|0,0,2]=4 2664 B4R0.1 C=CC(O)=O Amb22338581 [2,0,0,0,0,0|0,0,2]=4 2665 B4R0.1 C=CC(O)=O Amb22351186 [2,0,0,0,0,0|0,0,2]=4 2666 B4R0.1 C=CC(O)=O Amb22351399 [2,0,0,0,0,0|0,0,2]=4 2667 B4R0.1 C=CC(O)=O Amb22363130 [2,0,0,0,0,0|0,0,2]=4 2668 B4R0.1 C=C[13C](O)=O Amb22351199 [2,0,0,0,0,0|0,0,2]=4 2669 B4R0.1 CB(C)CI Amb24400642 [2,0,0,0,0,0|2,0,0]=4 2670 B4R0.1 CB(C)CN Amb24505137 [2,0,0,0,0,0|2,0,0]=4 2671 B4R0.1 CB(C)CO Amb24477462 [2,0,0,0,0,0|1,0,0]=3 2672 B4R0.1 CC(=C)[13CH]=O Amb22055667 [2,0,0,0,0,0|0,0,2]=4 2673 B4R0.1 CC(=N)CO Amb24478077 [2,0,0,0,0,0|1,0,1]=4 2674 B4R0.1 CC(=O)CI Amb22831972 [2,0,0,0,0,0|2,0,0]=4 2675 B4R0.1 CC(=O)CN Amb10603379 [2,0,0,0,0,0|2,0,0]=4 2676 B4R0.1 CC(=O)CN Amb22489444 [2,0,0,0,0,0|2,0,0]=4 2677 B4R0.1 CC(=O)CO Amb2404925 [2,0,0,0,0,0|1,0,1]=4 2678 B4R0.1 CC(=O)CS Amb19148935 [2,0,0,0,0,0|2,0,0]=4 2679 B4R0.1 CC(=S)C=O Amb24477343 [2,0,0,0,0,0|1,0,1]=4 2680 B4R0.1 CC(Br)C=C Amb17939275 [2,0,0,0,0,0|1,0,1]=4 2681 B4R0.1 CC(Br)CF Amb24477189 [2,0,0,0,0,0|2,0,0]=4 2682 B4R0.1 CC(Br)CS Amb25025648 [2,0,0,0,0,0|1,1,0]=4 2683 B4R0.1 CC(C)=C=C Amb19930195 [2,0,0,0,0,0|0,0,2]=4 2684 B4R0.1 CC(C)=C=O Amb17672588 [2,0,0,0,0,0|0,0,2]=4 2685 B4R0.1 CC(C)=CCl Amb22338168 [2,0,0,0,0,0|1,0,1]=4 2686 B4R0.1 CC(C)C=C Amb17666952 [2,0,0,0,0,0|0,0,1]=3 2687 B4R0.1 CC(C)CN Amb22230768 [2,0,0,0,0,0|1,0,0]=3 2688 B4R0.1 CC(C)CN Amb24325115 [2,0,0,0,0,0|1,0,0]=3 2689 B4R0.1 CC(C)CN Amb24325409 [2,0,0,0,0,0|1,0,0]=3 2690 B4R0.1 CC(C)C[NH3+] Amb24585767 [2,0,0,0,0,0|1,0,0]=3 2691 B4R0.1 CC(C)C[O-] Amb22338617 [2,0,0,0,0,0|0,0,1]=3 2692 B4R0.1 CC(C)C[Zn+] Amb22228383 [2,0,0,0,0,0|1,0,0]=3 2693 B4R0.1 CC(C)NN Amb22492443 [2,0,0,0,0,0|2,0,0]=4 2694 B4R0.1 CC(C)NO Amb22058701 [2,0,0,0,0,0|1,0,0]=3 2695 B4R0.1 CC(C)ON Amb19889792 [2,0,0,0,0,0|2,0,0]=4 2696 B4R0.1 CC(C)S[Na] Amb22353173 [2,0,0,0,0,0|2,0,0]=4 2697 B4R0.1 CC(C)[Mg]Br Amb17938646 [2,0,0,0,0,0|2,0,0]=4 2698 B4R0.1 CC(C)[Mg]Cl Amb19889423 [2,0,0,0,0,0|2,0,0]=4 2699 B4R0.1 CC(C=O)Cl Amb10603585 [2,0,0,0,0,0|1,0,0]=3 2700 B4R0.1 CC(CF)O Amb10841218 [2,0,0,0,0,0|2,0,0]=4 2701 B4R0.1 CC(CN)Br Amb17593487 [2,0,0,0,0,0|2,0,0]=4 2702 B4R0.1 CC(Cl)CI Amb25326269 [2,0,0,0,0,0|2,0,0]=4 2703 B4R0.1 CC(Cl)CN Amb18638639 [2,0,0,0,0,0|2,0,0]=4 2704 B4R0.1 CC(Cl)CO Amb20623180 [2,0,0,0,0,0|1,0,0]=3 2705 B4R0.1 CC(Cl)C[SiH3] Amb24372912 [2,0,0,0,0,0|1,1,0]=4 2706 B4R0.1 CC(F)CBr Amb24064674 [2,0,0,0,0,0|2,0,0]=4 2707 B4R0.1 CC(F)CN Amb24117010 [2,0,0,0,0,0|2,0,0]=4 2708 B4R0.1 CC(I)C=C Amb24597828 [2,0,0,0,0,0|1,0,1]=4 2709 B4R0.1 CC(I)C=O Amb24477178 [2,0,0,0,0,0|1,0,0]=3 2710 B4R0.1 CC(I)CO Amb24477272 [2,0,0,0,0,0|1,0,0]=3 2711 B4R0.1 CC(N)=CO Amb24478074 [2,0,0,0,0,0|1,0,1]=4 2712 B4R0.1 CC(N)C=C Amb19338158 [2,0,0,0,0,0|1,0,1]=4 2713 B4R0.1 CC(N)C=C Amb20669464 [2,0,0,0,0,0|1,0,1]=4 2714 B4R0.1 CC(N)C=O Amb24476907 [2,0,0,0,0,0|1,0,0]=3 2715 B4R0.1 CC(N)CCl Amb24670798 [2,0,0,0,0,0|2,0,0]=4 2716 B4R0.1 CC(N)CF Amb24113179 [2,0,0,0,0,0|2,0,0]=4 2717 B4R0.1 CC(N)CI Amb24693906 [2,0,0,0,0,0|2,0,0]=4 2718 B4R0.1 CC(N)CO Amb22230596 [2,0,0,0,0,0|1,0,0]=3 2719 B4R0.1 CC(N)CS Amb24476863 [2,0,0,0,0,0|1,1,0]=4 2720 B4R0.1 CC(O)C=O Amb24477285 [2,0,0,0,0,0|1,0,0]=3 2721 B4R0.1 CC(O)CI Amb25790038 [2,0,0,0,0,0|2,0,0]=4 2722 B4R0.1 CC(O)CN Amb22733873 [2,0,0,0,0,0|2,0,0]=4 2723 B4R0.1 CC(O)CO Amb22231414 [2,0,0,0,0,0|1,0,0]=3 2724 B4R0.1 CC(O)CO Amb22336184 [2,0,0,0,0,0|1,0,0]=3 2725 B4R0.1 CC(O)CO Amb22336311 [2,0,0,0,0,0|1,0,0]=3 2726 B4R0.1 CC(O)CO Amb22337860 [2,0,0,0,0,0|1,0,0]=3 2727 B4R0.1 CC(O)CO Amb22337955 [2,0,0,0,0,0|1,0,0]=3 2728 B4R0.1 CC(O)CO Amb22338488 [2,0,0,0,0,0|1,0,0]=3 2729 B4R0.1 CC(O)CO Amb22730967 [2,0,0,0,0,0|1,0,0]=3 2730 B4R0.1 CC(O)CS Amb22348002 [2,0,0,0,0,0|1,1,0]=4 2731 B4R0.1 CC(O)NO Amb24333811 [2,0,0,0,0,0|2,0,0]=4 2732 B4R0.1 CC(S)C=C Amb24477940 [2,0,0,0,0,0|1,0,1]=4 2733 B4R0.1 CC(S)C=O Amb25799633 [2,0,0,0,0,0|1,0,0]=3 2734 B4R0.1 CC(S)CN Amb18523220 [2,0,0,0,0,0|2,0,0]=4 2735 B4R0.1 CC(S)CN Amb20669250 [2,0,0,0,0,0|2,0,0]=4 2736 B4R0.1 CC(S)CO Amb19375527 [2,0,0,0,0,0|1,0,0]=3 2737 B4R0.1 CCC(=C)Br Amb22052658 [2,0,0,0,0,0|2,0,0]=4 2738 B4R0.1 CCC(=C)C Amb10069004 [2,0,0,0,0,0|2,0,0]=4 2739 B4R0.1 CCC(=C)Cl Amb22228725 [2,0,0,0,0,0|2,0,0]=4 2740 B4R0.1 CCC(=C)O Amb22338693 [2,0,0,0,0,0|1,0,0]=3 2741 B4R0.1 CCC(=O)Cl Amb22338551 [2,0,0,0,0,0|1,0,0]=3 2742 B4R0.1 CCC(=O)F Amb10839798 [2,0,0,0,0,0|1,0,0]=3 2743 B4R0.1 CCC(=S)N Amb1114671 [2,0,0,0,0,0|1,1,0]=4 2744 B4R0.1 CCC(C)F Amb22008012 [2,0,0,0,0,0|1,0,1]=4 2745 B4R0.1 CCC(C)[Mg+] Amb24325479 [2,0,0,0,0,0|1,0,1]=4 2746 B4R0.1 CCC(C)[Zn+] Amb22228696 [2,0,0,0,0,0|1,0,1]=4 2747 B4R0.1 CCC(N)O Amb25076743 [2,0,0,0,0,0|1,0,1]=4 2748 B4R0.1 CCC(O)=O Amb22363268 [2,0,0,0,0,0|0,0,0]=2 2749 B4R0.1 CCC(O)Br Amb25045070 [2,0,0,0,0,0|1,0,1]=4 2750 B4R0.1 CCC(O)Cl Amb24390895 [2,0,0,0,0,0|1,0,1]=4 2751 B4R0.1 CCC(O)S Amb25057963 [2,0,0,0,0,0|0,1,1]=4 2752 B4R0.1 CCC(S)=S Amb25219037 [2,0,0,0,0,0|0,2,0]=4 2753 B4R0.1 CCC([O-])=O Amb17942918 [2,0,0,0,0,0|0,0,1]=3 2754 B4R0.1 CCC([O-])=O Amb22043363 [2,0,0,0,0,0|0,0,1]=3 2755 B4R0.1 CCC([O-])=O Amb22053980 [2,0,0,0,0,0|0,0,1]=3 2756 B4R0.1 CCC([O-])=O Amb22353324 [2,0,0,0,0,0|0,0,1]=3 2757 B4R0.1 CCC([O-])=O Amb22730265 [2,0,0,0,0,0|0,0,1]=3 2758 B4R0.1 CCC([O-])=O Amb22731204 [2,0,0,0,0,0|0,0,1]=3 2759 B4R0.1 CCC([O-])=O Amb22732964 [2,0,0,0,0,0|0,0,1]=3 2760 B4R0.1 CCC([O-])=O Amb22733966 [2,0,0,0,0,0|0,0,1]=3 2761 B4R0.1 CCI(=O)=O Amb25809920 [2,0,0,0,0,0|1,0,1]=4 2762 B4R0.1 CCN(C)C Amb22337954 [2,0,0,0,0,0|1,0,1]=4 2763 B4R0.1 CCN(C)O Amb25746619 [2,0,0,0,0,0|2,0,0]=4 2764 B4R0.1 CCS(=O)Cl Amb24647938 [2,0,0,0,0,0|2,0,0]=4 2765 B4R0.1 CCS(C)=O Amb25301908 [2,0,0,0,0,0|2,0,0]=4 2766 B4R0.1 CCS(N)=O Amb24734600 [2,0,0,0,0,0|2,0,0]=4 2767 B4R0.1 CCS(O)=O Amb24332177 [2,0,0,0,0,0|1,0,0]=3 2768 B4R0.1 CCS([O-])=O Amb17943109 [2,0,0,0,0,0|1,0,1]=4 2769 B4R0.1 CCS([O-])=O Amb22411287 [2,0,0,0,0,0|1,0,1]=4 2770 B4R0.1 CC[13C](O)=O Amb22336570 [2,0,0,0,0,0|0,0,0]=2 2771 B4R0.1 CC[13C](O)=O Amb22732548 [2,0,0,0,0,0|0,0,0]=2 2772 B4R0.1 CC[13C]([O-])=O Amb22363364 [2,0,0,0,0,0|0,0,1]=3 2773 B4R0.1 CC[C@@H](C)Br Amb25809928 [2,0,0,0,0,0|1,0,1]=4 2774 B4R0.1 CC[C@@H](C)I Amb25110237 [2,0,0,0,0,0|1,0,1]=4 2775 B4R0.1 CC[C@@H](C)N Amb22225170 [2,0,0,0,0,0|1,0,1]=4 2776 B4R0.1 CC[C@@H](N)O Amb25824305 [2,0,0,0,0,0|1,0,1]=4 2777 B4R0.1 CC[C@H](C)Cl Amb25689589 [2,0,0,0,0,0|1,0,1]=4 2778 B4R0.1 CC[C@H](C)I Amb24426180 [2,0,0,0,0,0|1,0,1]=4 2779 B4R0.1 CC[C@H](C)N Amb19889468 [2,0,0,0,0,0|1,0,1]=4 2780 B4R0.1 CC[C@H](C)S Amb25775158 [2,0,0,0,0,0|1,0,1]=4 2781 B4R0.1 CC[SiH](C)C Amb19893872 [2,0,0,0,0,0|0,1,1]=4 2782 B4R0.1 CN(C)=CBr Amb22336345 [2,0,0,0,0,0|2,0,0]=4 2783 B4R0.1 CN(C)C=C Amb25244447 [2,0,0,0,0,0|1,0,1]=4 2784 B4R0.1 CN(C)C=O Amb22168323 [2,0,0,0,0,0|1,0,0]=3 2785 B4R0.1 CN(C)CO Amb17673884 [2,0,0,0,0,0|1,0,0]=3 2786 B4R0.1 CN(C)N=C Amb19890029 [2,0,0,0,0,0|2,0,0]=4 2787 B4R0.1 CN(C)N=O Amb17938637 [2,0,0,0,0,0|2,0,0]=4 2788 B4R0.1 CN(C)[13CH]=O Amb22363163 [2,0,0,0,0,0|1,0,0]=3 2789 B4R0.1 CN(C=O)N Amb10843911 [2,0,0,0,0,0|2,0,0]=4 2790 B4R0.1 CNC(=O)Br Amb25764660 [2,0,0,0,0,0|2,0,0]=4 2791 B4R0.1 CNC(=O)N Amb1152075 [2,0,0,0,0,0|2,0,0]=4 2792 B4R0.1 CNC(C)C Amb22338323 [2,0,0,0,0,0|1,0,1]=4 2793 B4R0.1 CNC(Cl)=O Amb17942998 [2,0,0,0,0,0|2,0,0]=4 2794 B4R0.1 CNC(N)=O Amb22899158 [2,0,0,0,0,0|2,0,0]=4 2795 B4R0.1 CNC(O)=S Amb25747283 [2,0,0,0,0,0|1,1,0]=4 2796 B4R0.1 COC(C)C Amb22732422 [2,0,0,0,0,0|1,0,1]=4 2797 B4R0.1 COC([O-])=O Amb22731820 [2,0,0,0,0,0|1,0,1]=4 2798 B4R0.1 COC([O-])=O Amb25688001 [2,0,0,0,0,0|1,0,1]=4 2799 B4R0.1 CP(C)CO Amb24430966 [2,0,0,0,0,0|1,0,0]=3 2800 B4R0.1 CSC(=O)Cl Amb22336225 [2,0,0,0,0,0|2,0,0]=4 2801 B4R0.1 CSC(C)=O Amb22043188 [2,0,0,0,0,0|2,0,0]=4 2802 B4R0.1 CSC(C)C Amb22730048 [2,0,0,0,0,0|1,0,1]=4 2803 B4R0.1 CSC(N)=O Amb25082577 [2,0,0,0,0,0|2,0,0]=4 2804 B4R0.1 C[13CH2]C([O-])=O Amb22368991 [2,0,0,0,0,0|0,0,1]=3 2805 B4R0.1 C[13CH2][13C]([O-])=O Amb22338749 [2,0,0,0,0,0|0,0,1]=3 2806 B4R0.1 C[15N](C)C=O Amb22338371 [2,0,0,0,0,0|1,0,0]=3 2807 B4R0.1 C[C@@H](Br)CBr Amb25791075 [2,0,0,0,0,0|2,0,0]=4 2808 B4R0.1 C[C@@H](Br)CO Amb24477146 [2,0,0,0,0,0|1,0,0]=3 2809 B4R0.1 C[C@@H](CO)F Amb10840975 [2,0,0,0,0,0|1,0,0]=3 2810 B4R0.1 C[C@@H](F)CN Amb25830144 [2,0,0,0,0,0|2,0,0]=4 2811 B4R0.1 C[C@@H](N)C=C Amb22225390 [2,0,0,0,0,0|1,0,1]=4 2812 B4R0.1 C[C@@H](N)C=O Amb25090862 [2,0,0,0,0,0|1,0,0]=3 2813 B4R0.1 C[C@@H](N)CF Amb25745231 [2,0,0,0,0,0|2,0,0]=4 2814 B4R0.1 C[C@@H](N)CN Amb22747741 [2,0,0,0,0,0|2,0,0]=4 2815 B4R0.1 C[C@@H](N)CO Amb22748206 [2,0,0,0,0,0|1,0,0]=3 2816 B4R0.1 C[C@@H](N)CS Amb25745019 [2,0,0,0,0,0|1,1,0]=4 2817 B4R0.1 C[C@@H](O)C=O Amb25745956 [2,0,0,0,0,0|1,0,0]=3 2818 B4R0.1 C[C@@H](O)CBr Amb20242351 [2,0,0,0,0,0|2,0,0]=4 2819 B4R0.1 C[C@@H](O)CI Amb20241371 [2,0,0,0,0,0|2,0,0]=4 2820 B4R0.1 C[C@@H](O)CS Amb25662551 [2,0,0,0,0,0|1,1,0]=4 2821 B4R0.1 C[C@@H](S)CN Amb25745448 [2,0,0,0,0,0|2,0,0]=4 2822 B4R0.1 C[C@@H](S)CO Amb25220615 [2,0,0,0,0,0|1,0,0]=3 2823 B4R0.1 C[C@H](Br)CO Amb24661942 [2,0,0,0,0,0|1,0,0]=3 2824 B4R0.1 C[C@H](CO)F Amb10840974 [2,0,0,0,0,0|1,0,0]=3 2825 B4R0.1 C[C@H](Cl)C=C Amb24477039 [2,0,0,0,0,0|1,0,1]=4 2826 B4R0.1 C[C@H](Cl)CN Amb25024879 [2,0,0,0,0,0|2,0,0]=4 2827 B4R0.1 C[C@H](N)C=C Amb22226721 [2,0,0,0,0,0|1,0,1]=4 2828 B4R0.1 C[C@H](N)CF Amb20622784 [2,0,0,0,0,0|2,0,0]=4 2829 B4R0.1 C[C@H](N)CN Amb19515858 [2,0,0,0,0,0|2,0,0]=4 2830 B4R0.1 C[C@H](N)CN Amb20623334 [2,0,0,0,0,0|2,0,0]=4 2831 B4R0.1 C[C@H](N)CS Amb24332667 [2,0,0,0,0,0|1,1,0]=4 2832 B4R0.1 C[C@H](O)C=O Amb24452140 [2,0,0,0,0,0|1,0,0]=3 2833 B4R0.1 C[C@H](O)CBr Amb24477066 [2,0,0,0,0,0|2,0,0]=4 2834 B4R0.1 C[C@H](O)CF Amb24524627 [2,0,0,0,0,0|2,0,0]=4 2835 B4R0.1 C[C@H](O)CS Amb24554233 [2,0,0,0,0,0|1,1,0]=4 2836 B4R0.1 C[C@H](S)CO Amb25662302 [2,0,0,0,0,0|1,0,0]=3 2837 B4R0.1 C[N+](C)=CBr Amb22730803 [2,0,0,0,0,0|2,0,0]=4 2838 B4R0.1 C[N+](C)=CO Amb22731321 [2,0,0,0,0,0|1,0,0]=3 2839 B4R0.1 C[NH+](C)CCl Amb24557829 [2,0,0,0,0,0|2,0,0]=4 2840 B4R0.1 C[SiH](C)C=C Amb25226815 [2,0,0,0,0,0|0,1,1]=4 2841 B4R0.1 C[SiH](C)CCl Amb19893703 [2,0,0,0,0,0|1,1,0]=4 2842 B4R0.1 C[SiH](C)CO Amb25058422 [2,0,0,0,0,0|0,1,0]=3 2843 B4R0.1 ClCN(C)C Amb10552384 [2,0,0,0,0,0|2,0,0]=4 2844 B4R0.1 FC(=O)CCl Amb10839258 [2,0,0,0,0,0|2,0,0]=4 2845 B4R0.1 FCC(=O)Cl Amb16185604 [2,0,0,0,0,0|2,0,0]=4 2846 B4R0.1 FCC(F)C Amb10841203 [2,0,0,0,0,0|2,0,0]=4 2847 B4R0.1 NC(=O)CCl Amb1933827 [2,0,0,0,0,0|2,0,0]=4 2848 B4R0.1 NC(=O)CCl Amb20620153 [2,0,0,0,0,0|2,0,0]=4 2849 B4R0.1 NC(=O)CN Amb22234569 [2,0,0,0,0,0|2,0,0]=4 2850 B4R0.1 NC(=O)CO Amb1804460 [2,0,0,0,0,0|2,0,0]=4 2851 B4R0.1 NC(Cl)C=O Amb24696065 [2,0,0,0,0,0|2,0,0]=4 2852 B4R0.1 NC(O)CO Amb25267126 [2,0,0,0,0,0|2,0,0]=4 2853 B4R0.1 NC(S)CO Amb24392950 [2,0,0,0,0,0|2,0,0]=4 2854 B4R0.1 NCC(=O)N Amb10604177 [2,0,0,0,0,0|2,0,0]=4 2855 B4R0.1 NCC(=O)S Amb17593043 [2,0,0,0,0,0|1,1,0]=4 2856 B4R0.1 NCC(O)=O Amb22274145 [2,0,0,0,0,0|1,0,0]=3 2857 B4R0.1 NCC(O)=O Amb22731925 [2,0,0,0,0,0|1,0,0]=3 2858 B4R0.1 NCC([O-])=O Amb20240906 [2,0,0,0,0,0|1,0,1]=4 2859 B4R0.1 NCC([O-])=O Amb21962917 [2,0,0,0,0,0|1,0,1]=4 2860 B4R0.1 NCC([O-])=O Amb22167467 [2,0,0,0,0,0|1,0,1]=4 2861 B4R0.1 NCC([O-])=O Amb22167948 [2,0,0,0,0,0|1,0,1]=4 2862 B4R0.1 NCC([O-])=O Amb22336294 [2,0,0,0,0,0|1,0,1]=4 2863 B4R0.1 NCC([O-])=O Amb22493796 [2,0,0,0,0,0|1,0,1]=4 2864 B4R0.1 NCC([O-])=O Amb22729954 [2,0,0,0,0,0|1,0,1]=4 2865 B4R0.1 NCC([O-])=O Amb22729967 [2,0,0,0,0,0|1,0,1]=4 2866 B4R0.1 NCC([O-])=O Amb22733691 [2,0,0,0,0,0|1,0,1]=4 2867 B4R0.1 NC[13C](O)=O Amb22354047 [2,0,0,0,0,0|1,0,0]=3 2868 B4R0.1 NNC(C)C Amb10782088 [2,0,0,0,0,0|2,0,0]=4 2869 B4R0.1 NNC(C)C Amb1101958 [2,0,0,0,0,0|2,0,0]=4 2870 B4R0.1 N[13CH2]C(O)=O Amb22363299 [2,0,0,0,0,0|1,0,0]=3 2871 B4R0.1 N[13CH2][13C](O)=O Amb22351252 [2,0,0,0,0,0|1,0,0]=3 2872 B4R0.1 O([2H])C(C)C Amb16185559 [2,0,0,0,0,0|2,0,0]=4 2873 B4R0.1 O=C(Cl)CI Amb22045163 [2,0,0,0,0,0|2,0,0]=4 2874 B4R0.1 O=C(F)CF Amb24476837 [2,0,0,0,0,0|2,0,0]=4 2875 B4R0.1 O=C(P)CCl Amb24377624 [2,0,0,0,0,0|2,0,0]=4 2876 B4R0.1 O=CC(Cl)Br Amb22054538 [2,0,0,0,0,0|2,0,0]=4 2877 B4R0.1 O=CC(Cl)Cl Amb17593172 [2,0,0,0,0,0|2,0,0]=4 2878 B4R0.1 O=CC(Cl)Cl Amb22055052 [2,0,0,0,0,0|2,0,0]=4 2879 B4R0.1 OC(=O)CI Amb1916034 [2,0,0,0,0,0|1,0,0]=3 2880 B4R0.1 OC(=O)CI Amb22274295 [2,0,0,0,0,0|1,0,0]=3 2881 B4R0.1 OC(=O)CI Amb22353096 [2,0,0,0,0,0|1,0,0]=3 2882 B4R0.1 OC(=O)CO Amb22338156 [2,0,0,0,0,0|1,0,0]=3 2883 B4R0.1 OC(=O)CP Amb24476887 [2,0,0,0,0,0|1,0,0]=3 2884 B4R0.1 OC(=O)CS Amb22360787 [2,0,0,0,0,0|1,0,0]=3 2885 B4R0.1 OC(=O)CS Amb24323537 [2,0,0,0,0,0|1,0,0]=3 2886 B4R0.1 OC(=O)O[Na] Amb22411585 [2,0,0,0,0,0|2,0,0]=4 2887 B4R0.1 OC(=O)[13CH2]Br Amb22363172 [2,0,0,0,0,0|1,0,0]=3 2888 B4R0.1 OC(=O)[13CH2]Cl Amb22351601 [2,0,0,0,0,0|1,0,0]=3 2889 B4R0.1 OC(=O)[13CH2]I Amb22367368 [2,0,0,0,0,0|1,0,0]=3 2890 B4R0.1 OC(=S)CCl Amb25064312 [2,0,0,0,0,0|1,1,0]=4 2891 B4R0.1 OC(=[18O])CBr Amb22367291 [2,0,0,0,0,0|1,0,0]=3 2892 B4R0.1 OC(Cl)C=O Amb25700927 [2,0,0,0,0,0|2,0,0]=4 2893 B4R0.1 OCC(=O)Cl Amb25121296 [2,0,0,0,0,0|2,0,0]=4 2894 B4R0.1 OCC(F)Br Amb22228819 [2,0,0,0,0,0|2,0,0]=4 2895 B4R0.1 OCC(O)=S Amb25245907 [2,0,0,0,0,0|1,1,0]=4 2896 B4R0.1 OCC(O)Br Amb25794267 [2,0,0,0,0,0|2,0,0]=4 2897 B4R0.1 OCC(O)Cl Amb24433225 [2,0,0,0,0,0|2,0,0]=4 2898 B4R0.1 OCC(O)I Amb25362172 [2,0,0,0,0,0|2,0,0]=4 2899 B4R0.1 OCC(O)O Amb25662266 [2,0,0,0,0,0|2,0,0]=4 2900 B4R0.1 OCP(=O)O Amb1981423 [2,0,0,0,0,0|2,0,0]=4 2901 B4R0.1 O[13CH2][13C](O)=O Amb22055344 [2,0,0,0,0,0|1,0,0]=3 2902 B4R0.1 O[13C](=O)CBr Amb22351346 [2,0,0,0,0,0|1,0,0]=3 2903 B4R0.1 O[13C](=O)CCl Amb22351545 [2,0,0,0,0,0|1,0,0]=3 2904 B4R0.1 O[13C](=O)CI Amb22367367 [2,0,0,0,0,0|1,0,0]=3 2905 B4R0.1 O[13C](=O)[13CH2]Br Amb22351322 [2,0,0,0,0,0|1,0,0]=3 2906 B4R0.1 O[13C](=O)[13CH2]Cl Amb17610796 [2,0,0,0,0,0|1,0,0]=3 2907 B4R0.1 O[13C](=O)[13CH2]I Amb22367449 [2,0,0,0,0,0|1,0,0]=3 2908 B4R0.1 O[13C](=O)[13CH]=O Amb22055361 [2,0,0,0,0,0|1,0,1]=4 2909 B4R0.1 O[13C](=O)[13CH]=[13CH2] Amb17607705 [2,0,0,0,0,0|0,0,2]=4 2910 B4R0.1 O[13C](=[18O])CBr Amb22337237 [2,0,0,0,0,0|1,0,0]=3 2911 B4R0.1 O[14C](=O)CBr Amb22731740 [2,0,0,0,0,0|1,0,0]=3 2912 B4R0.1 O[14C](=O)O[Na] Amb22350243 [2,0,0,0,0,0|2,0,0]=4 2913 B4R0.1 [13CH3]CC([O-])=O Amb22336277 [2,0,0,0,0,0|0,0,1]=3 2914 B4R0.1 [13CH3]N([13CH3])C=O Amb22353459 [2,0,0,0,0,0|1,0,0]=3 2915 B4R0.1 [13CH3][13CH2]C(O)=O Amb22337241 [2,0,0,0,0,0|0,0,0]=2 2916 B4R0.1 [13CH3][13CH2][13C](O)=O Amb22367502 [2,0,0,0,0,0|0,0,0]=2 2917 B4R0.1 [13CH3][13CH]([13CH3])[13CH2]O Amb22338875 [2,0,0,0,0,0|0,0,0]=2 2918 B4R0.1 [15NH2]C(=O)CI Amb22367467 [2,0,0,0,0,0|2,0,0]=4 2919 B4R0.1 [15NH2]CC(O)=O Amb22337980 [2,0,0,0,0,0|1,0,0]=3 2920 B4R0.1 [15NH2]C[13C](O)=O Amb22367030 [2,0,0,0,0,0|1,0,0]=3 2921 B4R0.1 [15NH2][13CH2]C(O)=O Amb22353332 [2,0,0,0,0,0|1,0,0]=3 2922 B4R0.1 [15NH2][13CH2][13C](O)=O Amb22055358 [2,0,0,0,0,0|1,0,0]=3 2923 B4R0.1 [Li]OC(C)C Amb22730754 [2,0,0,0,0,0|2,0,0]=4 2924 B4R0.1 [O-]C(=O)CBr Amb22049507 [2,0,0,0,0,0|1,0,1]=4 2925 B4R0.1 [O-]C(=O)CC Amb10844614 [2,0,0,0,0,0|0,0,1]=3 2926 B4R0.1 [O-]C(=O)CCl Amb22330602 [2,0,0,0,0,0|1,0,1]=4 2927 B4R0.1 [O-]C(=O)CF Amb10840933 [2,0,0,0,0,0|1,0,1]=4 2928 B4R0.1 [O-]C(=O)CF Amb22230760 [2,0,0,0,0,0|1,0,1]=4 2929 B4R0.1 [O-]C(=O)CF Amb22730747 [2,0,0,0,0,0|1,0,1]=4 2930 B4R0.1 [O-]C(=O)CI Amb22229643 [2,0,0,0,0,0|1,0,1]=4 2931 B4R0.1 [O-]C(=O)CO Amb22045509 [2,0,0,0,0,0|1,0,1]=4 2932 B4R0.1 [O-]C(=O)CO Amb22730982 [2,0,0,0,0,0|1,0,1]=4 2933 B4R0.1 [O-]CC([O-])=O Amb22739620 [2,0,0,0,0,0|1,0,1]=4 2934 B4R0.2 C#CCC=O Amb25681696 [2,0,0,0,0,0|0,0,2]=4 2935 B4R0.2 C=CCC=O Amb25058716 [2,0,0,0,0,0|0,0,2]=4 2936 B4R0.2 C=CCCCl Amb22229725 [2,0,0,0,0,0|2,0,0]=4 2937 B4R0.2 C=CCCI Amb24079603 [2,0,0,0,0,0|2,0,0]=4 2938 B4R0.2 C=CCCS Amb24117955 [2,0,0,0,0,0|2,0,0]=4 2939 B4R0.2 CC#CC=O Amb24477088 [2,0,0,0,0,0|0,0,2]=4 2940 B4R0.2 CCC#CO Amb22492573 [2,0,0,0,0,0|0,0,2]=4 2941 B4R0.2 CCC=CCl Amb22227554 [2,0,0,0,0,0|1,0,1]=4 2942 B4R0.2 CCC=NO Amb24369620 [2,0,0,0,0,0|1,0,1]=4 2943 B4R0.2 CCCCN Amb22002333 [2,0,0,0,0,0|1,0,1]=4 2944 B4R0.2 CCCCN Amb24325127 [2,0,0,0,0,0|1,0,1]=4 2945 B4R0.2 CCCCN Amb24325258 [2,0,0,0,0,0|1,0,1]=4 2946 B4R0.2 CCCCO Amb22336484 [2,0,0,0,0,0|0,0,1]=3 2947 B4R0.2 CCCCO Amb22338139 [2,0,0,0,0,0|0,0,1]=3 2948 B4R0.2 CCCCO Amb22338167 [2,0,0,0,0,0|0,0,1]=3 2949 B4R0.2 CCCCO Amb22351678 [2,0,0,0,0,0|0,0,1]=3 2950 B4R0.2 CCCCP Amb24334197 [2,0,0,0,0,0|1,0,1]=4 2951 B4R0.2 CCCCS Amb22367090 [2,0,0,0,0,0|0,1,1]=4 2952 B4R0.2 CCCC[*] Amb24270972 [2,0,0,0,0,0|1,0,1]=4 2953 B4R0.2 CCCC[Mg+] Amb22045798 [2,0,0,0,0,0|1,0,1]=4 2954 B4R0.2 CCCC[NH3+] Amb22366025 [2,0,0,0,0,0|1,0,1]=4 2955 B4R0.2 CCCC[O-] Amb17940588 [2,0,0,0,0,0|0,0,2]=4 2956 B4R0.2 CCCC[O-] Amb22045714 [2,0,0,0,0,0|0,0,2]=4 2957 B4R0.2 CCCC[O-] Amb22047270 [2,0,0,0,0,0|0,0,2]=4 2958 B4R0.2 CCCC[O-] Amb22052429 [2,0,0,0,0,0|0,0,2]=4 2959 B4R0.2 CCCC[O-] Amb22053566 [2,0,0,0,0,0|0,0,2]=4 2960 B4R0.2 CCCC[O-] Amb22053645 [2,0,0,0,0,0|0,0,2]=4 2961 B4R0.2 CCCC[O-] Amb22053708 [2,0,0,0,0,0|0,0,2]=4 2962 B4R0.2 CCCC[SiH3] Amb19883792 [2,0,0,0,0,0|1,0,1]=4 2963 B4R0.2 CCCC[Sn+3] Amb22053676 [2,0,0,0,0,0|1,0,1]=4 2964 B4R0.2 CCCC[Zn+] Amb22230365 [2,0,0,0,0,0|1,0,1]=4 2965 B4R0.2 CCCNC Amb1125050 [2,0,0,0,0,0|2,0,0]=4 2966 B4R0.2 CCCNC Amb13951517 [2,0,0,0,0,0|2,0,0]=4 2967 B4R0.2 CCCNN Amb22490873 [2,0,0,0,0,0|2,0,0]=4 2968 B4R0.2 CCCNO Amb20621997 [2,0,0,0,0,0|1,0,0]=3 2969 B4R0.2 CCCNO Amb24333131 [2,0,0,0,0,0|1,0,0]=3 2970 B4R0.2 CCCOC Amb22227974 [2,0,0,0,0,0|2,0,0]=4 2971 B4R0.2 CCCON Amb21929105 [2,0,0,0,0,0|2,0,0]=4 2972 B4R0.2 CCCO[NH3+] Amb2412392 [2,0,0,0,0,0|2,0,0]=4 2973 B4R0.2 CCCPC Amb24334551 [2,0,0,0,0,0|2,0,0]=4 2974 B4R0.2 CCCSC Amb22045208 [2,0,0,0,0,0|2,0,0]=4 2975 B4R0.2 CCCS[Na] Amb22352940 [2,0,0,0,0,0|2,0,0]=4 2976 B4R0.2 CCC[Hg]Cl Amb22730789 [2,0,0,0,0,0|2,0,0]=4 2977 B4R0.2 CCC[Mg]Br Amb17939070 [2,0,0,0,0,0|2,0,0]=4 2978 B4R0.2 CCC[Mg]Cl Amb22352591 [2,0,0,0,0,0|2,0,0]=4 2979 B4R0.2 CCC[SiH2]C Amb19892273 [2,0,0,0,0,0|1,1,0]=4 2980 B4R0.2 CCC[SiH2]S Amb24349756 [2,0,0,0,0,0|0,2,0]=4 2981 B4R0.2 CCC[Zn]Br Amb22000414 [2,0,0,0,0,0|2,0,0]=4 2982 B4R0.2 CCNC=C Amb24120592 [2,0,0,0,0,0|2,0,0]=4 2983 B4R0.2 CCNC=O Amb22229692 [2,0,0,0,0,0|1,0,0]=3 2984 B4R0.2 CCNC=S Amb24476965 [2,0,0,0,0,0|1,1,0]=4 2985 B4R0.2 CCOC=C Amb2447619 [2,0,0,0,0,0|2,0,0]=4 2986 B4R0.2 CCOC=N Amb22167706 [2,0,0,0,0,0|2,0,0]=4 2987 B4R0.2 CCOCO Amb25042105 [2,0,0,0,0,0|1,0,1]=4 2988 B4R0.2 CCON=O Amb17938639 [2,0,0,0,0,0|2,0,0]=4 2989 B4R0.2 CCO[13CH]=O Amb22351501 [2,0,0,0,0,0|1,0,0]=3 2990 B4R0.2 CCSC=C Amb10604172 [2,0,0,0,0,0|2,0,0]=4 2991 B4R0.2 CC\C=C\Br Amb22002685 [2,0,0,0,0,0|1,0,1]=4 2992 B4R0.2 CC\C=C\Cl Amb25024567 [2,0,0,0,0,0|1,0,1]=4 2993 B4R0.2 CC\C=C\N Amb25188893 [2,0,0,0,0,0|1,0,1]=4 2994 B4R0.2 CC\C=N\O Amb24333315 [2,0,0,0,0,0|1,0,1]=4 2995 B4R0.2 CNCNO Amb24392932 [2,0,0,0,0,0|2,0,0]=4 2996 B4R0.2 COCC=C Amb10070248 [2,0,0,0,0,0|2,0,0]=4 2997 B4R0.2 COCCO Amb22338563 [2,0,0,0,0,0|1,0,1]=4 2998 B4R0.2 C[Se]CC=C Amb22735092 [2,0,0,0,0,0|2,0,0]=4 2999 B4R0.2 C\C=C\CC Amb22730891 [2,0,0,0,0,0|1,0,1]=4 3000 B4R0.2 ClCCC=O Amb16233605 [2,0,0,0,0,0|1,0,0]=3 3001 B4R0.2 NCCC=C Amb10601640 [2,0,0,0,0,0|2,0,0]=4 3002 B4R0.2 NCCC=O Amb24476871 [2,0,0,0,0,0|1,0,0]=3 3003 B4R0.2 NCCCO Amb22229163 [2,0,0,0,0,0|1,0,1]=4 3004 B4R0.2 NCCCO Amb22350557 [2,0,0,0,0,0|1,0,1]=4 3005 B4R0.2 NCCNO Amb24476856 [2,0,0,0,0,0|2,0,0]=4 3006 B4R0.2 NCCS=O Amb25826403 [2,0,0,0,0,0|2,0,0]=4 3007 B4R0.2 NNCC=O Amb24550561 [2,0,0,0,0,0|2,0,0]=4 3008 B4R0.2 O=CCCBr Amb18124460 [2,0,0,0,0,0|1,0,0]=3 3009 B4R0.2 O=CCCF Amb21858609 [2,0,0,0,0,0|1,0,0]=3 3010 B4R0.2 O=CCN=O Amb24477338 [2,0,0,0,0,0|2,0,0]=4 3011 B4R0.2 O=CNCCl Amb24613099 [2,0,0,0,0,0|2,0,0]=4 3012 B4R0.2 O=NCCCl Amb25721260 [2,0,0,0,0,0|2,0,0]=4 3013 B4R0.2 OCCC=O Amb24412391 [2,0,0,0,0,0|1,0,0]=3 3014 B4R0.2 OCCCO Amb22369724 [2,0,0,0,0,0|1,0,1]=4 3015 B4R0.2 OCCCO Amb22733136 [2,0,0,0,0,0|1,0,1]=4 3016 B4R0.2 OCCNO Amb24477455 [2,0,0,0,0,0|2,0,0]=4 3017 B4R0.2 OCCSO Amb25840750 [2,0,0,0,0,0|2,0,0]=4 3018 B4R0.2 OCOC=O Amb25694134 [2,0,0,0,0,0|2,0,0]=4 3019 B4R0.2 OC[13CH2]CO Amb22338655 [2,0,0,0,0,0|1,0,1]=4 3020 B4R0.2 O[13CH2][13CH2][13CH2]Br Amb22338924 [2,0,0,0,0,0|1,0,1]=4 3021 B4R0.2 O\C=C/CCl Amb22338049 [2,0,0,0,0,0|1,0,1]=4 3022 B4R0.2 [13CH3]O[13CH2][13CH2]O Amb22337754 [2,0,0,0,0,0|1,0,1]=4 3023 B4R0.2 [2H]OCCC Amb22731779 [2,0,0,0,0,0|2,0,0]=4 3024 B4R0.2 [C-]#[N+]CCC Amb24117082 [2,0,0,0,0,0|2,0,0]=4 3025 B6R0.1 C=C(CCO)C=O Amb25278289 [1,1,0,0,0,0|2,0,0]=4 3026 B6R0.1 C=C(CCO)CO Amb25825219 [1,1,0,0,0,0|2,0,0]=4 3027 B6R0.1 C=C(CO)CCN Amb24426567 [1,1,0,0,0,0|2,0,0]=4 3028 B6R0.1 C=CC(=O)CCCl Amb24446646 [1,1,0,0,0,0|2,0,0]=4 3029 B6R0.1 C=CC(Cl)CC=O Amb24595013 [1,1,0,0,0,0|1,0,1]=4 3030 B6R0.1 C=CCC(Br)CO Amb24399232 [1,1,0,0,0,0|2,0,0]=4 3031 B6R0.1 C=CCC(Cl)CO Amb25807468 [1,1,0,0,0,0|2,0,0]=4 3032 B6R0.1 C=CCC(N)CF Amb25183816 [1,1,0,0,0,0|2,0,0]=4 3033 B6R0.1 C=CCC(N)CN Amb24479839 [1,1,0,0,0,0|2,0,0]=4 3034 B6R0.1 C=CCC(N)CO Amb24745656 [1,1,0,0,0,0|2,0,0]=4 3035 B6R0.1 C=CCC(O)CBr Amb24478446 [1,1,0,0,0,0|2,0,0]=4 3036 B6R0.1 C=CCC(O)CF Amb25345890 [1,1,0,0,0,0|2,0,0]=4 3037 B6R0.1 C=CCC(O)CI Amb25746456 [1,1,0,0,0,0|2,0,0]=4 3038 B6R0.1 C=CCC(O)CN Amb22304831 [1,1,0,0,0,0|2,0,0]=4 3039 B6R0.1 C=CC[C@@H](N)CO Amb24088744 [1,1,0,0,0,0|2,0,0]=4 3040 B6R0.1 C=CC[C@@H](O)CCl Amb22736714 [1,1,0,0,0,0|2,0,0]=4 3041 B6R0.1 C=CC[C@@H](O)CI Amb24419791 [1,1,0,0,0,0|2,0,0]=4 3042 B6R0.1 C=CC[C@H](Br)CO Amb24479036 [1,1,0,0,0,0|2,0,0]=4 3043 B6R0.1 C=CC[C@H](N)CO Amb24088875 [1,1,0,0,0,0|2,0,0]=4 3044 B6R0.1 C=CC[C@H](N)CO Amb25732908 [1,1,0,0,0,0|2,0,0]=4 3045 B6R0.1 C=CC[C@H](O)CCl Amb22736707 [1,1,0,0,0,0|2,0,0]=4 3046 B6R0.1 CC(C#C)NC=O Amb25366975 [1,1,0,0,0,0|1,0,1]=4 3047 B6R0.1 CC(C#N)NC=O Amb18120801 [1,1,0,0,0,0|1,0,1]=4 3048 B6R0.1 CC(CBr)CC#N Amb18126303 [1,1,0,0,0,0|1,0,1]=4 3049 B6R0.1 CC(CBr)CC=C Amb24740775 [1,1,0,0,0,0|1,0,0]=3 3050 B6R0.1 CC(CBr)CC=O Amb18126382 [1,1,0,0,0,0|0,0,0]=2 3051 B6R0.1 CC(CBr)NC=O Amb25363197 [1,1,0,0,0,0|1,0,0]=3 3052 B6R0.1 CC(CC)\C=C\Cl Amb24334568 [1,1,0,0,0,0|1,0,1]=4 3053 B6R0.1 CC(CC=C)C=C Amb25705690 [1,1,0,0,0,0|1,0,1]=4 3054 B6R0.1 CC(CC=C)NN Amb25351147 [1,1,0,0,0,0|2,0,0]=4 3055 B6R0.1 CC(CC=O)=C=C Amb24434894 [1,1,0,0,0,0|0,0,2]=4 3056 B6R0.1 CC(CC=O)C#N Amb18638919 [1,1,0,0,0,0|0,0,1]=3 3057 B6R0.1 CC(CC=O)C=C Amb18120863 [1,1,0,0,0,0|0,0,1]=3 3058 B6R0.1 CC(CC=O)C=O Amb18121376 [1,1,0,0,0,0|0,0,1]=3 3059 B6R0.1 CC(CCCl)CCl Amb24479659 [1,1,0,0,0,0|1,0,1]=4 3060 B6R0.1 CC(CCI)CI Amb25777394 [1,1,0,0,0,0|1,0,1]=4 3061 B6R0.1 CC(CCN)CN Amb21955767 [1,1,0,0,0,0|1,0,1]=4 3062 B6R0.1 CC(CCO)C#C Amb25762142 [1,1,0,0,0,0|0,0,2]=4 3063 B6R0.1 CC(CCO)C=C Amb22229374 [1,1,0,0,0,0|0,0,2]=4 3064 B6R0.1 CC(CCO)C=C Amb22641463 [1,1,0,0,0,0|0,0,2]=4 3065 B6R0.1 CC(CCl)CC#N Amb25735504 [1,1,0,0,0,0|1,0,1]=4 3066 B6R0.1 CC(CCl)CC=O Amb24332851 [1,1,0,0,0,0|0,0,0]=2 3067 B6R0.1 CC(CCl)CCN Amb24436514 [1,1,0,0,0,0|1,0,1]=4 3068 B6R0.1 CC(CCl)N=C=O Amb25314842 [1,1,0,0,0,0|1,0,1]=4 3069 B6R0.1 CC(CCl)\C=C\Cl Amb24472920 [1,1,0,0,0,0|1,0,1]=4 3070 B6R0.1 CC(CF)CC#N Amb24742643 [1,1,0,0,0,0|1,0,1]=4 3071 B6R0.1 CC(CF)CCO Amb24332497 [1,1,0,0,0,0|0,0,1]=3 3072 B6R0.1 CC(CN)CC=C Amb18121275 [1,1,0,0,0,0|1,0,0]=3 3073 B6R0.1 CC(CN)CCBr Amb25353643 [1,1,0,0,0,0|1,0,1]=4 3074 B6R0.1 CC(CN)CCCl Amb24599413 [1,1,0,0,0,0|1,0,1]=4 3075 B6R0.1 CC(CN)CCF Amb24539384 [1,1,0,0,0,0|1,0,1]=4 3076 B6R0.1 CC(CN)CNO Amb25235896 [1,1,0,0,0,0|1,0,0]=3 3077 B6R0.1 CC(CNN)CN Amb24673236 [1,1,0,0,0,0|2,0,0]=4 3078 B6R0.1 CC(CO)CC#C Amb24406137 [1,1,0,0,0,0|1,0,1]=4 3079 B6R0.1 CC(CO)CC#N Amb24691578 [1,1,0,0,0,0|1,0,1]=4 3080 B6R0.1 CC(CO)CC=C Amb17593084 [1,1,0,0,0,0|1,0,0]=3 3081 B6R0.1 CC(CO)CC=O Amb18639949 [1,1,0,0,0,0|0,0,0]=2 3082 B6R0.1 CC(CO)CCCl Amb24568555 [1,1,0,0,0,0|1,0,1]=4 3083 B6R0.1 CC(CO)CNC Amb17569890 [1,1,0,0,0,0|2,0,0]=4 3084 B6R0.1 CC(CO)CON Amb25746199 [1,1,0,0,0,0|2,0,0]=4 3085 B6R0.1 CC(CO)NC=O Amb25330301 [1,1,0,0,0,0|1,0,0]=3 3086 B6R0.1 CC(CO)OC=O Amb25026452 [1,1,0,0,0,0|1,0,0]=3 3087 B6R0.1 CC(CO)OCO Amb24332099 [1,1,0,0,0,0|1,0,1]=4 3088 B6R0.1 CC(CON)CN Amb24479834 [1,1,0,0,0,0|2,0,0]=4 3089 B6R0.1 CC(OC)CC=O Amb17593089 [1,1,0,0,0,0|0,0,0]=2 3090 B6R0.1 CC(OC)CCN Amb13952649 [1,1,0,0,0,0|1,0,1]=4 3091 B6R0.1 CC(SC)CCN Amb13952574 [1,1,0,0,0,0|1,0,1]=4 3092 B6R0.1 CC(\C=C\O)C#C Amb25686428 [1,1,0,0,0,0|0,0,2]=4 3093 B6R0.1 CC=C(C)CCO Amb22229371 [1,1,0,0,0,0|0,0,2]=4 3094 B6R0.1 CC=NC(C)CO Amb24332341 [1,1,0,0,0,0|2,0,0]=4 3095 B6R0.1 CC=N[C@@H](C)CO Amb24507477 [1,1,0,0,0,0|2,0,0]=4 3096 B6R0.1 CCC(=C)CC=O Amb24445213 [1,1,0,0,0,0|0,0,2]=4 3097 B6R0.1 CCC(=C)CCC Amb22228810 [1,1,0,0,0,0|2,0,0]=4 3098 B6R0.1 CCC(=O)CC=O Amb24333311 [1,1,0,0,0,0|1,0,1]=4 3099 B6R0.1 CCC(=O)CCN Amb18202790 [1,1,0,0,0,0|2,0,0]=4 3100 B6R0.1 CCC(=O)CCS Amb24733984 [1,1,0,0,0,0|2,0,0]=4 3101 B6R0.1 CCC(=O)COC Amb19515551 [1,1,0,0,0,0|2,0,0]=4 3102 B6R0.1 CCC(=O)SCC Amb22043397 [1,1,0,0,0,0|2,0,0]=4 3103 B6R0.1 CCC(Br)CC=C Amb24528531 [1,1,0,0,0,0|2,0,0]=4 3104 B6R0.1 CCC(C)C=NO Amb24443378 [1,1,0,0,0,0|1,0,1]=4 3105 B6R0.1 CCC(C)CC#C Amb22229837 [1,1,0,0,0,0|1,0,1]=4 3106 B6R0.1 CCC(C)CC#N Amb24117251 [1,1,0,0,0,0|1,0,1]=4 3107 B6R0.1 CCC(C)CCBr Amb22641836 [1,1,0,0,0,0|1,0,1]=4 3108 B6R0.1 CCC(C)CCC Amb22229359 [1,1,0,0,0,0|1,0,1]=4 3109 B6R0.1 CCC(C)CCCl Amb24478904 [1,1,0,0,0,0|1,0,1]=4 3110 B6R0.1 CCC(C)CCS Amb24657421 [1,1,0,0,0,0|0,1,1]=4 3111 B6R0.1 CCC(C)CNC Amb19271598 [1,1,0,0,0,0|2,0,0]=4 3112 B6R0.1 CCC(C)CON Amb25316087 [1,1,0,0,0,0|2,0,0]=4 3113 B6R0.1 CCC(C)C[Mg]Br Amb22897327 [1,1,0,0,0,0|2,0,0]=4 3114 B6R0.1 CCC(C)C[Zn]Br Amb22897702 [1,1,0,0,0,0|2,0,0]=4 3115 B6R0.1 CCC(C)NC=S Amb24659847 [1,1,0,0,0,0|1,1,0]=4 3116 B6R0.1 CCC(C)OC=O Amb22734039 [1,1,0,0,0,0|1,0,0]=3 3117 B6R0.1 CCC(C)SC=C Amb25745483 [1,1,0,0,0,0|2,0,0]=4 3118 B6R0.1 CCC(I)CCO Amb24574041 [1,1,0,0,0,0|1,0,1]=4 3119 B6R0.1 CCC(N)CC=C Amb18977592 [1,1,0,0,0,0|2,0,0]=4 3120 B6R0.1 CCC(N)CC=C Amb22831631 [1,1,0,0,0,0|2,0,0]=4 3121 B6R0.1 CCC(N)CCO Amb18833133 [1,1,0,0,0,0|1,0,1]=4 3122 B6R0.1 CCC(O)CC=C Amb22734219 [1,1,0,0,0,0|2,0,0]=4 3123 B6R0.1 CCCC(=C)C=O Amb18639170 [1,1,0,0,0,0|1,0,0]=3 3124 B6R0.1 CCCC(=N)NO Amb10069022 [1,1,0,0,0,0|1,0,0]=3 3125 B6R0.1 CCCC(=O)C#C Amb25696103 [1,1,0,0,0,0|1,0,0]=3 3126 B6R0.1 CCCC(=O)C=O Amb18639569 [1,1,0,0,0,0|0,0,1]=3 3127 B6R0.1 CCCC(=O)CBr Amb24433274 [1,1,0,0,0,0|1,0,0]=3 3128 B6R0.1 CCCC(=O)CCl Amb19372924 [1,1,0,0,0,0|1,0,0]=3 3129 B6R0.1 CCCC(=O)CF Amb25370812 [1,1,0,0,0,0|1,0,0]=3 3130 B6R0.1 CCCC(=O)CN Amb17593086 [1,1,0,0,0,0|1,0,0]=3 3131 B6R0.1 CCCC(=O)CO Amb25125092 [1,1,0,0,0,0|0,0,0]=2 3132 B6R0.1 CCCC(=O)CS Amb24631668 [1,1,0,0,0,0|0,1,0]=3 3133 B6R0.1 CCCC(=S)OC Amb22043317 [1,1,0,0,0,0|0,1,0]=3 3134 B6R0.1 CCCC(Br)C=O Amb18126388 [1,1,0,0,0,0|1,0,1]=4 3135 B6R0.1 CCCC(Br)CO Amb25320904 [1,1,0,0,0,0|1,0,1]=4 3136 B6R0.1 CCCC(C)=CBr Amb24373188 [1,1,0,0,0,0|2,0,0]=4 3137 B6R0.1 CCCC(C)=CC Amb25744974 [1,1,0,0,0,0|2,0,0]=4 3138 B6R0.1 CCCC(C)=NN Amb24673239 [1,1,0,0,0,0|2,0,0]=4 3139 B6R0.1 CCCC(C)=NO Amb24693854 [1,1,0,0,0,0|1,0,0]=3 3140 B6R0.1 CCCC(C)CBr Amb18177792 [1,1,0,0,0,0|1,0,1]=4 3141 B6R0.1 CCCC(C)CI Amb24531410 [1,1,0,0,0,0|1,0,1]=4 3142 B6R0.1 CCCC(C)CS Amb25851785 [1,1,0,0,0,0|1,0,1]=4 3143 B6R0.1 CCCC(C)NO Amb25737149 [1,1,0,0,0,0|1,0,1]=4 3144 B6R0.1 CCCC(C)ON Amb24424249 [1,1,0,0,0,0|1,0,1]=4 3145 B6R0.1 CCCC(Cl)C=O Amb18124277 [1,1,0,0,0,0|1,0,1]=4 3146 B6R0.1 CCCC(F)C=O Amb24544750 [1,1,0,0,0,0|1,0,1]=4 3147 B6R0.1 CCCC(I)C=O Amb25290285 [1,1,0,0,0,0|1,0,1]=4 3148 B6R0.1 CCCC(O)C=C Amb22002474 [1,1,0,0,0,0|1,0,1]=4 3149 B6R0.1 CCCC(O)C=O Amb24531721 [1,1,0,0,0,0|0,0,1]=3 3150 B6R0.1 CCCC(O)CBr Amb24365915 [1,1,0,0,0,0|1,0,1]=4 3151 B6R0.1 CCCC(O)CCl Amb24470722 [1,1,0,0,0,0|1,0,1]=4 3152 B6R0.1 CCCC(O)NN Amb25282642 [1,1,0,0,0,0|1,0,1]=4 3153 B6R0.1 CCCN(C)N=O Amb25231763 [1,1,0,0,0,0|2,0,0]=4 3154 B6R0.1 CCCN(C)OC Amb25250408 [1,1,0,0,0,0|2,0,0]=4 3155 B6R0.1 CCCN(N)C=O Amb18121867 [1,1,0,0,0,0|2,0,0]=4 3156 B6R0.1 CCCS(=O)NC Amb24645515 [1,1,0,0,0,0|2,0,0]=4 3157 B6R0.1 CCCS(=O)NN Amb24707685 [1,1,0,0,0,0|2,0,0]=4 3158 B6R0.1 CCC[14C](=O)O[Na] Amb22352104 [1,1,0,0,0,0|0,0,0]=2 3159 B6R0.1 CCC[C@@H](C)CO Amb22823174 [1,1,0,0,0,0|1,0,1]=4 3160 B6R0.1 CCC[C@@H](N)CO Amb22756532 [1,1,0,0,0,0|1,0,1]=4 3161 B6R0.1 CCC[C@@H](O)CCl Amb22736025 [1,1,0,0,0,0|1,0,1]=4 3162 B6R0.1 CCC[C@@H](O)CN Amb24428580 [1,1,0,0,0,0|1,0,1]=4 3163 B6R0.1 CCC[C@@H](O)CO Amb25215310 [1,1,0,0,0,0|0,0,2]=4 3164 B6R0.1 CCC[C@H](Br)CO Amb24478880 [1,1,0,0,0,0|1,0,1]=4 3165 B6R0.1 CCC[C@H](C)CBr Amb24478868 [1,1,0,0,0,0|1,0,1]=4 3166 B6R0.1 CCC[C@H](C)CI Amb24372792 [1,1,0,0,0,0|1,0,1]=4 3167 B6R0.1 CCC[C@H](Cl)C=O Amb24470180 [1,1,0,0,0,0|1,0,1]=4 3168 B6R0.1 CCC[C@H](Cl)CO Amb25858080 [1,1,0,0,0,0|1,0,1]=4 3169 B6R0.1 CCC[C@H](O)C=C Amb25133740 [1,1,0,0,0,0|1,0,1]=4 3170 B6R0.1 CCC[C@H](O)CCl Amb22735942 [1,1,0,0,0,0|1,0,1]=4 3171 B6R0.1 CCC[C@H](O)CO Amb22225461 [1,1,0,0,0,0|0,0,2]=4 3172 B6R0.1 CCC\C(\C)=C/Cl Amb25299421 [1,1,0,0,0,0|2,0,0]=4 3173 B6R0.1 CCC\C(\Cl)=C\Cl Amb24546444 [1,1,0,0,0,0|2,0,0]=4 3174 B6R0.1 CCC\C(\N)=N\N Amb17933232 [1,1,0,0,0,0|2,0,0]=4 3175 B6R0.1 CCC\C(\N)=N\O Amb19890174 [1,1,0,0,0,0|1,0,0]=3 3176 B6R0.1 CCNC(=N)CO Amb23514995 [1,1,0,0,0,0|2,0,0]=4 3177 B6R0.1 CCNC(=N)OC Amb25335141 [1,1,0,0,0,0|2,0,0]=4 3178 B6R0.1 CCNC(=O)C#C Amb24057137 [1,1,0,0,0,0|2,0,0]=4 3179 B6R0.1 CCNC(=O)CBr Amb2090261 [1,1,0,0,0,0|2,0,0]=4 3180 B6R0.1 CCNC(=O)CCl Amb1643925 [1,1,0,0,0,0|2,0,0]=4 3181 B6R0.1 CCNC(=O)CI Amb23512617 [1,1,0,0,0,0|2,0,0]=4 3182 B6R0.1 CCNC(=O)CN Amb21956656 [1,1,0,0,0,0|2,0,0]=4 3183 B6R0.1 CCNC(=O)N=O Amb25745700 [1,1,0,0,0,0|1,0,1]=4 3184 B6R0.1 CCNC(=O)OC Amb22734099 [1,1,0,0,0,0|1,0,0]=3 3185 B6R0.1 CCNC(=O)ON Amb25108031 [1,1,0,0,0,0|1,0,0]=3 3186 B6R0.1 CCNC(N)=NO Amb24389708 [1,1,0,0,0,0|2,0,0]=4 3187 B6R0.1 CCOC(=C)C=O Amb18639586 [1,1,0,0,0,0|2,0,0]=4 3188 B6R0.1 CCOC(=C)CO Amb23585492 [1,1,0,0,0,0|2,0,0]=4 3189 B6R0.1 CCOC(=N)CO Amb17593094 [1,1,0,0,0,0|2,0,0]=4 3190 B6R0.1 CCOC(=O)C#C Amb2182884 [1,1,0,0,0,0|2,0,0]=4 3191 B6R0.1 CCOC(=O)C=C Amb22338016 [1,1,0,0,0,0|2,0,0]=4 3192 B6R0.1 CCOC(=O)CN Amb20246808 [1,1,0,0,0,0|2,0,0]=4 3193 B6R0.1 CCOC(=O)C[NH3+] Amb24113741 [1,1,0,0,0,0|2,0,0]=4 3194 B6R0.1 CCOC(=O)NCl Amb24381604 [1,1,0,0,0,0|2,0,0]=4 3195 B6R0.1 CCOC(=O)[13CH2]Br Amb22337807 [1,1,0,0,0,0|2,0,0]=4 3196 B6R0.1 CCOC(=O)[13CH2]N Amb22055360 [1,1,0,0,0,0|2,0,0]=4 3197 B6R0.1 CCOC(=S)C=O Amb25746370 [1,1,0,0,0,0|1,1,0]=4 3198 B6R0.1 CCOC(=S)CO Amb25720817 [1,1,0,0,0,0|1,1,0]=4 3199 B6R0.1 CCOC(O)C=O Amb25207812 [1,1,0,0,0,0|1,0,1]=4 3200 B6R0.1 CCOP(=O)CO Amb25219603 [1,1,0,0,0,0|2,0,0]=4 3201 B6R0.1 CCO[13C](=O)CBr Amb22363272 [1,1,0,0,0,0|2,0,0]=4 3202 B6R0.1 CCO[13C](=O)[13CH2]Br Amb22351963 [1,1,0,0,0,0|2,0,0]=4 3203 B6R0.1 CCO[13C](=O)[13CH2]Cl Amb17613989 [1,1,0,0,0,0|2,0,0]=4 3204 B6R0.1 CCO[13C](=O)[13CH2]N Amb17614823 [1,1,0,0,0,0|2,0,0]=4 3205 B6R0.1 CCO\C(\N)=N\O Amb25378748 [1,1,0,0,0,0|2,0,0]=4 3206 B6R0.1 CCSC(=O)CBr Amb25227484 [1,1,0,0,0,0|2,0,0]=4 3207 B6R0.1 CCSC(=O)CCl Amb24530234 [1,1,0,0,0,0|2,0,0]=4 3208 B6R0.1 CCSC(=O)CN Amb24479789 [1,1,0,0,0,0|2,0,0]=4 3209 B6R0.1 CCSC(=O)NN Amb25074866 [1,1,0,0,0,0|2,0,0]=4 3210 B6R0.1 CC[C@@H](C)CCBr Amb25362204 [1,1,0,0,0,0|1,0,1]=4 3211 B6R0.1 CC[C@@H](C)CCI Amb24531332 [1,1,0,0,0,0|1,0,1]=4 3212 B6R0.1 CC[C@@H](C)CCN Amb25173553 [1,1,0,0,0,0|1,0,1]=4 3213 B6R0.1 CC[C@@H](C)CCO Amb22800733 [1,1,0,0,0,0|0,0,1]=3 3214 B6R0.1 CC[C@@H](C)N=C=O Amb24724238 [1,1,0,0,0,0|1,0,1]=4 3215 B6R0.1 CC[C@@H](N)CC=C Amb22831805 [1,1,0,0,0,0|2,0,0]=4 3216 B6R0.1 CC[C@@H](N)CCO Amb24479845 [1,1,0,0,0,0|1,0,1]=4 3217 B6R0.1 CC[C@@H](O)CC=C Amb22898757 [1,1,0,0,0,0|2,0,0]=4 3218 B6R0.1 CC[C@H](C)CC=O Amb25805988 [1,1,0,0,0,0|0,0,0]=2 3219 B6R0.1 CC[C@H](C)CCN Amb24640834 [1,1,0,0,0,0|1,0,1]=4 3220 B6R0.1 CC[C@H](C)CCO Amb24333653 [1,1,0,0,0,0|0,0,1]=3 3221 B6R0.1 CC[C@H](C)NC=O Amb25261503 [1,1,0,0,0,0|1,0,0]=3 3222 B6R0.1 CC[C@H](N)CCO Amb24738993 [1,1,0,0,0,0|1,0,1]=4 3223 B6R0.1 CC[C@H](O)CC=C Amb25832194 [1,1,0,0,0,0|2,0,0]=4 3224 B6R0.1 CC[C@H](O)CCC Amb25781736 [1,1,0,0,0,0|1,0,1]=4 3225 B6R0.1 CC\C=C(/Br)\C=O Amb25278288 [1,1,0,0,0,0|1,0,1]=4 3226 B6R0.1 CC\C=C(/C)\CO Amb22347713 [1,1,0,0,0,0|1,0,1]=4 3227 B6R0.1 CC\C=C(/F)\C=O Amb25122538 [1,1,0,0,0,0|1,0,1]=4 3228 B6R0.1 CC\C=C(\Br)/C=O Amb18645748 [1,1,0,0,0,0|1,0,1]=4 3229 B6R0.1 CC\C=C(\C)/CO Amb24677771 [1,1,0,0,0,0|1,0,1]=4 3230 B6R0.1 CC\C=C(\Cl)/C=O Amb18640561 [1,1,0,0,0,0|1,0,1]=4 3231 B6R0.1 CC\C=C(\F)/CO Amb25692315 [1,1,0,0,0,0|1,0,1]=4 3232 B6R0.1 CN(CCO)CO Amb24691618 [1,1,0,0,0,0|1,0,1]=4 3233 B6R0.1 CNC(=O)CCBr Amb17332890 [1,1,0,0,0,0|2,0,0]=4 3234 B6R0.1 CNC(=O)CCCl Amb1130566 [1,1,0,0,0,0|2,0,0]=4 3235 B6R0.1 CNC(=O)CCI Amb25205915 [1,1,0,0,0,0|2,0,0]=4 3236 B6R0.1 CNC(=O)CCN Amb1139824 [1,1,0,0,0,0|2,0,0]=4 3237 B6R0.1 CNC(=O)CCO Amb10608414 [1,1,0,0,0,0|2,0,0]=4 3238 B6R0.1 CNC(=O)CCS Amb25727705 [1,1,0,0,0,0|2,0,0]=4 3239 B6R0.1 CNC(=O)COC Amb22275885 [1,1,0,0,0,0|2,0,0]=4 3240 B6R0.1 CNC(=O)NCC Amb24120627 [1,1,0,0,0,0|2,0,0]=4 3241 B6R0.1 CNC(C)CC#C Amb18959778 [1,1,0,0,0,0|1,0,1]=4 3242 B6R0.1 CNC(C)CC#N Amb18540665 [1,1,0,0,0,0|1,0,1]=4 3243 B6R0.1 CNC(C)CC=C Amb18292023 [1,1,0,0,0,0|1,0,0]=3 3244 B6R0.1 CNC(C)CCBr Amb25076974 [1,1,0,0,0,0|1,0,1]=4 3245 B6R0.1 CNC(C)CCCl Amb22492693 [1,1,0,0,0,0|1,0,1]=4 3246 B6R0.1 CNC(C)CCN Amb20090507 [1,1,0,0,0,0|1,0,1]=4 3247 B6R0.1 CNC(C)CCS Amb24627618 [1,1,0,0,0,0|0,1,1]=4 3248 B6R0.1 CNC(C)CNC Amb18993072 [1,1,0,0,0,0|2,0,0]=4 3249 B6R0.1 CNC(C)CNN Amb18640278 [1,1,0,0,0,0|2,0,0]=4 3250 B6R0.1 CNC(C)CSC Amb18300373 [1,1,0,0,0,0|2,0,0]=4 3251 B6R0.1 CNC(C)NC=O Amb24479143 [1,1,0,0,0,0|1,0,0]=3 3252 B6R0.1 CNCC(=O)C#C Amb25675071 [1,1,0,0,0,0|2,0,0]=4 3253 B6R0.1 CNCC(=O)CN Amb25218252 [1,1,0,0,0,0|2,0,0]=4 3254 B6R0.1 CNCC(=O)NC Amb2371052 [1,1,0,0,0,0|2,0,0]=4 3255 B6R0.1 CNCC(=O)NN Amb16186920 [1,1,0,0,0,0|2,0,0]=4 3256 B6R0.1 CNCC(=O)NO Amb24640961 [1,1,0,0,0,0|1,0,0]=3 3257 B6R0.1 CNCC(=O)OC Amb1153975 [1,1,0,0,0,0|1,0,0]=3 3258 B6R0.1 CNCC(=O)OC Amb2371116 [1,1,0,0,0,0|1,0,0]=3 3259 B6R0.1 CNCC(C)CN Amb18300042 [1,1,0,0,0,0|2,0,0]=4 3260 B6R0.1 CNCC(C)CS Amb25853223 [1,1,0,0,0,0|2,0,0]=4 3261 B6R0.1 CNCC(C)OC Amb19959922 [1,1,0,0,0,0|2,0,0]=4 3262 B6R0.1 CNCC(C)SC Amb18299459 [1,1,0,0,0,0|2,0,0]=4 3263 B6R0.1 CNCC(N)=NO Amb24648670 [1,1,0,0,0,0|2,0,0]=4 3264 B6R0.1 CNC[C@H](C)CO Amb25663141 [1,1,0,0,0,0|2,0,0]=4 3265 B6R0.1 CNN(C)CCO Amb25167370 [1,1,0,0,0,0|1,0,1]=4 3266 B6R0.1 CNNC(=O)OC Amb22411352 [1,1,0,0,0,0|2,0,0]=4 3267 B6R0.1 CN[C@H](C)CNC Amb25091130 [1,1,0,0,0,0|2,0,0]=4 3268 B6R0.1 COC(=C)CCO Amb25024469 [1,1,0,0,0,0|2,0,0]=4 3269 B6R0.1 COC(=N)CCCl Amb19958799 [1,1,0,0,0,0|2,0,0]=4 3270 B6R0.1 COC(=N)CCCl Amb22234673 [1,1,0,0,0,0|2,0,0]=4 3271 B6R0.1 COC(=N)CCO Amb17593095 [1,1,0,0,0,0|2,0,0]=4 3272 B6R0.1 COC(=O)CC=O Amb18199826 [1,1,0,0,0,0|1,0,1]=4 3273 B6R0.1 COC(=O)CCF Amb22748635 [1,1,0,0,0,0|1,0,0]=3 3274 B6R0.1 COC(=O)CCI Amb24442243 [1,1,0,0,0,0|1,0,0]=3 3275 B6R0.1 COC(=O)CCN Amb1105940 [1,1,0,0,0,0|1,0,0]=3 3276 B6R0.1 COC(=O)CCN Amb22489470 [1,1,0,0,0,0|1,0,0]=3 3277 B6R0.1 COC(=O)CON Amb18640433 [1,1,0,0,0,0|2,0,0]=4 3278 B6R0.1 COC(=O)NCCl Amb24479773 [1,1,0,0,0,0|2,0,0]=4 3279 B6R0.1 COC(=O)NOC Amb24480502 [1,1,0,0,0,0|2,0,0]=4 3280 B6R0.1 COC(=O)OCC Amb22732530 [1,1,0,0,0,0|1,0,0]=3 3281 B6R0.1 COC(=O)OCCl Amb20623618 [1,1,0,0,0,0|2,0,0]=4 3282 B6R0.1 COC(=S)CCCl Amb25758715 [1,1,0,0,0,0|1,1,0]=4 3283 B6R0.1 COC(=S)CCS Amb10795255 [1,1,0,0,0,0|1,1,0]=4 3284 B6R0.1 COC(C)=CC=O Amb25328678 [1,1,0,0,0,0|0,0,2]=4 3285 B6R0.1 COC(C)CC#N Amb20622879 [1,1,0,0,0,0|1,0,1]=4 3286 B6R0.1 COC(C)CCBr Amb22227890 [1,1,0,0,0,0|1,0,1]=4 3287 B6R0.1 COC(C)CCCl Amb24359538 [1,1,0,0,0,0|1,0,1]=4 3288 B6R0.1 COC(C)CCN Amb21961545 [1,1,0,0,0,0|1,0,1]=4 3289 B6R0.1 COC(C)CON Amb18640476 [1,1,0,0,0,0|2,0,0]=4 3290 B6R0.1 COC(C)CSC Amb25043640 [1,1,0,0,0,0|2,0,0]=4 3291 B6R0.1 COC(C)N=C=O Amb24593600 [1,1,0,0,0,0|1,0,1]=4 3292 B6R0.1 COC(C)NC=O Amb24392931 [1,1,0,0,0,0|1,0,0]=3 3293 B6R0.1 COCC(=C)CO Amb24523815 [1,1,0,0,0,0|2,0,0]=4 3294 B6R0.1 COCC(=N)NO Amb21858420 [1,1,0,0,0,0|2,0,0]=4 3295 B6R0.1 COCC(=O)C#N Amb25744731 [1,1,0,0,0,0|2,0,0]=4 3296 B6R0.1 COCC(=O)C=C Amb22168158 [1,1,0,0,0,0|2,0,0]=4 3297 B6R0.1 COCC(=O)CCl Amb24523799 [1,1,0,0,0,0|2,0,0]=4 3298 B6R0.1 COCC(=O)CN Amb18833134 [1,1,0,0,0,0|2,0,0]=4 3299 B6R0.1 COCC(=O)CO Amb24364722 [1,1,0,0,0,0|1,0,0]=3 3300 B6R0.1 COCC(=O)O[Na] Amb2227682 [1,1,0,0,0,0|1,0,0]=3 3301 B6R0.1 COCC(C)=NO Amb24530685 [1,1,0,0,0,0|2,0,0]=4 3302 B6R0.1 COCC(C)CBr Amb24332722 [1,1,0,0,0,0|2,0,0]=4 3303 B6R0.1 COCC(C)CCl Amb24393321 [1,1,0,0,0,0|2,0,0]=4 3304 B6R0.1 COCC(C)SC Amb24507664 [1,1,0,0,0,0|2,0,0]=4 3305 B6R0.1 COCC(N)=S=O Amb25843320 [1,1,0,0,0,0|2,0,0]=4 3306 B6R0.1 COCC(NC)C Amb10609106 [1,1,0,0,0,0|2,0,0]=4 3307 B6R0.1 COCC(O)C=O Amb18122318 [1,1,0,0,0,0|1,0,1]=4 3308 B6R0.1 COC[C@@H](C)CO Amb22745568 [1,1,0,0,0,0|2,0,0]=4 3309 B6R0.1 COC[C@H](C)CO Amb17872438 [1,1,0,0,0,0|2,0,0]=4 3310 B6R0.1 CON(C)CC=C Amb24333772 [1,1,0,0,0,0|2,0,0]=4 3311 B6R0.1 COS(=O)CCCl Amb24635086 [1,1,0,0,0,0|2,0,0]=4 3312 B6R0.1 COS(=O)CCO Amb25713675 [1,1,0,0,0,0|2,0,0]=4 3313 B6R0.1 COS(=O)OCC Amb22729134 [1,1,0,0,0,0|2,0,0]=4 3314 B6R0.1 CO[13C](=O)[13CH2][15NH][13CH3] Amb22336903 [1,1,0,0,0,0|1,0,0]=3 3315 B6R0.1 CO[C@H](C)CCBr Amb24470089 [1,1,0,0,0,0|1,0,1]=4 3316 B6R0.1 CO\C(\C)=C/C=O Amb25326199 [1,1,0,0,0,0|0,0,2]=4 3317 B6R0.1 CO\C(\C)=C\C=O Amb18121410 [1,1,0,0,0,0|0,0,2]=4 3318 B6R0.1 CSC(=O)CCCl Amb24735675 [1,1,0,0,0,0|1,1,0]=4 3319 B6R0.1 CSC(C)CC=C Amb25662675 [1,1,0,0,0,0|1,0,0]=3 3320 B6R0.1 CSC(C)CCBr Amb24693201 [1,1,0,0,0,0|1,0,1]=4 3321 B6R0.1 CSC(C)CCCl Amb25169533 [1,1,0,0,0,0|1,0,1]=4 3322 B6R0.1 CSCC(=O)NN Amb22058723 [1,1,0,0,0,0|2,0,0]=4 3323 B6R0.1 CSCC(C)=NO Amb25316343 [1,1,0,0,0,0|2,0,0]=4 3324 B6R0.1 CSCC(C)CN Amb18970333 [1,1,0,0,0,0|2,0,0]=4 3325 B6R0.1 CSCC(C)CS Amb24350656 [1,1,0,0,0,0|2,0,0]=4 3326 B6R0.1 CS[C@H](C)CCO Amb24581736 [1,1,0,0,0,0|0,0,1]=3 3327 B6R0.1 C[C@@H](CBr)CC=C Amb24739638 [1,1,0,0,0,0|1,0,0]=3 3328 B6R0.1 C[C@@H](CBr)CCO Amb24478942 [1,1,0,0,0,0|0,0,1]=3 3329 B6R0.1 C[C@@H](CC=O)C=C Amb25746367 [1,1,0,0,0,0|0,0,1]=3 3330 B6R0.1 C[C@@H](CCO)C=C Amb24334509 [1,1,0,0,0,0|0,0,2]=4 3331 B6R0.1 C[C@@H](CCO)CO Amb19944691 [1,1,0,0,0,0|0,0,1]=3 3332 B6R0.1 C[C@@H](CCl)CCO Amb24671318 [1,1,0,0,0,0|0,0,1]=3 3333 B6R0.1 C[C@@H](CI)CC=C Amb25242572 [1,1,0,0,0,0|1,0,0]=3 3334 B6R0.1 C[C@@H](CN)CC=C Amb25836360 [1,1,0,0,0,0|1,0,0]=3 3335 B6R0.1 C[C@@H](CO)CC#C Amb25042877 [1,1,0,0,0,0|1,0,1]=4 3336 B6R0.1 C[C@@H](CO)CC=C Amb25167493 [1,1,0,0,0,0|1,0,0]=3 3337 B6R0.1 C[C@@H](CO)CCN Amb22801706 [1,1,0,0,0,0|1,0,1]=4 3338 B6R0.1 C[C@@H](CO)NC=O Amb25372235 [1,1,0,0,0,0|1,0,0]=3 3339 B6R0.1 C[C@H](CBr)CC#N Amb24577421 [1,1,0,0,0,0|1,0,1]=4 3340 B6R0.1 C[C@H](CBr)CCO Amb24740770 [1,1,0,0,0,0|0,0,1]=3 3341 B6R0.1 C[C@H](CBr)N=C=O Amb24478553 [1,1,0,0,0,0|1,0,1]=4 3342 B6R0.1 C[C@H](CCO)CO Amb22225176 [1,1,0,0,0,0|0,0,1]=3 3343 B6R0.1 C[C@H](CO)CC#N Amb25662541 [1,1,0,0,0,0|1,0,1]=4 3344 B6R0.1 C[C@H](CO)CC=C Amb25026058 [1,1,0,0,0,0|1,0,0]=3 3345 B6R0.1 C[C@H](CO)CCCl Amb25848484 [1,1,0,0,0,0|1,0,1]=4 3346 B6R0.1 C[C@H](CO)CCN Amb25663130 [1,1,0,0,0,0|1,0,1]=4 3347 B6R0.1 C[NH2+]CC(=O)OC Amb22045201 [1,1,0,0,0,0|1,0,0]=3 3348 B6R0.1 C[NH2+]CC(=O)OC Amb24113851 [1,1,0,0,0,0|1,0,0]=3 3349 B6R0.1 C\C(\C=O)=C\CC Amb18120867 [1,1,0,0,0,0|1,0,1]=4 3350 B6R0.1 C\C(\CBr)=C\C=O Amb18645750 [1,1,0,0,0,0|0,0,2]=4 3351 B6R0.1 C\C(\CC)=C\C=O Amb18120877 [1,1,0,0,0,0|0,0,2]=4 3352 B6R0.1 C\C(\CCC)=C/C Amb22734722 [1,1,0,0,0,0|2,0,0]=4 3353 B6R0.1 C\C(\CCl)=C\C=O Amb25326191 [1,1,0,0,0,0|0,0,2]=4 3354 B6R0.1 C\C(\CO)=C/C=O Amb24417925 [1,1,0,0,0,0|0,0,2]=4 3355 B6R0.1 C\C=C(/C)\CC=C Amb24479822 [1,1,0,0,0,0|1,0,1]=4 3356 B6R0.1 C\C=C(/C)\CC=O Amb18120886 [1,1,0,0,0,0|0,0,1]=3 3357 B6R0.1 C\C=C(/C)\CCO Amb24674649 [1,1,0,0,0,0|0,0,2]=4 3358 B6R0.1 C\C=C(\C)/CC=C Amb24099383 [1,1,0,0,0,0|1,0,1]=4 3359 B6R0.1 C\C=C/C(=O)CO Amb24530239 [1,1,0,0,0,0|0,0,2]=4 3360 B6R0.1 C\C=C\C(=O)CO Amb24633379 [1,1,0,0,0,0|0,0,2]=4 3361 B6R0.1 C\C=C\C(=O)NO Amb25076258 [1,1,0,0,0,0|0,0,2]=4 3362 B6R0.1 C\C=C\C(C)CC Amb22232014 [1,1,0,0,0,0|1,0,1]=4 3363 B6R0.1 C\C=C\C(C)CN Amb24479862 [1,1,0,0,0,0|1,0,1]=4 3364 B6R0.1 C\C=C\C(C)NC Amb18639480 [1,1,0,0,0,0|1,0,1]=4 3365 B6R0.1 C\C=C\[C@H](C)CO Amb25381306 [1,1,0,0,0,0|1,0,1]=4 3366 B6R0.1 N#CC(=O)CCO Amb25730943 [1,1,0,0,0,0|2,0,0]=4 3367 B6R0.1 N=C(CCO)NO Amb22491265 [1,1,0,0,0,0|2,0,0]=4 3368 B6R0.1 NC(CCF)=NO Amb24540455 [1,1,0,0,0,0|2,0,0]=4 3369 B6R0.1 NC(CS)CCO Amb25083064 [1,1,0,0,0,0|1,0,1]=4 3370 B6R0.1 NCC(=O)CCN Amb18121893 [1,1,0,0,0,0|2,0,0]=4 3371 B6R0.1 NCC(=O)CCN Amb22227739 [1,1,0,0,0,0|2,0,0]=4 3372 B6R0.1 NCC(=O)CCN Amb22360700 [1,1,0,0,0,0|2,0,0]=4 3373 B6R0.1 NCC(N)CCO Amb19514523 [1,1,0,0,0,0|1,0,1]=4 3374 B6R0.1 NCC(O)CCO Amb22011571 [1,1,0,0,0,0|1,0,1]=4 3375 B6R0.1 NCCC(=O)CBr Amb24479170 [1,1,0,0,0,0|2,0,0]=4 3376 B6R0.1 NCCC(=O)NN Amb18559344 [1,1,0,0,0,0|2,0,0]=4 3377 B6R0.1 NCCC(=O)NO Amb22751684 [1,1,0,0,0,0|1,0,0]=3 3378 B6R0.1 NCCC(CC)C Amb10607691 [1,1,0,0,0,0|1,0,1]=4 3379 B6R0.1 NCCC(CO)C Amb17506270 [1,1,0,0,0,0|1,0,1]=4 3380 B6R0.1 NCCC(N)=NO Amb24761482 [1,1,0,0,0,0|2,0,0]=4 3381 B6R0.1 NCCC(O)C=O Amb25682881 [1,1,0,0,0,0|1,0,1]=4 3382 B6R0.1 NC[C@@H](N)CCO Amb19514529 [1,1,0,0,0,0|1,0,1]=4 3383 B6R0.1 NC[C@H](N)CCO Amb25115256 [1,1,0,0,0,0|1,0,1]=4 3384 B6R0.1 NNC(=O)CCO Amb20622339 [1,1,0,0,0,0|2,0,0]=4 3385 B6R0.1 NNC(=O)CCS Amb20622690 [1,1,0,0,0,0|2,0,0]=4 3386 B6R0.1 N[C@H](CS)CCO Amb25691951 [1,1,0,0,0,0|1,0,1]=4 3387 B6R0.1 O=C(CCCl)CCl Amb22395038 [1,1,0,0,0,0|2,0,0]=4 3388 B6R0.1 O=C(CCCl)NBr Amb24391501 [1,1,0,0,0,0|2,0,0]=4 3389 B6R0.1 O=C(CCCl)NCl Amb24427328 [1,1,0,0,0,0|2,0,0]=4 3390 B6R0.1 O=CC(S)CC=O Amb25768520 [1,1,0,0,0,0|1,0,1]=4 3391 B6R0.1 O=CCC(Br)CBr Amb24671080 [1,1,0,0,0,0|1,0,0]=3 3392 B6R0.1 OCC(=O)CCO Amb24061314 [1,1,0,0,0,0|1,0,0]=3 3393 B6R0.1 OCC(=O)CCS Amb24332279 [1,1,0,0,0,0|1,0,0]=3 3394 B6R0.1 OCC(Cl)CCO Amb24441411 [1,1,0,0,0,0|1,0,1]=4 3395 B6R0.1 OCC(O)CC=O Amb25243032 [1,1,0,0,0,0|1,0,0]=3 3396 B6R0.1 OCC(O)CNO Amb25026456 [1,1,0,0,0,0|2,0,0]=4 3397 B6R0.1 OCCC(=NO)N Amb13952693 [1,1,0,0,0,0|2,0,0]=4 3398 B6R0.1 OCCC(=O)CBr Amb25210851 [1,1,0,0,0,0|2,0,0]=4 3399 B6R0.1 OCCC(=O)CCl Amb24674169 [1,1,0,0,0,0|2,0,0]=4 3400 B6R0.1 OCCC(=O)CO Amb10603377 [1,1,0,0,0,0|1,0,0]=3 3401 B6R0.1 OCCC(CN)C Amb17506271 [1,1,0,0,0,0|0,0,1]=3 3402 B6R0.1 OCCC(Cl)CCl Amb25147506 [1,1,0,0,0,0|1,0,1]=4 3403 B6R0.1 OCCC(O)CCl Amb25361069 [1,1,0,0,0,0|1,0,1]=4 3404 B6R0.1 OCC[C@@H](O)C=O Amb24741761 [1,1,0,0,0,0|1,0,1]=4 3405 B6R0.1 OCC[C@H](CO)O Amb10071064 [1,1,0,0,0,0|1,0,1]=4 3406 B6R0.1 OCC[C@H](O)CCl Amb25714009 [1,1,0,0,0,0|1,0,1]=4 3407 B6R0.1 OCC\C(=N\O)\N Amb1113605 [1,1,0,0,0,0|2,0,0]=4 3408 B6R0.1 OC[C@H](Br)CCO Amb25697346 [1,1,0,0,0,0|1,0,1]=4 3409 B6R0.1 OC[C@H](O)CC=O Amb24595645 [1,1,0,0,0,0|1,0,0]=3 3410 B6R0.1 O[C@@H](CC=O)C=O Amb25169555 [1,1,0,0,0,0|1,0,1]=4 3411 B6R0.1 O[C@@H](CCl)CC=O Amb25824190 [1,1,0,0,0,0|1,0,0]=3 3412 B6R0.1 O[C@H](CC=O)C=O Amb25373324 [1,1,0,0,0,0|1,0,1]=4 3413 B6R0.3 C#CC(O)C(O)=O Amb22731622 [1,1,0,0,0,0|0,0,2]=4 3414 B6R0.3 C#C[C@H](N)C(O)=O Amb22350666 [1,1,0,0,0,0|0,0,2]=4 3415 B6R0.3 C=C(CF)C(O)=O Amb25215375 [1,1,0,0,0,0|1,0,1]=4 3416 B6R0.3 C=C(CI)C(O)=O Amb24419641 [1,1,0,0,0,0|1,0,1]=4 3417 B6R0.3 C=C(CN)C(O)=O Amb25200864 [1,1,0,0,0,0|1,0,1]=4 3418 B6R0.3 C=C(CO)C(O)=O Amb18121817 [1,1,0,0,0,0|1,0,1]=4 3419 B6R0.3 C=CC(Br)C(O)=O Amb24453871 [1,1,0,0,0,0|0,0,2]=4 3420 B6R0.3 C=CC(N)C(O)=O Amb20240543 [1,1,0,0,0,0|0,0,2]=4 3421 B6R0.3 C=CC(O)C(O)=O Amb24061247 [1,1,0,0,0,0|0,0,2]=4 3422 B6R0.3 C=C[C@@H](N)C(O)=O Amb20241335 [1,1,0,0,0,0|0,0,2]=4 3423 B6R0.3 C=C[C@@H](N)C(O)=O Amb22756048 [1,1,0,0,0,0|0,0,2]=4 3424 B6R0.3 C=C[C@@H](O)C(O)=O Amb25146844 [1,1,0,0,0,0|0,0,2]=4 3425 B6R0.3 C=C[C@H](O)C(O)=O Amb25118468 [1,1,0,0,0,0|0,0,2]=4 3426 B6R0.3 CC(=C)C(O)C=O Amb24457056 [1,1,0,0,0,0|0,0,2]=4 3427 B6R0.3 CC(=O)C(Br)CO Amb24649743 [1,1,0,0,0,0|2,0,0]=4 3428 B6R0.3 CC(=O)C(Cl)CF Amb24594938 [1,1,0,0,0,0|2,0,0]=4 3429 B6R0.3 CC(=O)C(Cl)CO Amb25321596 [1,1,0,0,0,0|2,0,0]=4 3430 B6R0.3 CC(=O)C(F)CO Amb24725289 [1,1,0,0,0,0|2,0,0]=4 3431 B6R0.3 CC(=O)C(N)CN Amb24479898 [1,1,0,0,0,0|2,0,0]=4 3432 B6R0.3 CC(=O)C(N)CO Amb18640011 [1,1,0,0,0,0|2,0,0]=4 3433 B6R0.3 CC(=O)C(N)CS Amb24479874 [1,1,0,0,0,0|2,0,0]=4 3434 B6R0.3 CC(=O)C(O)C=O Amb24715304 [1,1,0,0,0,0|1,0,1]=4 3435 B6R0.3 CC(=O)C(O)CN Amb24636554 [1,1,0,0,0,0|2,0,0]=4 3436 B6R0.3 CC(=O)C([Na])C=O Amb25858759 [1,1,0,0,0,0|1,0,1]=4 3437 B6R0.3 CC(=O)[C@@H](N)CO Amb22745043 [1,1,0,0,0,0|2,0,0]=4 3438 B6R0.3 CC(=O)[C@@H](O)CCl Amb24401543 [1,1,0,0,0,0|2,0,0]=4 3439 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [1,1,0,0,0,0|2,0,0]=4 3440 B6R0.3 CC(=O)[C@H](O)CCl Amb25169511 [1,1,0,0,0,0|2,0,0]=4 3441 B6R0.3 CC(=O)[C@H](O)CO Amb25838797 [1,1,0,0,0,0|2,0,0]=4 3442 B6R0.3 CC(Br)C(=O)C=O Amb24478903 [1,1,0,0,0,0|1,0,1]=4 3443 B6R0.3 CC(Br)C(Cl)C=C Amb24736705 [1,1,0,0,0,0|2,0,0]=4 3444 B6R0.3 CC(Br)C(Cl)C=O Amb25828586 [1,1,0,0,0,0|1,0,0]=3 3445 B6R0.3 CC(Br)C(S)CO Amb24479553 [1,1,0,0,0,0|1,0,1]=4 3446 B6R0.3 CC(C#C)C(O)=O Amb25085390 [1,1,0,0,0,0|0,0,2]=4 3447 B6R0.3 CC(C(=O)C)CO Amb10844844 [1,1,0,0,0,0|2,0,0]=4 3448 B6R0.3 CC(C(=O)O)C#N Amb17210512 [1,1,0,0,0,0|1,0,1]=4 3449 B6R0.3 CC(C)=C(Br)C=O Amb18645747 [1,1,0,0,0,0|0,0,2]=4 3450 B6R0.3 CC(C)=C(C)C=O Amb18639155 [1,1,0,0,0,0|0,0,2]=4 3451 B6R0.3 CC(C)=C(Cl)C=O Amb18640665 [1,1,0,0,0,0|0,0,2]=4 3452 B6R0.3 CC(C)C(=C)C=O Amb18639179 [1,1,0,0,0,0|0,0,1]=3 3453 B6R0.3 CC(C)C(=O)C=C Amb24507596 [1,1,0,0,0,0|1,0,1]=4 3454 B6R0.3 CC(C)C(=O)CO Amb18061654 [1,1,0,0,0,0|0,0,2]=4 3455 B6R0.3 CC(C)C(Br)C#C Amb25774453 [1,1,0,0,0,0|1,0,1]=4 3456 B6R0.3 CC(C)C(Br)C#N Amb18645566 [1,1,0,0,0,0|1,0,1]=4 3457 B6R0.3 CC(C)C(Br)CBr Amb22729124 [1,1,0,0,0,0|1,0,1]=4 3458 B6R0.3 CC(C)C(Br)CC Amb18180084 [1,1,0,0,0,0|1,0,1]=4 3459 B6R0.3 CC(C)C(Br)CF Amb24501654 [1,1,0,0,0,0|1,0,1]=4 3460 B6R0.3 CC(C)C(Br)CN Amb24478564 [1,1,0,0,0,0|1,0,1]=4 3461 B6R0.3 CC(C)C(C)=CBr Amb24333014 [1,1,0,0,0,0|1,0,1]=4 3462 B6R0.3 CC(C)C(C)=NO Amb24529673 [1,1,0,0,0,0|1,0,1]=4 3463 B6R0.3 CC(C)C(C)C#C Amb25120094 [1,1,0,0,0,0|1,0,1]=4 3464 B6R0.3 CC(C)C(C)CBr Amb24479890 [1,1,0,0,0,0|1,0,1]=4 3465 B6R0.3 CC(C)C(C)CCl Amb24334315 [1,1,0,0,0,0|1,0,1]=4 3466 B6R0.3 CC(C)C(C)NO Amb25254785 [1,1,0,0,0,0|1,0,0]=3 3467 B6R0.3 CC(C)C(C)ON Amb24634580 [1,1,0,0,0,0|2,0,0]=4 3468 B6R0.3 CC(C)C(C)SC Amb25802954 [1,1,0,0,0,0|2,0,0]=4 3469 B6R0.3 CC(C)C(Cl)=NO Amb25345474 [1,1,0,0,0,0|1,0,1]=4 3470 B6R0.3 CC(C)C(Cl)C#N Amb24475461 [1,1,0,0,0,0|1,0,1]=4 3471 B6R0.3 CC(C)C(Cl)C=C Amb24565720 [1,1,0,0,0,0|1,0,0]=3 3472 B6R0.3 CC(C)C(Cl)C=O Amb18123761 [1,1,0,0,0,0|0,0,0]=2 3473 B6R0.3 CC(C)C(Cl)CBr Amb25241233 [1,1,0,0,0,0|1,0,1]=4 3474 B6R0.3 CC(C)C(Cl)CC Amb25341714 [1,1,0,0,0,0|1,0,1]=4 3475 B6R0.3 CC(C)C(F)C#N Amb25048377 [1,1,0,0,0,0|1,0,1]=4 3476 B6R0.3 CC(C)C(F)CBr Amb24634287 [1,1,0,0,0,0|1,0,1]=4 3477 B6R0.3 CC(C)C(I)C=O Amb25745826 [1,1,0,0,0,0|0,0,0]=2 3478 B6R0.3 CC(C)C(N)C#N Amb19514958 [1,1,0,0,0,0|1,0,1]=4 3479 B6R0.3 CC(C)C(N)C=C Amb23536604 [1,1,0,0,0,0|1,0,0]=3 3480 B6R0.3 CC(C)C(N)C=O Amb25063407 [1,1,0,0,0,0|0,0,0]=2 3481 B6R0.3 CC(C)C(N)CF Amb24620348 [1,1,0,0,0,0|1,0,1]=4 3482 B6R0.3 CC(C)C(N)CN Amb19283589 [1,1,0,0,0,0|1,0,1]=4 3483 B6R0.3 CC(C)C(N)NN Amb24386051 [1,1,0,0,0,0|2,0,0]=4 3484 B6R0.3 CC(C)C(O)C=C Amb22346222 [1,1,0,0,0,0|1,0,0]=3 3485 B6R0.3 CC(C)C(O)CBr Amb25065246 [1,1,0,0,0,0|1,0,1]=4 3486 B6R0.3 CC(C)C(O)CCl Amb25094018 [1,1,0,0,0,0|1,0,1]=4 3487 B6R0.3 CC(C)C(O)CF Amb25167444 [1,1,0,0,0,0|1,0,1]=4 3488 B6R0.3 CC(C)C(O)CN Amb19414467 [1,1,0,0,0,0|1,0,1]=4 3489 B6R0.3 CC(C)C(S)C=O Amb25827516 [1,1,0,0,0,0|0,0,0]=2 3490 B6R0.3 CC(C)C(S)CN Amb18251083 [1,1,0,0,0,0|1,0,1]=4 3491 B6R0.3 CC(C)C(S)CO Amb25809908 [1,1,0,0,0,0|0,0,1]=3 3492 B6R0.3 CC(C)N(C)C=O Amb24271077 [1,1,0,0,0,0|1,0,0]=3 3493 B6R0.3 CC(C)P(C)CO Amb24748478 [1,1,0,0,0,0|1,0,1]=4 3494 B6R0.3 CC(C)[C@@H](Br)CO Amb25109146 [1,1,0,0,0,0|0,0,1]=3 3495 B6R0.3 CC(C)[C@@H](C)CBr Amb24479756 [1,1,0,0,0,0|1,0,1]=4 3496 B6R0.3 CC(C)[C@@H](C)CCl Amb24402293 [1,1,0,0,0,0|1,0,1]=4 3497 B6R0.3 CC(C)[C@@H](C)CN Amb24445433 [1,1,0,0,0,0|1,0,1]=4 3498 B6R0.3 CC(C)[C@@H](Cl)C=O Amb25189961 [1,1,0,0,0,0|0,0,0]=2 3499 B6R0.3 CC(C)[C@@H](F)C=O Amb25358933 [1,1,0,0,0,0|0,0,0]=2 3500 B6R0.3 CC(C)[C@@H](I)C=O Amb24695477 [1,1,0,0,0,0|0,0,0]=2 3501 B6R0.3 CC(C)[C@@H](N)C=C Amb24425059 [1,1,0,0,0,0|1,0,0]=3 3502 B6R0.3 CC(C)[C@@H](N)CBr Amb24739073 [1,1,0,0,0,0|1,0,1]=4 3503 B6R0.3 CC(C)[C@@H](N)CO Amb22745159 [1,1,0,0,0,0|0,0,1]=3 3504 B6R0.3 CC(C)[C@@H](O)C=C Amb25682322 [1,1,0,0,0,0|1,0,0]=3 3505 B6R0.3 CC(C)[C@@H](O)CO Amb25662102 [1,1,0,0,0,0|0,0,1]=3 3506 B6R0.3 CC(C)[C@@H](O)CS Amb24735137 [1,1,0,0,0,0|0,1,1]=4 3507 B6R0.3 CC(C)[C@H](Br)C#N Amb25770062 [1,1,0,0,0,0|1,0,1]=4 3508 B6R0.3 CC(C)[C@H](Br)C=O Amb25360935 [1,1,0,0,0,0|0,0,0]=2 3509 B6R0.3 CC(C)[C@H](C)CO Amb24332267 [1,1,0,0,0,0|0,0,1]=3 3510 B6R0.3 CC(C)[C@H](C)NC Amb25786130 [1,1,0,0,0,0|2,0,0]=4 3511 B6R0.3 CC(C)[C@H](Cl)C=O Amb25053420 [1,1,0,0,0,0|0,0,0]=2 3512 B6R0.3 CC(C)[C@H](F)C=O Amb25169558 [1,1,0,0,0,0|0,0,0]=2 3513 B6R0.3 CC(C)[C@H](N)C#C Amb25190055 [1,1,0,0,0,0|1,0,1]=4 3514 B6R0.3 CC(C)[C@H](N)CC Amb24480517 [1,1,0,0,0,0|1,0,1]=4 3515 B6R0.3 CC(C)[C@H](N)CCl Amb24502642 [1,1,0,0,0,0|1,0,1]=4 3516 B6R0.3 CC(C)[C@H](O)C#N Amb25693361 [1,1,0,0,0,0|1,0,1]=4 3517 B6R0.3 CC(C)[C@H](O)C=O Amb25292428 [1,1,0,0,0,0|0,0,0]=2 3518 B6R0.3 CC(C)[C@H](O)CC Amb24641520 [1,1,0,0,0,0|1,0,1]=4 3519 B6R0.3 CC(C)[C@H](O)CO Amb25320597 [1,1,0,0,0,0|0,0,1]=3 3520 B6R0.3 CC(C)\C(\Cl)=C/Cl Amb25295512 [1,1,0,0,0,0|1,0,1]=4 3521 B6R0.3 CC(C=C)C(O)=O Amb21618706 [1,1,0,0,0,0|0,0,2]=4 3522 B6R0.3 CC(C=O)C(C)=C Amb18639176 [1,1,0,0,0,0|0,0,2]=4 3523 B6R0.3 CC(C=O)C(C)=O Amb18639572 [1,1,0,0,0,0|1,0,1]=4 3524 B6R0.3 CC(C=O)C(F)F Amb25746789 [1,1,0,0,0,0|2,0,0]=4 3525 B6R0.3 CC(C=O)N(C)C Amb25771612 [1,1,0,0,0,0|1,0,0]=3 3526 B6R0.3 CC(CBr)C(C)=O Amb25296678 [1,1,0,0,0,0|2,0,0]=4 3527 B6R0.3 CC(CBr)C(O)=O Amb22002601 [1,1,0,0,0,0|1,0,0]=3 3528 B6R0.3 CC(CC)C(O)Br Amb24635628 [1,1,0,0,0,0|1,0,1]=4 3529 B6R0.3 CC(CCl)C(=O)Cl Amb24479841 [1,1,0,0,0,0|2,0,0]=4 3530 B6R0.3 CC(CCl)C(=O)S Amb24410197 [1,1,0,0,0,0|1,1,0]=4 3531 B6R0.3 CC(CCl)C(N)=O Amb25061744 [1,1,0,0,0,0|2,0,0]=4 3532 B6R0.3 CC(CCl)C(O)=O Amb18522181 [1,1,0,0,0,0|1,0,0]=3 3533 B6R0.3 CC(CF)C(C)=O Amb25253758 [1,1,0,0,0,0|2,0,0]=4 3534 B6R0.3 CC(CF)C(O)=O Amb24432331 [1,1,0,0,0,0|1,0,0]=3 3535 B6R0.3 CC(CI)C(O)=O Amb25695307 [1,1,0,0,0,0|1,0,0]=3 3536 B6R0.3 CC(CN)C(=O)Cl Amb24525988 [1,1,0,0,0,0|2,0,0]=4 3537 B6R0.3 CC(CN)C(C)=O Amb18639690 [1,1,0,0,0,0|2,0,0]=4 3538 B6R0.3 CC(CO)C(C)Cl Amb24479460 [1,1,0,0,0,0|1,0,1]=4 3539 B6R0.3 CC(CO)C(C)I Amb24410940 [1,1,0,0,0,0|1,0,1]=4 3540 B6R0.3 CC(CO)C(C)N Amb18122199 [1,1,0,0,0,0|1,0,1]=4 3541 B6R0.3 CC(CO)C(C)S Amb22641872 [1,1,0,0,0,0|1,0,1]=4 3542 B6R0.3 CC(CO)C([O-])=O Amb24123145 [1,1,0,0,0,0|1,0,1]=4 3543 B6R0.3 CC(CS)C(C)=O Amb25830693 [1,1,0,0,0,0|2,0,0]=4 3544 B6R0.3 CC(CS)C(N)=O Amb25759660 [1,1,0,0,0,0|2,0,0]=4 3545 B6R0.3 CC(Cl)C(Br)C=O Amb25258050 [1,1,0,0,0,0|1,0,0]=3 3546 B6R0.3 CC(Cl)C(Cl)C=O Amb18643662 [1,1,0,0,0,0|1,0,0]=3 3547 B6R0.3 CC(Cl)C(S)CO Amb25102279 [1,1,0,0,0,0|1,0,1]=4 3548 B6R0.3 CC(F)C(Br)CO Amb25109242 [1,1,0,0,0,0|1,0,1]=4 3549 B6R0.3 CC(F)C(I)CO Amb25293778 [1,1,0,0,0,0|1,0,1]=4 3550 B6R0.3 CC(I)C(F)CO Amb25325094 [1,1,0,0,0,0|1,0,1]=4 3551 B6R0.3 CC(N)C(N)C=C Amb25731884 [1,1,0,0,0,0|2,0,0]=4 3552 B6R0.3 CC(N)C(O)CO Amb24583121 [1,1,0,0,0,0|1,0,1]=4 3553 B6R0.3 CC(N=C)C(O)=O Amb24591339 [1,1,0,0,0,0|1,0,1]=4 3554 B6R0.3 CC(NBr)C(O)=O Amb24677636 [1,1,0,0,0,0|2,0,0]=4 3555 B6R0.3 CC(NCl)C(O)=O Amb25267473 [1,1,0,0,0,0|2,0,0]=4 3556 B6R0.3 CC(NN)C(O)=O Amb18640367 [1,1,0,0,0,0|2,0,0]=4 3557 B6R0.3 CC(O)C(Br)C=O Amb25702152 [1,1,0,0,0,0|1,0,0]=3 3558 B6R0.3 CC(O)C(Cl)C=C Amb25723922 [1,1,0,0,0,0|2,0,0]=4 3559 B6R0.3 CC(O)C(Cl)CO Amb24633291 [1,1,0,0,0,0|1,0,1]=4 3560 B6R0.3 CC(O)C(N)C=C Amb25076566 [1,1,0,0,0,0|2,0,0]=4 3561 B6R0.3 CC(O)C(N)C=O Amb24480424 [1,1,0,0,0,0|1,0,0]=3 3562 B6R0.3 CC(O)C(O)C=O Amb18122303 [1,1,0,0,0,0|1,0,0]=3 3563 B6R0.3 CC(O)C(O)CO Amb22227692 [1,1,0,0,0,0|1,0,1]=4 3564 B6R0.3 CC(O)[C@@H](N)CC Amb24453251 [1,1,0,0,0,0|1,0,1]=4 3565 B6R0.3 CC(O)[C@@H](N)CO Amb22800884 [1,1,0,0,0,0|1,0,1]=4 3566 B6R0.3 CC(ON)C(O)=O Amb24479235 [1,1,0,0,0,0|2,0,0]=4 3567 B6R0.3 CCC(=C)C(=O)Cl Amb22353554 [1,1,0,0,0,0|1,0,1]=4 3568 B6R0.3 CCC(=C)C(N)=O Amb24480748 [1,1,0,0,0,0|1,0,1]=4 3569 B6R0.3 CCC(=C)C(O)=O Amb18639591 [1,1,0,0,0,0|0,0,1]=3 3570 B6R0.3 CCC(=O)C(N)=O Amb22011827 [1,1,0,0,0,0|1,0,1]=4 3571 B6R0.3 CCC(=O)C(O)=O Amb22274199 [1,1,0,0,0,0|0,0,1]=3 3572 B6R0.3 CCC(=O)C([O-])=O Amb22360646 [1,1,0,0,0,0|0,0,2]=4 3573 B6R0.3 CCC(B(O)O)C Amb10071974 [1,1,0,0,0,0|1,0,1]=4 3574 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [1,1,0,0,0,0|1,0,0]=3 3575 B6R0.3 CCC(Br)C(C)=O Amb24615269 [1,1,0,0,0,0|1,0,0]=3 3576 B6R0.3 CCC(Br)C(Cl)=O Amb17666758 [1,1,0,0,0,0|1,0,0]=3 3577 B6R0.3 CCC(Br)[N+]([O-])=O Amb17673702 [1,1,0,0,0,0|1,0,1]=4 3578 B6R0.3 CCC(C(=O)Cl)N Amb17593240 [1,1,0,0,0,0|1,0,0]=3 3579 B6R0.3 CCC(C(=O)N)Br Amb13952819 [1,1,0,0,0,0|1,0,0]=3 3580 B6R0.3 CCC(C(=O)N)N Amb1914080 [1,1,0,0,0,0|1,0,0]=3 3581 B6R0.3 CCC(C(=O)O)S Amb17501370 [1,1,0,0,0,0|0,0,0]=2 3582 B6R0.3 CCC(C(C)C)N Amb10610298 [1,1,0,0,0,0|1,0,1]=4 3583 B6R0.3 CCC(C(O)C)O Amb2227553 [1,1,0,0,0,0|1,0,1]=4 3584 B6R0.3 CCC(C)C(=C)Br Amb22583745 [1,1,0,0,0,0|2,0,0]=4 3585 B6R0.3 CCC(C)S([O-])=O Amb19893328 [1,1,0,0,0,0|1,0,1]=4 3586 B6R0.3 CCC(Cl)C(=C)Cl Amb24426218 [1,1,0,0,0,0|2,0,0]=4 3587 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [1,1,0,0,0,0|1,0,0]=3 3588 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [1,1,0,0,0,0|1,0,0]=3 3589 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [1,1,0,0,0,0|1,0,0]=3 3590 B6R0.3 CCC(F)C(C)=O Amb24736393 [1,1,0,0,0,0|1,0,0]=3 3591 B6R0.3 CCC(F)C(N)=O Amb25811426 [1,1,0,0,0,0|1,0,0]=3 3592 B6R0.3 CCC(F)C(O)=O Amb25716167 [1,1,0,0,0,0|0,0,0]=2 3593 B6R0.3 CCC(I)C(N)=O Amb25131171 [1,1,0,0,0,0|1,0,0]=3 3594 B6R0.3 CCC(N)C(=O)S Amb24479075 [1,1,0,0,0,0|0,1,0]=3 3595 B6R0.3 CCC(N)C(C)=O Amb18202785 [1,1,0,0,0,0|1,0,0]=3 3596 B6R0.3 CCC(N)C(N)=S Amb24573684 [1,1,0,0,0,0|1,1,0]=4 3597 B6R0.3 CCC(N)P(O)=O Amb25269903 [1,1,0,0,0,0|1,0,0]=3 3598 B6R0.3 CCC(O)C(=C)Br Amb25236591 [1,1,0,0,0,0|2,0,0]=4 3599 B6R0.3 CCC(O)C(C)=O Amb25336501 [1,1,0,0,0,0|1,0,0]=3 3600 B6R0.3 CCC(O)C(N)=O Amb24116514 [1,1,0,0,0,0|1,0,0]=3 3601 B6R0.3 CCC(O)C(N)=S Amb23449332 [1,1,0,0,0,0|1,1,0]=4 3602 B6R0.3 CCC(O)C(O)=O Amb22352315 [1,1,0,0,0,0|0,0,0]=2 3603 B6R0.3 CCC(O)C(O)=O Amb22360643 [1,1,0,0,0,0|0,0,0]=2 3604 B6R0.3 CCC(O)C([O-])=O Amb17943026 [1,1,0,0,0,0|0,0,1]=3 3605 B6R0.3 CCC(O)C([O-])=O Amb24325325 [1,1,0,0,0,0|0,0,1]=3 3606 B6R0.3 CCC(O)P(O)=O Amb25169578 [1,1,0,0,0,0|1,0,0]=3 3607 B6R0.3 CCC(S)C(N)=O Amb24479879 [1,1,0,0,0,0|1,0,0]=3 3608 B6R0.3 CCN(C)C(C)=O Amb22753516 [1,1,0,0,0,0|2,0,0]=4 3609 B6R0.3 CCN(O)C(N)=O Amb24669876 [1,1,0,0,0,0|2,0,0]=4 3610 B6R0.3 CC[C@@H](Br)C(=O)Cl Amb24582761 [1,1,0,0,0,0|1,0,0]=3 3611 B6R0.3 CC[C@@H](Br)C(N)=O Amb25025862 [1,1,0,0,0,0|1,0,0]=3 3612 B6R0.3 CC[C@@H](C)C(=O)Cl Amb24577241 [1,1,0,0,0,0|1,0,0]=3 3613 B6R0.3 CC[C@@H](C)C(N)=O Amb22232008 [1,1,0,0,0,0|1,0,0]=3 3614 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [1,1,0,0,0,0|1,0,0]=3 3615 B6R0.3 CC[C@@H](Cl)C(O)=O Amb22800493 [1,1,0,0,0,0|0,0,0]=2 3616 B6R0.3 CC[C@@H](F)C(O)=O Amb24669143 [1,1,0,0,0,0|0,0,0]=2 3617 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [1,1,0,0,0,0|1,0,0]=3 3618 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [1,1,0,0,0,0|1,0,0]=3 3619 B6R0.3 CC[C@@H](O)C(C)=O Amb25108045 [1,1,0,0,0,0|1,0,0]=3 3620 B6R0.3 CC[C@@H](O)C(O)=O Amb22369401 [1,1,0,0,0,0|0,0,0]=2 3621 B6R0.3 CC[C@H](Br)C(N)=O Amb24365914 [1,1,0,0,0,0|1,0,0]=3 3622 B6R0.3 CC[C@H](Br)C(O)=O Amb20242441 [1,1,0,0,0,0|0,0,0]=2 3623 B6R0.3 CC[C@H](C(=O)O)N Amb16233349 [1,1,0,0,0,0|0,0,0]=2 3624 B6R0.3 CC[C@H](C)B(O)O Amb25746615 [1,1,0,0,0,0|1,0,1]=4 3625 B6R0.3 CC[C@H](C)C(C)=O Amb24706969 [1,1,0,0,0,0|1,0,0]=3 3626 B6R0.3 CC[C@H](C)C(N)=S Amb25266928 [1,1,0,0,0,0|1,1,0]=4 3627 B6R0.3 CC[C@H](Cl)C(=O)Cl Amb24710023 [1,1,0,0,0,0|1,0,0]=3 3628 B6R0.3 CC[C@H](Cl)C(O)=O Amb25190040 [1,1,0,0,0,0|0,0,0]=2 3629 B6R0.3 CC[C@H](F)C(O)=O Amb24479776 [1,1,0,0,0,0|0,0,0]=2 3630 B6R0.3 CC[C@H](O)C(C)=O Amb24332700 [1,1,0,0,0,0|1,0,0]=3 3631 B6R0.3 CC[C@H](O)C(N)=O Amb25858046 [1,1,0,0,0,0|1,0,0]=3 3632 B6R0.3 CN(C)C(=O)C=O Amb18639628 [1,1,0,0,0,0|1,0,1]=4 3633 B6R0.3 CN=C(Cl)C(O)=O Amb24446313 [1,1,0,0,0,0|1,0,1]=4 3634 B6R0.3 CNC(=C)C(O)=O Amb25743212 [1,1,0,0,0,0|1,0,1]=4 3635 B6R0.3 CNC(=N)C(O)=O Amb18639921 [1,1,0,0,0,0|1,0,1]=4 3636 B6R0.3 CNC(=S)C(O)=O Amb24479905 [1,1,0,0,0,0|1,0,1]=4 3637 B6R0.3 CNC(C(C)C)C Amb1117387 [1,1,0,0,0,0|2,0,0]=4 3638 B6R0.3 CNC(C)C(C)=O Amb24369529 [1,1,0,0,0,0|2,0,0]=4 3639 B6R0.3 CNC(C)C(O)=O Amb19373699 [1,1,0,0,0,0|1,0,0]=3 3640 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [1,1,0,0,0,0|2,0,0]=4 3641 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [1,1,0,0,0,0|2,0,0]=4 3642 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [1,1,0,0,0,0|2,0,0]=4 3643 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [1,1,0,0,0,0|2,0,0]=4 3644 B6R0.3 COC(=C)C(O)=O Amb18639906 [1,1,0,0,0,0|1,0,1]=4 3645 B6R0.3 COC(=O)C(O)=O Amb22011503 [1,1,0,0,0,0|1,0,1]=4 3646 B6R0.3 COC(Br)C(C)=O Amb25360111 [1,1,0,0,0,0|2,0,0]=4 3647 B6R0.3 COC(N)C(N)=O Amb25178891 [1,1,0,0,0,0|2,0,0]=4 3648 B6R0.3 COC(N)C(O)=O Amb24621851 [1,1,0,0,0,0|1,0,0]=3 3649 B6R0.3 COC(O)C(O)=O Amb24479754 [1,1,0,0,0,0|1,0,0]=3 3650 B6R0.3 CO[C@H](C)C(C)=O Amb24736032 [1,1,0,0,0,0|2,0,0]=4 3651 B6R0.3 CSC(=O)C(O)=O Amb24731100 [1,1,0,0,0,0|1,0,1]=4 3652 B6R0.3 CSC(=S)C(O)=O Amb25702678 [1,1,0,0,0,0|1,0,1]=4 3653 B6R0.3 CSC(Br)C(O)=O Amb25169549 [1,1,0,0,0,0|1,0,0]=3 3654 B6R0.3 CSC(C)C(=O)Cl Amb24742667 [1,1,0,0,0,0|2,0,0]=4 3655 B6R0.3 CSC(F)C(O)=O Amb25043740 [1,1,0,0,0,0|1,0,0]=3 3656 B6R0.3 CSC(O)C(C)=O Amb24479166 [1,1,0,0,0,0|2,0,0]=4 3657 B6R0.3 CS[C@@H](C)C(O)=O Amb25173497 [1,1,0,0,0,0|1,0,0]=3 3658 B6R0.3 C[C@@H](Br)[C@H](Cl)C=C Amb25147388 [1,1,0,0,0,0|2,0,0]=4 3659 B6R0.3 C[C@@H](C(=O)O)CN Amb10844022 [1,1,0,0,0,0|1,0,0]=3 3660 B6R0.3 C[C@@H](C(=O)O)NC Amb16233347 [1,1,0,0,0,0|1,0,0]=3 3661 B6R0.3 C[C@@H](C(=O)O)NC Amb16233348 [1,1,0,0,0,0|1,0,0]=3 3662 B6R0.3 C[C@@H](C=O)C(C)=O Amb24666681 [1,1,0,0,0,0|1,0,1]=4 3663 B6R0.3 C[C@@H](C=O)[C@@H](C)O Amb25714216 [1,1,0,0,0,0|1,0,0]=3 3664 B6R0.3 C[C@@H](CBr)C(O)=O Amb24334368 [1,1,0,0,0,0|1,0,0]=3 3665 B6R0.3 C[C@@H](CC)[C@H](C)O Amb24456969 [1,1,0,0,0,0|1,0,1]=4 3666 B6R0.3 C[C@@H](CN)C(O)=O Amb22756746 [1,1,0,0,0,0|1,0,0]=3 3667 B6R0.3 C[C@@H](CO)C(C)=O Amb25320503 [1,1,0,0,0,0|2,0,0]=4 3668 B6R0.3 C[C@@H](CO)N(C)C Amb25373937 [1,1,0,0,0,0|1,0,1]=4 3669 B6R0.3 C[C@@H](CS)C(O)=O Amb24462697 [1,1,0,0,0,0|1,0,0]=3 3670 B6R0.3 C[C@@H](Cl)[C@H](Cl)C=C Amb25321987 [1,1,0,0,0,0|2,0,0]=4 3671 B6R0.3 C[C@@H](N)[C@@H](O)CO Amb19944286 [1,1,0,0,0,0|1,0,1]=4 3672 B6R0.3 C[C@@H](NN)C(O)=O Amb24732969 [1,1,0,0,0,0|2,0,0]=4 3673 B6R0.3 C[C@@H](NO)C(O)=O Amb24702625 [1,1,0,0,0,0|2,0,0]=4 3674 B6R0.3 C[C@@H](O)[C@@H](N)CC Amb24117049 [1,1,0,0,0,0|1,0,1]=4 3675 B6R0.3 C[C@@H](O)[C@H](C)CO Amb25810619 [1,1,0,0,0,0|1,0,1]=4 3676 B6R0.3 C[C@@H](O)[C@H](Cl)C=C Amb25760329 [1,1,0,0,0,0|2,0,0]=4 3677 B6R0.3 C[C@@H](O)[C@H](N)CC Amb24117050 [1,1,0,0,0,0|1,0,1]=4 3678 B6R0.3 C[C@@H](O)[C@H](O)C=C Amb25763019 [1,1,0,0,0,0|2,0,0]=4 3679 B6R0.3 C[C@@H](O)[C@H](O)C=O Amb24398705 [1,1,0,0,0,0|1,0,0]=3 3680 B6R0.3 C[C@@H](O)[C@H](O)CO Amb25084430 [1,1,0,0,0,0|1,0,1]=4 3681 B6R0.3 C[C@H](Br)[C@H](Cl)C=C Amb24415438 [1,1,0,0,0,0|2,0,0]=4 3682 B6R0.3 C[C@H](Br)[C@H](Cl)C=O Amb25779134 [1,1,0,0,0,0|1,0,0]=3 3683 B6R0.3 C[C@H](C(=O)N)OC Amb17617080 [1,1,0,0,0,0|2,0,0]=4 3684 B6R0.3 C[C@H](C(=O)O)CCl Amb10844008 [1,1,0,0,0,0|1,0,0]=3 3685 B6R0.3 C[C@H](C(=O)O)NC Amb10844859 [1,1,0,0,0,0|1,0,0]=3 3686 B6R0.3 C[C@H](C=C)[C@@H](C)O Amb25167394 [1,1,0,0,0,0|2,0,0]=4 3687 B6R0.3 C[C@H](C=C)[C@H](C)O Amb25284228 [1,1,0,0,0,0|2,0,0]=4 3688 B6R0.3 C[C@H](C=O)C(C)=O Amb25358934 [1,1,0,0,0,0|1,0,1]=4 3689 B6R0.3 C[C@H](C=O)N(C)C Amb24333507 [1,1,0,0,0,0|1,0,0]=3 3690 B6R0.3 C[C@H](CC)[C@H](C)O Amb25675718 [1,1,0,0,0,0|1,0,1]=4 3691 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [1,1,0,0,0,0|2,0,0]=4 3692 B6R0.3 C[C@H](CCl)C(O)=O Amb25133056 [1,1,0,0,0,0|1,0,0]=3 3693 B6R0.3 C[C@H](CN)C(O)=O Amb24117452 [1,1,0,0,0,0|1,0,0]=3 3694 B6R0.3 C[C@H](CO)[C@H](C)Cl Amb24479757 [1,1,0,0,0,0|1,0,1]=4 3695 B6R0.3 C[C@H](CS)C(O)=O Amb25228453 [1,1,0,0,0,0|1,0,0]=3 3696 B6R0.3 C[C@H](Cl)[C@@H](Cl)C=C Amb24479764 [1,1,0,0,0,0|2,0,0]=4 3697 B6R0.3 C[C@H](Cl)[C@H](Br)C=O Amb24479005 [1,1,0,0,0,0|1,0,0]=3 3698 B6R0.3 C[C@H](Cl)[C@H](Cl)C=O Amb25810801 [1,1,0,0,0,0|1,0,0]=3 3699 B6R0.3 C[C@H](N)[C@@H](O)C=C Amb25338363 [1,1,0,0,0,0|2,0,0]=4 3700 B6R0.3 C[C@H](N)[C@@H](O)CO Amb25327107 [1,1,0,0,0,0|1,0,1]=4 3701 B6R0.3 C[C@H](N)[C@H](O)CO Amb24479808 [1,1,0,0,0,0|1,0,1]=4 3702 B6R0.3 C[C@H](N=C)C(O)=O Amb25720495 [1,1,0,0,0,0|1,0,1]=4 3703 B6R0.3 C[C@H](NCl)C(O)=O Amb24460300 [1,1,0,0,0,0|2,0,0]=4 3704 B6R0.3 C[C@H](O)C(O)C=C Amb24748479 [1,1,0,0,0,0|2,0,0]=4 3705 B6R0.3 C[C@H](O)[C@@H](C)CO Amb24480821 [1,1,0,0,0,0|1,0,1]=4 3706 B6R0.3 C[C@H](O)[C@@H](O)C=C Amb25675725 [1,1,0,0,0,0|2,0,0]=4 3707 B6R0.3 C[C@H](O)[C@H](C)CO Amb25127201 [1,1,0,0,0,0|1,0,1]=4 3708 B6R0.3 C[C@H](O)[C@H](N)CO Amb24479858 [1,1,0,0,0,0|1,0,1]=4 3709 B6R0.3 C[C@H](O)[C@H](O)C=C Amb25676499 [1,1,0,0,0,0|2,0,0]=4 3710 B6R0.3 C[C@H](O)[C@H](O)CO Amb25185955 [1,1,0,0,0,0|1,0,1]=4 3711 B6R0.3 C[C@H](ON)C(O)=O Amb25853808 [1,1,0,0,0,0|2,0,0]=4 3712 B6R0.3 C\C=C(/Br)\C(O)=O Amb18646193 [1,1,0,0,0,0|0,0,2]=4 3713 B6R0.3 C\C=C(/Cl)\C(O)=O Amb18123515 [1,1,0,0,0,0|0,0,2]=4 3714 B6R0.3 C\C=C(/O)\C(O)=O Amb22727962 [1,1,0,0,0,0|0,0,2]=4 3715 B6R0.3 C\C=C(\C)/C(C)C Amb22731816 [1,1,0,0,0,0|1,0,1]=4 3716 B6R0.3 NC(=O)C(Cl)CCl Amb22228204 [1,1,0,0,0,0|2,0,0]=4 3717 B6R0.3 NC(=O)C(Cl)CO Amb24392534 [1,1,0,0,0,0|2,0,0]=4 3718 B6R0.3 NC(=O)C(F)CF Amb25128008 [1,1,0,0,0,0|2,0,0]=4 3719 B6R0.3 NC(=O)C(F)CO Amb24507432 [1,1,0,0,0,0|2,0,0]=4 3720 B6R0.3 NC(=O)[C@H](O)CO Amb25732480 [1,1,0,0,0,0|2,0,0]=4 3721 B6R0.3 NC(C#N)C(O)=O Amb25328320 [1,1,0,0,0,0|1,0,1]=4 3722 B6R0.3 NC(C(=O)N)CO Amb17593097 [1,1,0,0,0,0|2,0,0]=4 3723 B6R0.3 NC(C(=O)O)CF Amb10839589 [1,1,0,0,0,0|1,0,0]=3 3724 B6R0.3 NC(C(=O)O)CS Amb13961966 [1,1,0,0,0,0|1,0,0]=3 3725 B6R0.3 NC(C(C)C)C#N Amb1129748 [1,1,0,0,0,0|1,0,1]=4 3726 B6R0.3 NC(C=O)C(O)=O Amb24349579 [1,1,0,0,0,0|1,0,1]=4 3727 B6R0.3 NC(C=S)C(O)=O Amb25227802 [1,1,0,0,0,0|1,0,1]=4 3728 B6R0.3 NC(CCl)C(O)=O Amb19651457 [1,1,0,0,0,0|1,0,0]=3 3729 B6R0.3 NC(CCl)C(O)=O Amb21961077 [1,1,0,0,0,0|1,0,0]=3 3730 B6R0.3 NC(CI)C(O)=O Amb25177412 [1,1,0,0,0,0|1,0,0]=3 3731 B6R0.3 NC(CO)[13C](O)=O Amb22353217 [1,1,0,0,0,0|1,0,0]=3 3732 B6R0.3 NC(CS)C(N)=O Amb18641990 [1,1,0,0,0,0|2,0,0]=4 3733 B6R0.3 NC(CS)C(O)=O Amb22489523 [1,1,0,0,0,0|1,0,0]=3 3734 B6R0.3 NC(CS)P(O)=O Amb25772157 [1,1,0,0,0,0|2,0,0]=4 3735 B6R0.3 NC([13CH2]S)C(O)=O Amb22054824 [1,1,0,0,0,0|1,0,0]=3 3736 B6R0.3 NCC(=O)C(O)=O Amb24361938 [1,1,0,0,0,0|1,0,1]=4 3737 B6R0.3 NCC(C(=O)O)Cl Amb17593263 [1,1,0,0,0,0|1,0,0]=3 3738 B6R0.3 NCC(C(=O)O)S Amb17593238 [1,1,0,0,0,0|1,0,0]=3 3739 B6R0.3 NCC(Cl)C(N)=O Amb25173817 [1,1,0,0,0,0|2,0,0]=4 3740 B6R0.3 NCC(F)C(O)=O Amb22733051 [1,1,0,0,0,0|1,0,0]=3 3741 B6R0.3 NCC(N)C(N)=O Amb18122079 [1,1,0,0,0,0|2,0,0]=4 3742 B6R0.3 NCC(N)C(O)=O Amb22899095 [1,1,0,0,0,0|1,0,0]=3 3743 B6R0.3 NC[C@@H](F)C(O)=O Amb25824168 [1,1,0,0,0,0|1,0,0]=3 3744 B6R0.3 NC[C@@H](N)C(O)=O Amb22745957 [1,1,0,0,0,0|1,0,0]=3 3745 B6R0.3 NC[C@@H](O)C(O)=O Amb22169412 [1,1,0,0,0,0|1,0,0]=3 3746 B6R0.3 NC[C@@H](S)C(N)=O Amb25106293 [1,1,0,0,0,0|2,0,0]=4 3747 B6R0.3 NC[C@H](N)C(N)=O Amb24470655 [1,1,0,0,0,0|2,0,0]=4 3748 B6R0.3 NNC(C(C)C)C Amb10608978 [1,1,0,0,0,0|2,0,0]=4 3749 B6R0.3 NOC(F)C(O)=O Amb24446310 [1,1,0,0,0,0|2,0,0]=4 3750 B6R0.3 NOC(O)C(O)=O Amb24735537 [1,1,0,0,0,0|2,0,0]=4 3751 B6R0.3 N[13CH2][13C@H]([13C](=O)O)F Amb17608076 [1,1,0,0,0,0|1,0,0]=3 3752 B6R0.3 N[13CH2][13CH]([13C](=O)O)F Amb17614381 [1,1,0,0,0,0|1,0,0]=3 3753 B6R0.3 N[14CH]([14CH2]O)[14C](O)=O Amb22362940 [1,1,0,0,0,0|1,0,0]=3 3754 B6R0.3 N[C@@H](CCl)C(O)=O Amb22232860 [1,1,0,0,0,0|1,0,0]=3 3755 B6R0.3 N[C@@H](CI)C(O)=O Amb25767583 [1,1,0,0,0,0|1,0,0]=3 3756 B6R0.3 N[C@@H](CO)C(O)=O Amb22351170 [1,1,0,0,0,0|1,0,0]=3 3757 B6R0.3 N[C@@H](CS)C(=O)Cl Amb24562196 [1,1,0,0,0,0|2,0,0]=4 3758 B6R0.3 N[C@@H](CS)C(N)=O Amb23437751 [1,1,0,0,0,0|2,0,0]=4 3759 B6R0.3 N[C@@H](CS)[13C](O)=O Amb22350380 [1,1,0,0,0,0|1,0,0]=3 3760 B6R0.3 N[C@H](C(=O)O)CN Amb16183820 [1,1,0,0,0,0|1,0,0]=3 3761 B6R0.3 N[C@H](CF)C(O)=O Amb24479910 [1,1,0,0,0,0|1,0,0]=3 3762 B6R0.3 N[C@H](CO)C(N)=O Amb22886957 [1,1,0,0,0,0|2,0,0]=4 3763 B6R0.3 N[C@H](CS)C(O)=O Amb17942912 [1,1,0,0,0,0|1,0,0]=3 3764 B6R0.3 O=C(Cl)C(F)CCl Amb25324478 [1,1,0,0,0,0|2,0,0]=4 3765 B6R0.3 O=C(S)C(Cl)CCl Amb25112062 [1,1,0,0,0,0|1,1,0]=4 3766 B6R0.3 O=CC(C(=O)C)Br Amb17232509 [1,1,0,0,0,0|1,0,1]=4 3767 B6R0.3 O=CC(C(C)C)Br Amb17594091 [1,1,0,0,0,0|0,0,0]=2 3768 B6R0.3 O=CC(C(C)C)C Amb17593082 [1,1,0,0,0,0|0,0,0]=2 3769 B6R0.3 O=CC(C(C)C)O Amb17593092 [1,1,0,0,0,0|0,0,0]=2 3770 B6R0.3 OC(=O)C(=O)CBr Amb10068671 [1,1,0,0,0,0|1,0,1]=4 3771 B6R0.3 OC(=O)C(=O)CCl Amb16233358 [1,1,0,0,0,0|1,0,1]=4 3772 B6R0.3 OC(=O)C(=O)CF Amb22008247 [1,1,0,0,0,0|1,0,1]=4 3773 B6R0.3 OC(=O)C(=O)CF Amb22274202 [1,1,0,0,0,0|1,0,1]=4 3774 B6R0.3 OC(=O)C(=O)CS Amb22360785 [1,1,0,0,0,0|1,0,1]=4 3775 B6R0.3 OC(=O)C(Br)CCl Amb24478864 [1,1,0,0,0,0|1,0,0]=3 3776 B6R0.3 OC(=O)C(CF)Br Amb10605519 [1,1,0,0,0,0|1,0,0]=3 3777 B6R0.3 OC(=O)C(Cl)C=O Amb24480969 [1,1,0,0,0,0|1,0,1]=4 3778 B6R0.3 OC(=O)C(Cl)CBr Amb25227429 [1,1,0,0,0,0|1,0,0]=3 3779 B6R0.3 OC(=O)C(Cl)CCl Amb22228245 [1,1,0,0,0,0|1,0,0]=3 3780 B6R0.3 OC(=O)C(Cl)CF Amb24669144 [1,1,0,0,0,0|1,0,0]=3 3781 B6R0.3 OC(=O)C(Cl)CS Amb18643661 [1,1,0,0,0,0|1,0,0]=3 3782 B6R0.3 OC(=O)C(F)C=O Amb22055301 [1,1,0,0,0,0|1,0,1]=4 3783 B6R0.3 OC(=O)C(F)CF Amb24746801 [1,1,0,0,0,0|1,0,0]=3 3784 B6R0.3 OC(=O)C(S)CS Amb18643295 [1,1,0,0,0,0|1,0,0]=3 3785 B6R0.3 OC(=O)[C@H](Cl)CCl Amb25141566 [1,1,0,0,0,0|1,0,0]=3 3786 B6R0.3 OC(C(C)C)C#N Amb13952275 [1,1,0,0,0,0|1,0,1]=4 3787 B6R0.3 OC(C=O)C(O)=O Amb18640325 [1,1,0,0,0,0|1,0,1]=4 3788 B6R0.3 OC(CBr)C(O)=O Amb24061932 [1,1,0,0,0,0|1,0,0]=3 3789 B6R0.3 OC(CCl)P(O)=O Amb25069434 [1,1,0,0,0,0|2,0,0]=4 3790 B6R0.3 OC(CS)C(O)=O Amb18642053 [1,1,0,0,0,0|1,0,0]=3 3791 B6R0.3 OCC(Br)C(O)=O Amb18126327 [1,1,0,0,0,0|1,0,0]=3 3792 B6R0.3 OCC(C(=O)O)F Amb17593117 [1,1,0,0,0,0|1,0,0]=3 3793 B6R0.3 OCC(C(=O)O)O Amb17593103 [1,1,0,0,0,0|1,0,0]=3 3794 B6R0.3 OCC(C(O)C)N Amb17593100 [1,1,0,0,0,0|1,0,1]=4 3795 B6R0.3 OCC(Cl)C(O)=O Amb18124304 [1,1,0,0,0,0|1,0,0]=3 3796 B6R0.3 OC[C@@H](C(=O)O)Br Amb10601700 [1,1,0,0,0,0|1,0,0]=3 3797 B6R0.3 OC[C@@H](C(=O)O)C Amb10844567 [1,1,0,0,0,0|1,0,0]=3 3798 B6R0.3 OC[C@@H](C(C)C)C Amb17613247 [1,1,0,0,0,0|0,0,1]=3 3799 B6R0.3 OC[C@H](C(=O)O)C Amb10844554 [1,1,0,0,0,0|1,0,0]=3 3800 B6R0.3 OC[C@H](O)C(O)=O Amb22226732 [1,1,0,0,0,0|1,0,0]=3 3801 B6R0.3 ONC(=N)C(C)C Amb10070844 [1,1,0,0,0,0|1,0,1]=4 3802 B6R0.3 ONC(O)C(O)=O Amb25832155 [1,1,0,0,0,0|2,0,0]=4 3803 B6R0.3 O[13C](=O)C(=O)CBr Amb22363329 [1,1,0,0,0,0|1,0,1]=4 3804 B6R0.3 O[C@@H](CCl)C(O)=O Amb22225325 [1,1,0,0,0,0|1,0,0]=3 3805 B6R0.3 O[C@@H](CF)C(O)=O Amb24117272 [1,1,0,0,0,0|1,0,0]=3 3806 B6R0.3 O[C@@H](CS)C(O)=O Amb24428282 [1,1,0,0,0,0|1,0,0]=3 3807 B6R0.3 O[C@H](CCl)C(O)=O Amb22388611 [1,1,0,0,0,0|1,0,0]=3 3808 B6R0.3 [13CH3]CC(=O)C([O-])=O Amb22353582 [1,1,0,0,0,0|0,0,2]=4 3809 B6R0.3 [13CH3][13CH2][13CH](O)[13C](O)=O Amb22350316 [1,1,0,0,0,0|0,0,0]=2 3810 B6R0.3 [15NH2][13C@@H]([13CH2]S)[13C](O)=O Amb22354011 [1,1,0,0,0,0|1,0,0]=3 3811 B6R0.3 [15NH2][C@@H](CO)C(O)=O Amb22353589 [1,1,0,0,0,0|1,0,0]=3 3812 B6R0.3 [O-]C(=O)C(O)CO Amb22045196 [1,1,0,0,0,0|1,0,1]=4 3813 B6R0.3 [O-]C(=O)[C@@H](O)CO Amb22799769 [1,1,0,0,0,0|1,0,1]=4 3814 B6R0.3 [O-]C(=O)[C@H](C[S-])N Amb17621353 [1,1,0,0,0,0|1,0,1]=4 3815 B6R0.4 BC(=O)OCCCl Amb25199831 [1,1,0,0,0,0|2,0,0]=4 3816 B6R0.4 BrCCOC(C)C Amb1105066 [1,1,0,0,0,0|1,0,1]=4 3817 B6R0.4 C#CCCC(N)=O Amb18636026 [1,1,0,0,0,0|1,0,1]=4 3818 B6R0.4 C#CCCC([O-])=O Amb22232009 [1,1,0,0,0,0|0,0,2]=4 3819 B6R0.4 C=C(Cl)CCCBr Amb25811643 [1,1,0,0,0,0|2,0,0]=4 3820 B6R0.4 C=C(Cl)CCCCl Amb24635037 [1,1,0,0,0,0|2,0,0]=4 3821 B6R0.4 C=C(F)CCCO Amb25811029 [1,1,0,0,0,0|2,0,0]=4 3822 B6R0.4 C=C(I)CCCN Amb24581029 [1,1,0,0,0,0|2,0,0]=4 3823 B6R0.4 C=CCNC(C)C Amb10609485 [1,1,0,0,0,0|1,0,0]=3 3824 B6R0.4 C=NCCC(O)=O Amb24480865 [1,1,0,0,0,0|0,0,1]=3 3825 B6R0.4 CC#CCC(N)=O Amb24761404 [1,1,0,0,0,0|1,0,1]=4 3826 B6R0.4 CC#CCC(O)=O Amb17939740 [1,1,0,0,0,0|0,0,1]=3 3827 B6R0.4 CC(=C)CCC=O Amb18120891 [1,1,0,0,0,0|0,0,2]=4 3828 B6R0.4 CC(=C)CCCBr Amb22886717 [1,1,0,0,0,0|2,0,0]=4 3829 B6R0.4 CC(=C)CCCCl Amb24089299 [1,1,0,0,0,0|2,0,0]=4 3830 B6R0.4 CC(=C)CCCN Amb24761452 [1,1,0,0,0,0|2,0,0]=4 3831 B6R0.4 CC(=C)CCCO Amb22886814 [1,1,0,0,0,0|2,0,0]=4 3832 B6R0.4 CC(=C)CNC=O Amb24448470 [1,1,0,0,0,0|0,0,2]=4 3833 B6R0.4 CC(=O)CC=NO Amb25024487 [1,1,0,0,0,0|1,0,1]=4 3834 B6R0.4 CC(=O)CCC=O Amb18639597 [1,1,0,0,0,0|1,0,1]=4 3835 B6R0.4 CC(=O)CCC=S Amb25662155 [1,1,0,0,0,0|1,0,1]=4 3836 B6R0.4 CC(=O)CCCF Amb25068187 [1,1,0,0,0,0|1,0,0]=3 3837 B6R0.4 CC(=O)CCCI Amb25346994 [1,1,0,0,0,0|1,0,0]=3 3838 B6R0.4 CC(=O)CCCN Amb18121547 [1,1,0,0,0,0|1,0,0]=3 3839 B6R0.4 CC(=O)CCON Amb25186994 [1,1,0,0,0,0|2,0,0]=4 3840 B6R0.4 CC(=O)CNC=O Amb23442787 [1,1,0,0,0,0|1,0,1]=4 3841 B6R0.4 CC(=O)COC=O Amb24736861 [1,1,0,0,0,0|1,0,1]=4 3842 B6R0.4 CC(=O)C\C=N/O Amb25066399 [1,1,0,0,0,0|1,0,1]=4 3843 B6R0.4 CC(=O)NCC=O Amb25757509 [1,1,0,0,0,0|1,0,1]=4 3844 B6R0.4 CC(=O)NCCF Amb25832238 [1,1,0,0,0,0|2,0,0]=4 3845 B6R0.4 CC(=O)NCCI Amb25761166 [1,1,0,0,0,0|2,0,0]=4 3846 B6R0.4 CC(=O)NCCN Amb1218225 [1,1,0,0,0,0|2,0,0]=4 3847 B6R0.4 CC(=O)NCCS Amb22230992 [1,1,0,0,0,0|2,0,0]=4 3848 B6R0.4 CC(=O)OCCF Amb25123333 [1,1,0,0,0,0|2,0,0]=4 3849 B6R0.4 CC(=O)OCCI Amb17673987 [1,1,0,0,0,0|2,0,0]=4 3850 B6R0.4 CC(=O)OCCN Amb18121947 [1,1,0,0,0,0|2,0,0]=4 3851 B6R0.4 CC(=O)OCCP Amb25810695 [1,1,0,0,0,0|2,0,0]=4 3852 B6R0.4 CC(=O)SCCBr Amb24608039 [1,1,0,0,0,0|2,0,0]=4 3853 B6R0.4 CC(=O)SCCCl Amb24746776 [1,1,0,0,0,0|2,0,0]=4 3854 B6R0.4 CC(=O)SCCN Amb21953963 [1,1,0,0,0,0|2,0,0]=4 3855 B6R0.4 CC(=O)SCCN Amb22011516 [1,1,0,0,0,0|2,0,0]=4 3856 B6R0.4 CC(Br)CCC=C Amb20669632 [1,1,0,0,0,0|2,0,0]=4 3857 B6R0.4 CC(Br)CCC=O Amb18645866 [1,1,0,0,0,0|1,0,0]=3 3858 B6R0.4 CC(Br)CCON Amb25774479 [1,1,0,0,0,0|1,0,1]=4 3859 B6R0.4 CC(Br)CN=C=O Amb25060716 [1,1,0,0,0,0|1,0,1]=4 3860 B6R0.4 CC(Br)COC=O Amb24634016 [1,1,0,0,0,0|1,0,0]=3 3861 B6R0.4 CC(C)=C=CC=O Amb25082892 [1,1,0,0,0,0|0,0,2]=4 3862 B6R0.4 CC(C)=CC=CO Amb25746627 [1,1,0,0,0,0|0,0,2]=4 3863 B6R0.4 CC(C)=CCC=C Amb22230004 [1,1,0,0,0,0|1,0,1]=4 3864 B6R0.4 CC(C)=CCC=O Amb18120881 [1,1,0,0,0,0|0,0,1]=3 3865 B6R0.4 CC(C)=CCCO Amb22002283 [1,1,0,0,0,0|0,0,2]=4 3866 B6R0.4 CC(C)C#CC=O Amb25081455 [1,1,0,0,0,0|0,0,1]=3 3867 B6R0.4 CC(C)C#CCO Amb24757812 [1,1,0,0,0,0|0,0,2]=4 3868 B6R0.4 CC(C)C=C=CCl Amb25747188 [1,1,0,0,0,0|1,0,1]=4 3869 B6R0.4 CC(C)C=CC=C Amb24062928 [1,1,0,0,0,0|1,0,1]=4 3870 B6R0.4 CC(C)CCC=O Amb17673735 [1,1,0,0,0,0|0,0,0]=2 3871 B6R0.4 CC(C)CCNN Amb20622972 [1,1,0,0,0,0|1,0,1]=4 3872 B6R0.4 CC(C)CC[Zn]Br Amb22000394 [1,1,0,0,0,0|1,0,1]=4 3873 B6R0.4 CC(C)CN=[N+]=[N-] Amb25328317 [1,1,0,0,0,0|2,0,0]=4 3874 B6R0.4 CC(C)COC=C Amb22338580 [1,1,0,0,0,0|1,0,0]=3 3875 B6R0.4 CC(C)COCBr Amb25059167 [1,1,0,0,0,0|1,0,1]=4 3876 B6R0.4 CC(C)COCN Amb24377110 [1,1,0,0,0,0|1,0,1]=4 3877 B6R0.4 CC(C)CSC#N Amb24663736 [1,1,0,0,0,0|1,0,1]=4 3878 B6R0.4 CC(C)N=CCCl Amb24715987 [1,1,0,0,0,0|2,0,0]=4 3879 B6R0.4 CC(C)NC=S=O Amb25743205 [1,1,0,0,0,0|1,0,0]=3 3880 B6R0.4 CC(C)NCCBr Amb20224139 [1,1,0,0,0,0|1,0,1]=4 3881 B6R0.4 CC(C)NCCCl Amb22001878 [1,1,0,0,0,0|1,0,1]=4 3882 B6R0.4 CC(C)NCCS Amb18640872 [1,1,0,0,0,0|0,1,1]=4 3883 B6R0.4 CC(C)N\C=N/O Amb25789619 [1,1,0,0,0,0|1,0,0]=3 3884 B6R0.4 CC(C)O/C=C/Cl Amb17689422 [1,1,0,0,0,0|1,0,1]=4 3885 B6R0.4 CC(C)OCC=C Amb25362033 [1,1,0,0,0,0|1,0,0]=3 3886 B6R0.4 CC(C)OCC=O Amb25820659 [1,1,0,0,0,0|0,0,0]=2 3887 B6R0.4 CC(C)OCCN Amb21955181 [1,1,0,0,0,0|1,0,1]=4 3888 B6R0.4 CC(C)OCCN Amb22491045 [1,1,0,0,0,0|1,0,1]=4 3889 B6R0.4 CC(C)OCCS Amb25107566 [1,1,0,0,0,0|0,1,1]=4 3890 B6R0.4 CC(C)ONC=O Amb24735855 [1,1,0,0,0,0|1,0,0]=3 3891 B6R0.4 CC(C)O\C=C/Cl Amb24391483 [1,1,0,0,0,0|1,0,1]=4 3892 B6R0.4 CC(C)SCC#C Amb24479778 [1,1,0,0,0,0|1,0,1]=4 3893 B6R0.4 CC(C)SCC=C Amb17933937 [1,1,0,0,0,0|1,0,0]=3 3894 B6R0.4 CC(C)SCC=O Amb24479811 [1,1,0,0,0,0|0,0,0]=2 3895 B6R0.4 CC(C)SCCBr Amb18321807 [1,1,0,0,0,0|1,0,1]=4 3896 B6R0.4 CC(C)SCCI Amb25706190 [1,1,0,0,0,0|1,0,1]=4 3897 B6R0.4 CC(C)SCCN Amb21959653 [1,1,0,0,0,0|1,0,1]=4 3898 B6R0.4 CC(C)SCCN Amb22586910 [1,1,0,0,0,0|1,0,1]=4 3899 B6R0.4 CC(C)S\C=C/Br Amb24531716 [1,1,0,0,0,0|1,0,1]=4 3900 B6R0.4 CC(C)S\C=C\Br Amb24617844 [1,1,0,0,0,0|1,0,1]=4 3901 B6R0.4 CC(C)\C=C/C=O Amb25313098 [1,1,0,0,0,0|0,0,1]=3 3902 B6R0.4 CC(C)\C=C\C#C Amb24530443 [1,1,0,0,0,0|1,0,1]=4 3903 B6R0.4 CC(C)\C=C\C#N Amb24438061 [1,1,0,0,0,0|1,0,1]=4 3904 B6R0.4 CC(C)\C=C\CBr Amb25138767 [1,1,0,0,0,0|1,0,1]=4 3905 B6R0.4 CC(C)\C=C\CCl Amb25219185 [1,1,0,0,0,0|1,0,1]=4 3906 B6R0.4 CC(C)\C=C\CI Amb25317254 [1,1,0,0,0,0|1,0,1]=4 3907 B6R0.4 CC(C)\C=C\CO Amb25802048 [1,1,0,0,0,0|0,0,1]=3 3908 B6R0.4 CC(C)\N=C\CCl Amb25147657 [1,1,0,0,0,0|2,0,0]=4 3909 B6R0.4 CC(Cl)CCC=C Amb24355384 [1,1,0,0,0,0|2,0,0]=4 3910 B6R0.4 CC(Cl)CCC=O Amb18124284 [1,1,0,0,0,0|1,0,0]=3 3911 B6R0.4 CC(Cl)CNS=O Amb25210515 [1,1,0,0,0,0|2,0,0]=4 3912 B6R0.4 CC(Cl)C\C=C\Cl Amb25294374 [1,1,0,0,0,0|2,0,0]=4 3913 B6R0.4 CC(Cl)OCC=C Amb25147324 [1,1,0,0,0,0|2,0,0]=4 3914 B6R0.4 CC(Cl)SCC=C Amb25109175 [1,1,0,0,0,0|2,0,0]=4 3915 B6R0.4 CC(I)CCC=O Amb24333933 [1,1,0,0,0,0|1,0,0]=3 3916 B6R0.4 CC(I)CCCO Amb25302406 [1,1,0,0,0,0|1,0,1]=4 3917 B6R0.4 CC(N)CC=C=C Amb24434395 [1,1,0,0,0,0|2,0,0]=4 3918 B6R0.4 CC(N)CCC=C Amb18121283 [1,1,0,0,0,0|2,0,0]=4 3919 B6R0.4 CC(N)CCC=O Amb24443883 [1,1,0,0,0,0|1,0,0]=3 3920 B6R0.4 CC(N)\C=C\CO Amb25695323 [1,1,0,0,0,0|1,0,1]=4 3921 B6R0.4 CC(O)CCC=C Amb22059013 [1,1,0,0,0,0|2,0,0]=4 3922 B6R0.4 CC(O)CCCCl Amb22270232 [1,1,0,0,0,0|1,0,1]=4 3923 B6R0.4 CC(O)CCCF Amb24385806 [1,1,0,0,0,0|1,0,1]=4 3924 B6R0.4 CC(O)CCCO Amb22227752 [1,1,0,0,0,0|1,0,1]=4 3925 B6R0.4 CC(O)CCCS Amb25219256 [1,1,0,0,0,0|1,0,1]=4 3926 B6R0.4 CC(O)CNC=O Amb20622242 [1,1,0,0,0,0|1,0,0]=3 3927 B6R0.4 CC(O)CNCO Amb25727260 [1,1,0,0,0,0|1,0,1]=4 3928 B6R0.4 CC(O)CON=O Amb24480649 [1,1,0,0,0,0|2,0,0]=4 3929 B6R0.4 CC(O)CO[PH2]=O Amb24332262 [1,1,0,0,0,0|2,0,0]=4 3930 B6R0.4 CC(O)C\C=C/Br Amb25810811 [1,1,0,0,0,0|2,0,0]=4 3931 B6R0.4 CC(O)C\C=C\Cl Amb24479438 [1,1,0,0,0,0|2,0,0]=4 3932 B6R0.4 CC(O)OCC=C Amb24397961 [1,1,0,0,0,0|2,0,0]=4 3933 B6R0.4 CC(O)\C=C\C=O Amb18639615 [1,1,0,0,0,0|1,0,1]=4 3934 B6R0.4 CC(O)\C=C\CO Amb24671370 [1,1,0,0,0,0|1,0,1]=4 3935 B6R0.4 CC(S)CCCO Amb24412207 [1,1,0,0,0,0|1,0,1]=4 3936 B6R0.4 CC(S)CNC=O Amb24388784 [1,1,0,0,0,0|1,0,0]=3 3937 B6R0.4 CC(SCC#N)C Amb17501743 [1,1,0,0,0,0|1,0,1]=4 3938 B6R0.4 CC=C=CC(=O)O Amb17593065 [1,1,0,0,0,0|0,0,2]=4 3939 B6R0.4 CC=NCC(C)O Amb25213778 [1,1,0,0,0,0|2,0,0]=4 3940 B6R0.4 CCC#CC(=O)Cl Amb25857496 [1,1,0,0,0,0|1,0,1]=4 3941 B6R0.4 CCC#CC(N)=O Amb25255265 [1,1,0,0,0,0|1,0,1]=4 3942 B6R0.4 CCC=CC(C)=O Amb22731698 [1,1,0,0,0,0|1,0,1]=4 3943 B6R0.4 CCCC=C(F)F Amb10840483 [1,1,0,0,0,0|2,0,0]=4 3944 B6R0.4 CCCCB(O)O Amb2447142 [1,1,0,0,0,0|1,0,1]=4 3945 B6R0.4 CCCCC(=C)Br Amb22583744 [1,1,0,0,0,0|2,0,0]=4 3946 B6R0.4 CCCCC(=N)N Amb10066937 [1,1,0,0,0,0|2,0,0]=4 3947 B6R0.4 CCCCC(=O)Br Amb22730323 [1,1,0,0,0,0|1,0,0]=3 3948 B6R0.4 CCCCC(N)O Amb24479887 [1,1,0,0,0,0|1,0,1]=4 3949 B6R0.4 CCCCC(O)=S Amb24682342 [1,1,0,0,0,0|0,1,0]=3 3950 B6R0.4 CCCCC(O)O Amb24687253 [1,1,0,0,0,0|0,0,2]=4 3951 B6R0.4 CCCCC(O)S Amb24480485 [1,1,0,0,0,0|0,1,1]=4 3952 B6R0.4 CCCCC([O-])=O Amb19879370 [1,1,0,0,0,0|0,0,1]=3 3953 B6R0.4 CCCCC([O-])=O Amb22056343 [1,1,0,0,0,0|0,0,1]=3 3954 B6R0.4 CCCCC([O-])=O Amb22729192 [1,1,0,0,0,0|0,0,1]=3 3955 B6R0.4 CCCCC([O-])=O Amb22731639 [1,1,0,0,0,0|0,0,1]=3 3956 B6R0.4 CCCCS(=O)Cl Amb24551332 [1,1,0,0,0,0|2,0,0]=4 3957 B6R0.4 CCCCS([O-])=O Amb19889352 [1,1,0,0,0,0|1,0,1]=4 3958 B6R0.4 CCCC[13C](O)=O Amb22367454 [1,1,0,0,0,0|0,0,0]=2 3959 B6R0.4 CCCC[C@@H](C)O Amb19929139 [1,1,0,0,0,0|1,0,1]=4 3960 B6R0.4 CCCC[Sn](=O)S Amb22730994 [1,1,0,0,0,0|1,1,0]=4 3961 B6R0.4 CCCC[Sn](O)=O Amb22336393 [1,1,0,0,0,0|1,0,0]=3 3962 B6R0.4 CCCNC(=N)N Amb10844865 [1,1,0,0,0,0|2,0,0]=4 3963 B6R0.4 CCCNC(=N)N Amb16206147 [1,1,0,0,0,0|2,0,0]=4 3964 B6R0.4 CCCNC(=O)Cl Amb25688616 [1,1,0,0,0,0|1,0,0]=3 3965 B6R0.4 CCCNC(=O)N Amb1152241 [1,1,0,0,0,0|1,0,0]=3 3966 B6R0.4 CCCNC(=S)N Amb1152085 [1,1,0,0,0,0|1,1,0]=4 3967 B6R0.4 CCCNC(C)=S Amb25742111 [1,1,0,0,0,0|1,1,0]=4 3968 B6R0.4 CCCNC(C)O Amb25821613 [1,1,0,0,0,0|1,0,1]=4 3969 B6R0.4 CCCNC(N)=N Amb20667746 [1,1,0,0,0,0|2,0,0]=4 3970 B6R0.4 CCCNC(O)=S Amb25302945 [1,1,0,0,0,0|0,1,0]=3 3971 B6R0.4 CCCNS(C)=O Amb25024775 [1,1,0,0,0,0|2,0,0]=4 3972 B6R0.4 CCCN[N+]([O-])=O Amb21953652 [1,1,0,0,0,0|1,0,1]=4 3973 B6R0.4 CCCOC(=O)Cl Amb10604123 [1,1,0,0,0,0|1,0,0]=3 3974 B6R0.4 CCCOC(N)=S Amb24382119 [1,1,0,0,0,0|1,1,0]=4 3975 B6R0.4 CCCOC([S-])=S Amb22334111 [1,1,0,0,0,0|0,2,0]=4 3976 B6R0.4 CCCOP(O)=O Amb25366595 [1,1,0,0,0,0|1,0,0]=3 3977 B6R0.4 CCCO[N+]([O-])=O Amb22732564 [1,1,0,0,0,0|1,0,1]=4 3978 B6R0.4 CCCSC(C)=O Amb22043301 [1,1,0,0,0,0|1,0,0]=3 3979 B6R0.4 CCCSC(N)=N Amb20676008 [1,1,0,0,0,0|2,0,0]=4 3980 B6R0.4 CCCSC(N)=N Amb23482968 [1,1,0,0,0,0|2,0,0]=4 3981 B6R0.4 CCCSC(N)=S Amb24349580 [1,1,0,0,0,0|1,1,0]=4 3982 B6R0.4 CCNCC(=C)Br Amb18969562 [1,1,0,0,0,0|2,0,0]=4 3983 B6R0.4 CCNCC(=C)Cl Amb18289297 [1,1,0,0,0,0|2,0,0]=4 3984 B6R0.4 CCNCC(=O)N Amb1128676 [1,1,0,0,0,0|1,0,0]=3 3985 B6R0.4 CCNCC(=O)O Amb10609667 [1,1,0,0,0,0|0,0,0]=2 3986 B6R0.4 CCNCC(=S)N Amb17231834 [1,1,0,0,0,0|1,1,0]=4 3987 B6R0.4 CCNCC(C)=O Amb24545893 [1,1,0,0,0,0|1,0,0]=3 3988 B6R0.4 CCNC[C@H](C)O Amb25785620 [1,1,0,0,0,0|1,0,1]=4 3989 B6R0.4 CCOCB(O)O Amb25356792 [1,1,0,0,0,0|1,0,1]=4 3990 B6R0.4 CCOCC(=C)Br Amb24673237 [1,1,0,0,0,0|2,0,0]=4 3991 B6R0.4 CCOCC(C)=C Amb25761593 [1,1,0,0,0,0|2,0,0]=4 3992 B6R0.4 CCOCC(C)C Amb17673917 [1,1,0,0,0,0|1,0,1]=4 3993 B6R0.4 CCOCC(N)=N Amb19890012 [1,1,0,0,0,0|2,0,0]=4 3994 B6R0.4 CCOC[C@H](C)O Amb25067464 [1,1,0,0,0,0|1,0,1]=4 3995 B6R0.4 CCONC(C)=O Amb22230675 [1,1,0,0,0,0|2,0,0]=4 3996 B6R0.4 CCSCC(=O)O Amb1125185 [1,1,0,0,0,0|0,0,0]=2 3997 B6R0.4 CCSCC(C)C Amb22230686 [1,1,0,0,0,0|1,0,1]=4 3998 B6R0.4 CCSCC(C)O Amb24458211 [1,1,0,0,0,0|1,0,1]=4 3999 B6R0.4 CCSCC(N)=O Amb24420234 [1,1,0,0,0,0|1,0,0]=3 4000 B6R0.4 CCSC[C@H](C)O Amb25220206 [1,1,0,0,0,0|1,0,1]=4 4001 B6R0.4 CCSNC(N)=O Amb24479375 [1,1,0,0,0,0|2,0,0]=4 4002 B6R0.4 CC\C=C/C(O)=O Amb22230421 [1,1,0,0,0,0|0,0,1]=3 4003 B6R0.4 CC\C=C\C(N)=O Amb25770876 [1,1,0,0,0,0|1,0,1]=4 4004 B6R0.4 CC\C=N\C(N)=O Amb24479183 [1,1,0,0,0,0|1,0,1]=4 4005 B6R0.4 CN(C)CC=C=O Amb22733182 [1,1,0,0,0,0|1,0,0]=3 4006 B6R0.4 CN(C)CCC=O Amb22001057 [1,1,0,0,0,0|1,0,0]=3 4007 B6R0.4 CN(C)NCCO Amb24467619 [1,1,0,0,0,0|1,0,1]=4 4008 B6R0.4 CN(C)\N=C/C=O Amb25309549 [1,1,0,0,0,0|1,0,1]=4 4009 B6R0.4 CN(C)\N=C\C=O Amb25787405 [1,1,0,0,0,0|1,0,1]=4 4010 B6R0.4 CN=CCC(C)=O Amb25261368 [1,1,0,0,0,0|1,0,1]=4 4011 B6R0.4 CNCCC(=O)O Amb10609760 [1,1,0,0,0,0|0,0,0]=2 4012 B6R0.4 CNCCC(=S)N Amb17231833 [1,1,0,0,0,0|1,1,0]=4 4013 B6R0.4 CNCCC(C)=C Amb18993045 [1,1,0,0,0,0|2,0,0]=4 4014 B6R0.4 CNCCC(C)=O Amb24560306 [1,1,0,0,0,0|1,0,0]=3 4015 B6R0.4 CNCCC(C)C Amb10609494 [1,1,0,0,0,0|1,0,1]=4 4016 B6R0.4 CNCCC(C)C Amb1114399 [1,1,0,0,0,0|1,0,1]=4 4017 B6R0.4 CNCCC(N)=O Amb19959913 [1,1,0,0,0,0|1,0,0]=3 4018 B6R0.4 CNCCC(O)C Amb17569889 [1,1,0,0,0,0|1,0,1]=4 4019 B6R0.4 CNCCS(C)=O Amb21984676 [1,1,0,0,0,0|2,0,0]=4 4020 B6R0.4 CNNCC(N)=O Amb25773971 [1,1,0,0,0,0|2,0,0]=4 4021 B6R0.4 CNNCC(O)=O Amb21929288 [1,1,0,0,0,0|1,0,0]=3 4022 B6R0.4 CNOCC(O)=O Amb25104714 [1,1,0,0,0,0|1,0,0]=3 4023 B6R0.4 COCCC(C)Br Amb18805533 [1,1,0,0,0,0|1,0,1]=4 4024 B6R0.4 COCCC(C)O Amb20621489 [1,1,0,0,0,0|1,0,1]=4 4025 B6R0.4 COCCC(N)O Amb25727188 [1,1,0,0,0,0|1,0,1]=4 4026 B6R0.4 COCCC(O)Br Amb20242943 [1,1,0,0,0,0|1,0,1]=4 4027 B6R0.4 COCCN(=O)=O Amb24126452 [1,1,0,0,0,0|1,0,1]=4 4028 B6R0.4 COCCN(C)C Amb16231530 [1,1,0,0,0,0|1,0,1]=4 4029 B6R0.4 COCNC(C)=O Amb24659843 [1,1,0,0,0,0|2,0,0]=4 4030 B6R0.4 COCNC(N)=O Amb25744350 [1,1,0,0,0,0|2,0,0]=4 4031 B6R0.4 CON=CC(O)=O Amb25292253 [1,1,0,0,0,0|1,0,1]=4 4032 B6R0.4 CONCC(C)C Amb24423170 [1,1,0,0,0,0|1,0,0]=3 4033 B6R0.4 CONC[C@H](C)O Amb25721782 [1,1,0,0,0,0|2,0,0]=4 4034 B6R0.4 CO\C=C\C(O)=O Amb18121767 [1,1,0,0,0,0|0,0,2]=4 4035 B6R0.4 CO\N=C\C(=O)O Amb10976081 [1,1,0,0,0,0|1,0,1]=4 4036 B6R0.4 CS(=O)CCCBr Amb24365916 [1,1,0,0,0,0|2,0,0]=4 4037 B6R0.4 CS(=O)CCCN Amb18974527 [1,1,0,0,0,0|2,0,0]=4 4038 B6R0.4 CSCCC(=S)N Amb17307559 [1,1,0,0,0,0|1,1,0]=4 4039 B6R0.4 CSCCC(N)=N Amb19373501 [1,1,0,0,0,0|2,0,0]=4 4040 B6R0.4 CSCCC(N)=N Amb19516878 [1,1,0,0,0,0|2,0,0]=4 4041 B6R0.4 CSCCC(N)=O Amb24479809 [1,1,0,0,0,0|1,0,0]=3 4042 B6R0.4 CSCCN(=O)=O Amb24179458 [1,1,0,0,0,0|1,0,1]=4 4043 B6R0.4 CSCNC(C)=O Amb24561383 [1,1,0,0,0,0|2,0,0]=4 4044 B6R0.4 CSCNC(C)C Amb24712980 [1,1,0,0,0,0|2,0,0]=4 4045 B6R0.4 CSCNC(N)=O Amb24612362 [1,1,0,0,0,0|2,0,0]=4 4046 B6R0.4 CSCOC(C)=O Amb19884027 [1,1,0,0,0,0|2,0,0]=4 4047 B6R0.4 CSSCC(N)=O Amb24480454 [1,1,0,0,0,0|2,0,0]=4 4048 B6R0.4 CSSCC(O)=O Amb25378801 [1,1,0,0,0,0|1,0,0]=3 4049 B6R0.4 CS\C=C\C(O)=O Amb18641964 [1,1,0,0,0,0|0,0,2]=4 4050 B6R0.4 C[C@@H](Cl)CCC=C Amb25074076 [1,1,0,0,0,0|2,0,0]=4 4051 B6R0.4 C[C@@H](N)CCC=C Amb24670260 [1,1,0,0,0,0|2,0,0]=4 4052 B6R0.4 C[C@@H](O)CC=C=C Amb25098636 [1,1,0,0,0,0|2,0,0]=4 4053 B6R0.4 C[C@@H](O)CCC=C Amb19929324 [1,1,0,0,0,0|2,0,0]=4 4054 B6R0.4 C[C@@H](O)CCCCl Amb22801499 [1,1,0,0,0,0|1,0,1]=4 4055 B6R0.4 C[C@@H](O)CCCN Amb24479875 [1,1,0,0,0,0|1,0,1]=4 4056 B6R0.4 C[C@@H](O)CCCS Amb25794939 [1,1,0,0,0,0|1,0,1]=4 4057 B6R0.4 C[C@@H](O)CNC=O Amb25259151 [1,1,0,0,0,0|1,0,0]=3 4058 B6R0.4 C[C@@H](O)C\C=C\Br Amb25783863 [1,1,0,0,0,0|2,0,0]=4 4059 B6R0.4 C[C@@H](O)C\C=C\Cl Amb25321937 [1,1,0,0,0,0|2,0,0]=4 4060 B6R0.4 C[C@@H](O)\C=C\C=O Amb24404886 [1,1,0,0,0,0|1,0,1]=4 4061 B6R0.4 C[C@@H](O)\C=C\CO Amb24632440 [1,1,0,0,0,0|1,0,1]=4 4062 B6R0.4 C[C@H](Cl)CCCO Amb24525158 [1,1,0,0,0,0|1,0,1]=4 4063 B6R0.4 C[C@H](N)CCC=C Amb24332049 [1,1,0,0,0,0|2,0,0]=4 4064 B6R0.4 C[C@H](N)CCON Amb25041043 [1,1,0,0,0,0|1,0,1]=4 4065 B6R0.4 C[C@H](N)\C=C\CO Amb24700340 [1,1,0,0,0,0|1,0,1]=4 4066 B6R0.4 C[C@H](O)CC=C=C Amb25105924 [1,1,0,0,0,0|2,0,0]=4 4067 B6R0.4 C[C@H](O)CCC=C Amb22226511 [1,1,0,0,0,0|2,0,0]=4 4068 B6R0.4 C[C@H](O)CCCCl Amb22348392 [1,1,0,0,0,0|1,0,1]=4 4069 B6R0.4 C[C@H](O)CNC=O Amb25131739 [1,1,0,0,0,0|1,0,0]=3 4070 B6R0.4 C[C@H](O)COC=O Amb25662147 [1,1,0,0,0,0|1,0,0]=3 4071 B6R0.4 C[C@H](O)C\C=C/Cl Amb25320946 [1,1,0,0,0,0|2,0,0]=4 4072 B6R0.4 C[C@H](O)\C=C\C=O Amb25704114 [1,1,0,0,0,0|1,0,1]=4 4073 B6R0.4 C[C@H](O)\C=C\CO Amb24333195 [1,1,0,0,0,0|1,0,1]=4 4074 B6R0.4 C[SiH](C)OCC=C Amb22230575 [1,1,0,0,0,0|1,1,0]=4 4075 B6R0.4 C[SiH](C)\C=C/C=O Amb24573956 [1,1,0,0,0,0|0,1,1]=4 4076 B6R0.4 C[Si](=O)CCCN Amb22351702 [1,1,0,0,0,0|1,1,0]=4 4077 B6R0.4 C\C(\Br)=C/CC=O Amb25811514 [1,1,0,0,0,0|1,0,1]=4 4078 B6R0.4 C\C=C/CC(C)=O Amb25723218 [1,1,0,0,0,0|1,0,1]=4 4079 B6R0.4 C\C=C/CC(O)=O Amb25692581 [1,1,0,0,0,0|0,0,1]=3 4080 B6R0.4 C\C=C\CC(C)=O Amb24359011 [1,1,0,0,0,0|1,0,1]=4 4081 B6R0.4 C\C=C\CC(C)Br Amb24333875 [1,1,0,0,0,0|2,0,0]=4 4082 B6R0.4 C\C=C\CC(C)Cl Amb25124058 [1,1,0,0,0,0|2,0,0]=4 4083 B6R0.4 C\C=C\CC(C)O Amb24480541 [1,1,0,0,0,0|2,0,0]=4 4084 B6R0.4 C\C=N\CC(O)=O Amb24618330 [1,1,0,0,0,0|0,0,1]=3 4085 B6R0.4 ClCCCC(=O)N Amb1138237 [1,1,0,0,0,0|1,0,0]=3 4086 B6R0.4 ClCCNC(C)C Amb17334075 [1,1,0,0,0,0|1,0,1]=4 4087 B6R0.4 ClCCSC(C)C Amb15694848 [1,1,0,0,0,0|1,0,1]=4 4088 B6R0.4 FCCCC(=O)O Amb17593104 [1,1,0,0,0,0|0,0,0]=2 4089 B6R0.4 N#CCCC(=O)C Amb17334046 [1,1,0,0,0,0|1,0,1]=4 4090 B6R0.4 N#CCCC(=O)Cl Amb25106570 [1,1,0,0,0,0|1,0,1]=4 4091 B6R0.4 N#CNCC(O)=O Amb25173813 [1,1,0,0,0,0|1,0,1]=4 4092 B6R0.4 N#CSCC(O)=O Amb24480976 [1,1,0,0,0,0|1,0,1]=4 4093 B6R0.4 N=CNCC(O)=O Amb24670244 [1,1,0,0,0,0|1,0,1]=4 4094 B6R0.4 NC(=O)CCCBr Amb25779163 [1,1,0,0,0,0|1,0,0]=3 4095 B6R0.4 NC(=O)CCCO Amb20623438 [1,1,0,0,0,0|1,0,0]=3 4096 B6R0.4 NC(=O)CSCCl Amb25135617 [1,1,0,0,0,0|2,0,0]=4 4097 B6R0.4 NC(=O)NCCO Amb1146041 [1,1,0,0,0,0|2,0,0]=4 4098 B6R0.4 NC(=O)OCCBr Amb25145573 [1,1,0,0,0,0|2,0,0]=4 4099 B6R0.4 NC(=O)OCCO Amb20623788 [1,1,0,0,0,0|2,0,0]=4 4100 B6R0.4 NC(=S)CCCF Amb24667655 [1,1,0,0,0,0|1,1,0]=4 4101 B6R0.4 NCC#CC(O)=O Amb25703096 [1,1,0,0,0,0|0,0,2]=4 4102 B6R0.4 NCCCC(=O)Cl Amb1935063 [1,1,0,0,0,0|1,0,0]=3 4103 B6R0.4 NCCCC(=O)N Amb2099583 [1,1,0,0,0,0|1,0,0]=3 4104 B6R0.4 NCCCC(=O)O Amb1935210 [1,1,0,0,0,0|0,0,0]=2 4105 B6R0.4 NCCCC(C)C Amb1136518 [1,1,0,0,0,0|1,0,1]=4 4106 B6R0.4 NCCCC(C)C Amb13952127 [1,1,0,0,0,0|1,0,1]=4 4107 B6R0.4 NCCCC(Cl)=O Amb17801145 [1,1,0,0,0,0|1,0,0]=3 4108 B6R0.4 NCCCC(N)=S Amb24479598 [1,1,0,0,0,0|1,1,0]=4 4109 B6R0.4 NCCCC(N)O Amb25063002 [1,1,0,0,0,0|1,0,1]=4 4110 B6R0.4 NCCCP(O)=O Amb22370049 [1,1,0,0,0,0|1,0,0]=3 4111 B6R0.4 NCCCS(=O)=O Amb24427014 [1,1,0,0,0,0|1,0,1]=4 4112 B6R0.4 NCCCS(O)=O Amb25185942 [1,1,0,0,0,0|1,0,0]=3 4113 B6R0.4 NCCC[N+]([O-])=O Amb18833132 [1,1,0,0,0,0|1,0,1]=4 4114 B6R0.4 NCCNC(N)=O Amb19374121 [1,1,0,0,0,0|2,0,0]=4 4115 B6R0.4 NCCOC(N)=O Amb22059480 [1,1,0,0,0,0|2,0,0]=4 4116 B6R0.4 NCCOC(N)=O Amb24271076 [1,1,0,0,0,0|2,0,0]=4 4117 B6R0.4 NCCOS(O)=O Amb25843211 [1,1,0,0,0,0|2,0,0]=4 4118 B6R0.4 NC\C=C/C(O)=O Amb24117018 [1,1,0,0,0,0|0,0,2]=4 4119 B6R0.4 NC\C=C\C(O)=O Amb18639655 [1,1,0,0,0,0|0,0,2]=4 4120 B6R0.4 NC\C=C\C(O)=O Amb24325004 [1,1,0,0,0,0|0,0,2]=4 4121 B6R0.4 NNCCC(N)=O Amb24406769 [1,1,0,0,0,0|2,0,0]=4 4122 B6R0.4 NOCCC(=O)O Amb17569891 [1,1,0,0,0,0|1,0,0]=3 4123 B6R0.4 NOCCC(C)C Amb17101067 [1,1,0,0,0,0|0,0,1]=3 4124 B6R0.4 NOCCN(C)C Amb17104842 [1,1,0,0,0,0|1,0,1]=4 4125 B6R0.4 O=C(Br)CCCBr Amb25724818 [1,1,0,0,0,0|1,0,0]=3 4126 B6R0.4 O=C(Br)CCCCl Amb25146320 [1,1,0,0,0,0|1,0,0]=3 4127 B6R0.4 O=C(Cl)NCCCl Amb24479815 [1,1,0,0,0,0|2,0,0]=4 4128 B6R0.4 O=C(Cl)OCCF Amb21618836 [1,1,0,0,0,0|2,0,0]=4 4129 B6R0.4 O=C(Cl)SCCCl Amb25272444 [1,1,0,0,0,0|2,0,0]=4 4130 B6R0.4 O=C(S)CCCCl Amb24683280 [1,1,0,0,0,0|0,1,0]=3 4131 B6R0.4 O=CCCC(Cl)Cl Amb25241164 [1,1,0,0,0,0|2,0,0]=4 4132 B6R0.4 O=CCCC(F)F Amb25848573 [1,1,0,0,0,0|2,0,0]=4 4133 B6R0.4 O=CCCC(O)C Amb17593090 [1,1,0,0,0,0|1,0,0]=3 4134 B6R0.4 O=CCOC(=O)C Amb10070247 [1,1,0,0,0,0|1,0,1]=4 4135 B6R0.4 O=CNCC(=O)O Amb1911508 [1,1,0,0,0,0|1,0,1]=4 4136 B6R0.4 O=CNCC(Cl)Cl Amb25760256 [1,1,0,0,0,0|2,0,0]=4 4137 B6R0.4 O=CNN=C(C)C Amb2419224 [1,1,0,0,0,0|1,0,1]=4 4138 B6R0.4 O=COCC(Cl)Cl Amb25778565 [1,1,0,0,0,0|2,0,0]=4 4139 B6R0.4 O=COCC(F)F Amb22008000 [1,1,0,0,0,0|2,0,0]=4 4140 B6R0.4 O=C\C=C\C(C)C Amb13777283 [1,1,0,0,0,0|0,0,1]=3 4141 B6R0.4 O=S(Cl)CCCCl Amb25791632 [1,1,0,0,0,0|2,0,0]=4 4142 B6R0.4 OB(O)CCCBr Amb24480413 [1,1,0,0,0,0|1,0,1]=4 4143 B6R0.4 OC(=O)CCC=O Amb17673897 [1,1,0,0,0,0|0,0,1]=3 4144 B6R0.4 OC(=O)CCCI Amb22295911 [1,1,0,0,0,0|0,0,0]=2 4145 B6R0.4 OC(=O)CCCP Amb24717184 [1,1,0,0,0,0|0,0,0]=2 4146 B6R0.4 OC(=O)CCNCl Amb24437846 [1,1,0,0,0,0|1,0,0]=3 4147 B6R0.4 OC(=O)CN=C=S Amb25024397 [1,1,0,0,0,0|1,0,1]=4 4148 B6R0.4 OC(=O)CSN=O Amb24368923 [1,1,0,0,0,0|2,0,0]=4 4149 B6R0.4 OC(=O)C\C=C\Br Amb24511491 [1,1,0,0,0,0|0,0,2]=4 4150 B6R0.4 OC(=O)C\C=C\Cl Amb25111871 [1,1,0,0,0,0|0,0,2]=4 4151 B6R0.4 OC(=O)C\C=C\I Amb24507704 [1,1,0,0,0,0|0,0,2]=4 4152 B6R0.4 OC(=O)\C=C\CBr Amb18646194 [1,1,0,0,0,0|0,0,2]=4 4153 B6R0.4 OC(=O)\C=C\CCl Amb23399655 [1,1,0,0,0,0|0,0,2]=4 4154 B6R0.4 OC(=O)\C=C\CF Amb24117236 [1,1,0,0,0,0|0,0,2]=4 4155 B6R0.4 OC(=O)\C=C\CI Amb25350297 [1,1,0,0,0,0|0,0,2]=4 4156 B6R0.4 OC(=O)\C=C\CS Amb18285239 [1,1,0,0,0,0|0,0,2]=4 4157 B6R0.4 OCC#CC(O)=O Amb22002375 [1,1,0,0,0,0|0,0,2]=4 4158 B6R0.4 OCC=C=C(C)C Amb17593073 [1,1,0,0,0,0|0,0,2]=4 4159 B6R0.4 OCCCC(=O)O Amb17615189 [1,1,0,0,0,0|0,0,0]=2 4160 B6R0.4 OCCCC(N)C Amb17569888 [1,1,0,0,0,0|1,0,1]=4 4161 B6R0.4 OCCCC(O)=O Amb18640332 [1,1,0,0,0,0|0,0,0]=2 4162 B6R0.4 OCCCC(O)O Amb22802459 [1,1,0,0,0,0|0,0,2]=4 4163 B6R0.4 OCCNS(O)=O Amb25283153 [1,1,0,0,0,0|2,0,0]=4 4164 B6R0.4 OCCOC(=O)S Amb25106059 [1,1,0,0,0,0|1,1,0]=4 4165 B6R0.4 OCCOP(O)=O Amb25739645 [1,1,0,0,0,0|2,0,0]=4 4166 B6R0.4 OCCOS(O)=O Amb17942859 [1,1,0,0,0,0|2,0,0]=4 4167 B6R0.4 ON=NCC(O)=O Amb25204101 [1,1,0,0,0,0|2,0,0]=4 4168 B6R0.4 OP(=O)OCCCl Amb24479734 [1,1,0,0,0,0|2,0,0]=4 4169 B6R0.4 O[13CH2][13CH2][13CH2][13C](O)=O Amb19132555 [1,1,0,0,0,0|0,0,0]=2 4170 B6R0.4 SCCCC(=O)O Amb16185429 [1,1,0,0,0,0|0,0,0]=2 4171 B6R0.4 [C-]#[N+]CCC(N)=O Amb24411954 [1,1,0,0,0,0|1,0,1]=4 4172 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [1,1,0,0,0,0|2,0,0]=4 4173 B6R0.4 [O-]C(=O)OCCBr Amb24394548 [1,1,0,0,0,0|1,0,1]=4 4174 B6R0.4 [O-][N+](=O)CCCCl Amb25267487 [1,1,0,0,0,0|1,0,1]=4 4175 B6R0.4 [O-][N+](=O)CCCF Amb25234942 [1,1,0,0,0,0|1,0,1]=4 4176 B6R0.4 [O-][N+](=O)CCCO Amb20247690 [1,1,0,0,0,0|1,0,1]=4 4177 B6R0.5 BrCCC(C)(C)C Amb10602443 [1,1,0,0,0,0|1,0,1]=4 4178 B6R0.5 C=CC[N+](C)(C)C Amb15692682 [1,1,0,0,0,0|2,0,0]=4 4179 B6R0.5 CC(C)(C)CC#C Amb17845326 [1,1,0,0,0,0|1,0,1]=4 4180 B6R0.5 CC(C)(C)CCS Amb24735600 [1,1,0,0,0,0|0,1,1]=4 4181 B6R0.5 CC(C)(C)CON Amb24757784 [1,1,0,0,0,0|2,0,0]=4 4182 B6R0.5 CC(C)(C)CPCl Amb24738486 [1,1,0,0,0,0|2,0,0]=4 4183 B6R0.5 CC(C)(C)C[Mg]Cl Amb22000591 [1,1,0,0,0,0|2,0,0]=4 4184 B6R0.5 CC(C)(C)C[Zn]I Amb22000498 [1,1,0,0,0,0|2,0,0]=4 4185 B6R0.5 CC(C)(C)NC=O Amb22231350 [1,1,0,0,0,0|1,0,0]=3 4186 B6R0.5 CC(C)(C)NC=S Amb24480652 [1,1,0,0,0,0|1,1,0]=4 4187 B6R0.5 CC(C)(C)NCO Amb25809404 [1,1,0,0,0,0|1,0,1]=4 4188 B6R0.5 CC(C)(C)OC=O Amb22231614 [1,1,0,0,0,0|1,0,0]=3 4189 B6R0.5 CC(C)(C)SC=C Amb24660432 [1,1,0,0,0,0|2,0,0]=4 4190 B6R0.5 CC(C)(C)\C=C\Br Amb24527715 [1,1,0,0,0,0|1,0,1]=4 4191 B6R0.5 CC(C)(C)\C=C\Cl Amb22641466 [1,1,0,0,0,0|1,0,1]=4 4192 B6R0.5 CC(C)(C)\C=N\O Amb25025737 [1,1,0,0,0,0|1,0,1]=4 4193 B6R0.5 CC(C)(Cl)CC#N Amb24479278 [1,1,0,0,0,0|1,0,1]=4 4194 B6R0.5 CC(C)(Cl)CCBr Amb25336800 [1,1,0,0,0,0|1,0,1]=4 4195 B6R0.5 CC(C)(Cl)CCCl Amb22227726 [1,1,0,0,0,0|1,0,1]=4 4196 B6R0.5 CC(C)(Cl)CCO Amb25220241 [1,1,0,0,0,0|0,0,1]=3 4197 B6R0.5 CC(C)(Cl)N=C=O Amb25288337 [1,1,0,0,0,0|1,0,1]=4 4198 B6R0.5 CC(C)(Cl)\C=C\Cl Amb25147358 [1,1,0,0,0,0|1,0,1]=4 4199 B6R0.5 CC(C)(F)CC=O Amb25281907 [1,1,0,0,0,0|0,0,0]=2 4200 B6R0.5 CC(C)(F)CCN Amb25702234 [1,1,0,0,0,0|1,0,1]=4 4201 B6R0.5 CC(C)(F)CCO Amb24748447 [1,1,0,0,0,0|0,0,1]=3 4202 B6R0.5 CC(C)(F)CNN Amb25831224 [1,1,0,0,0,0|2,0,0]=4 4203 B6R0.5 CC(C)(N)C=NO Amb24642026 [1,1,0,0,0,0|1,0,1]=4 4204 B6R0.5 CC(C)(N)CC#N Amb24349750 [1,1,0,0,0,0|1,0,1]=4 4205 B6R0.5 CC(C)(N)CC=O Amb24604793 [1,1,0,0,0,0|0,0,0]=2 4206 B6R0.5 CC(C)(N)CCBr Amb25091021 [1,1,0,0,0,0|1,0,1]=4 4207 B6R0.5 CC(C)(N)CCCl Amb24120443 [1,1,0,0,0,0|1,0,1]=4 4208 B6R0.5 CC(C)(N)CCN Amb23402088 [1,1,0,0,0,0|1,0,1]=4 4209 B6R0.5 CC(C)(N)CCN Amb23402089 [1,1,0,0,0,0|1,0,1]=4 4210 B6R0.5 CC(C)(N)CNN Amb25707664 [1,1,0,0,0,0|2,0,0]=4 4211 B6R0.5 CC(C)(N)CNO Amb25856337 [1,1,0,0,0,0|1,0,0]=3 4212 B6R0.5 CC(C)(N)CON Amb24117958 [1,1,0,0,0,0|2,0,0]=4 4213 B6R0.5 CC(C)(N)\C=C\Cl Amb24532287 [1,1,0,0,0,0|1,0,1]=4 4214 B6R0.5 CC(C)(O)CC#C Amb20622312 [1,1,0,0,0,0|1,0,1]=4 4215 B6R0.5 CC(C)(O)CC#N Amb19651358 [1,1,0,0,0,0|1,0,1]=4 4216 B6R0.5 CC(C)(O)CC=O Amb18121857 [1,1,0,0,0,0|0,0,0]=2 4217 B6R0.5 CC(C)(O)CCBr Amb19958960 [1,1,0,0,0,0|1,0,1]=4 4218 B6R0.5 CC(C)(O)CCI Amb25204597 [1,1,0,0,0,0|1,0,1]=4 4219 B6R0.5 CC(C)(O)CON Amb24408881 [1,1,0,0,0,0|2,0,0]=4 4220 B6R0.5 CC(C)(O)\C=C\Br Amb25337761 [1,1,0,0,0,0|1,0,1]=4 4221 B6R0.5 CC(C)(O)\C=C\Cl Amb24601135 [1,1,0,0,0,0|1,0,1]=4 4222 B6R0.5 CC(C)(S)CCCl Amb25147412 [1,1,0,0,0,0|1,0,1]=4 4223 B6R0.5 CC(C)(S)CCO Amb22337501 [1,1,0,0,0,0|0,0,1]=3 4224 B6R0.5 CC(F)(F)CC=C Amb25223239 [1,1,0,0,0,0|2,0,0]=4 4225 B6R0.5 CC(F)(F)CCO Amb25345980 [1,1,0,0,0,0|1,0,1]=4 4226 B6R0.5 CC=NC(C)(C)C Amb24529509 [1,1,0,0,0,0|2,0,0]=4 4227 B6R0.5 CCCC(C)(C)Br Amb25356766 [1,1,0,0,0,0|1,0,1]=4 4228 B6R0.5 CCCC(C)(C)Cl Amb22052680 [1,1,0,0,0,0|1,0,1]=4 4229 B6R0.5 CCCC(C)(C)S Amb22228869 [1,1,0,0,0,0|1,0,1]=4 4230 B6R0.5 CCCC(N)(C)C Amb13951837 [1,1,0,0,0,0|1,0,1]=4 4231 B6R0.5 CCCC(N)(N)O Amb24616328 [1,1,0,0,0,0|1,0,1]=4 4232 B6R0.5 CCCC(N)(O)O Amb24480396 [1,1,0,0,0,0|0,0,2]=4 4233 B6R0.5 CCCP(=O)(Cl)Cl Amb22053922 [1,1,0,0,0,0|2,0,0]=4 4234 B6R0.5 CCCP(O)(O)=O Amb22230045 [1,1,0,0,0,0|1,0,0]=3 4235 B6R0.5 CCCS(=O)(=O)Br Amb23555502 [1,1,0,0,0,0|1,0,1]=4 4236 B6R0.5 CCCS(=O)(=O)F Amb10610150 [1,1,0,0,0,0|1,0,1]=4 4237 B6R0.5 CCCS(=O)(=O)N Amb1139748 [1,1,0,0,0,0|1,0,1]=4 4238 B6R0.5 CCCS(=O)(=O)[S-] Amb22369121 [1,1,0,0,0,0|1,0,1]=4 4239 B6R0.5 CCNS(O)(=O)=O Amb19650770 [1,1,0,0,0,0|2,0,0]=4 4240 B6R0.5 CCOP(C)(O)=O Amb17673498 [1,1,0,0,0,0|2,0,0]=4 4241 B6R0.5 CCOP(O)(=O)F Amb24609989 [1,1,0,0,0,0|2,0,0]=4 4242 B6R0.5 CCOP(O)(O)=O Amb22230660 [1,1,0,0,0,0|2,0,0]=4 4243 B6R0.5 CN(C)(C)CC=O Amb22349791 [1,1,0,0,0,0|1,0,0]=3 4244 B6R0.5 CN(C)(C)CCO Amb22362815 [1,1,0,0,0,0|1,0,1]=4 4245 B6R0.5 CNCC(C)(C)C Amb10609516 [1,1,0,0,0,0|2,0,0]=4 4246 B6R0.5 CNCC(C)(C)Cl Amb18642040 [1,1,0,0,0,0|2,0,0]=4 4247 B6R0.5 CNCC(C)(C)N Amb18952231 [1,1,0,0,0,0|2,0,0]=4 4248 B6R0.5 CNCC(C)(C)S Amb18640944 [1,1,0,0,0,0|2,0,0]=4 4249 B6R0.5 CNCC(O)(C)C Amb17138360 [1,1,0,0,0,0|2,0,0]=4 4250 B6R0.5 COCC(C)(C)N Amb19406610 [1,1,0,0,0,0|2,0,0]=4 4251 B6R0.5 COCC(O)(C)C Amb16193491 [1,1,0,0,0,0|2,0,0]=4 4252 B6R0.5 COCP(O)(O)=O Amb24580709 [1,1,0,0,0,0|2,0,0]=4 4253 B6R0.5 CP(C)(C)CCO Amb25806636 [1,1,0,0,0,0|1,0,1]=4 4254 B6R0.5 CP(O)(=O)CCO Amb25085578 [1,1,0,0,0,0|2,0,0]=4 4255 B6R0.5 CS(=O)(=O)CC=O Amb23452908 [1,1,0,0,0,0|2,0,0]=4 4256 B6R0.5 CSCC(C)(C)C Amb22733631 [1,1,0,0,0,0|2,0,0]=4 4257 B6R0.5 CSCC(N)(C)C Amb17485957 [1,1,0,0,0,0|2,0,0]=4 4258 B6R0.5 C[Ge](C)(C)CC=C Amb19930237 [1,1,0,0,0,0|1,1,0]=4 4259 B6R0.5 C[N+](C)(C)CC=C Amb22230224 [1,1,0,0,0,0|2,0,0]=4 4260 B6R0.5 C[N+](C)(C)CC=O Amb22735153 [1,1,0,0,0,0|1,0,0]=3 4261 B6R0.5 C[N+](C)(C)CCO Amb19748170 [1,1,0,0,0,0|1,0,1]=4 4262 B6R0.5 C[N+](C)(C)CCO Amb21858155 [1,1,0,0,0,0|1,0,1]=4 4263 B6R0.5 C[N+](C)(C)CCO Amb22353699 [1,1,0,0,0,0|1,0,1]=4 4264 B6R0.5 C[N+](C)(C)CCO Amb22353725 [1,1,0,0,0,0|1,0,1]=4 4265 B6R0.5 C[N+](C)(C)CCO Amb24106508 [1,1,0,0,0,0|1,0,1]=4 4266 B6R0.5 C[N+](C)(C)NC=O Amb24482385 [1,1,0,0,0,0|2,0,0]=4 4267 B6R0.5 C[N+](C)(N)CCO Amb25044464 [1,1,0,0,0,0|1,0,1]=4 4268 B6R0.5 C[N+](C)([13CH3])CCO Amb22338317 [1,1,0,0,0,0|1,0,1]=4 4269 B6R0.5 C[Si](C)(Br)CC=C Amb22337768 [1,1,0,0,0,0|1,1,0]=4 4270 B6R0.5 C[Sn](C)(C)CC=C Amb19894280 [1,1,0,0,0,0|2,0,0]=4 4271 B6R0.5 C\C=C\C(C)(C)C Amb22734233 [1,1,0,0,0,0|1,0,1]=4 4272 B6R0.5 C\C=C\C(C)(C)N Amb18121294 [1,1,0,0,0,0|1,0,1]=4 4273 B6R0.5 C\C=C\C(C)(C)O Amb24699156 [1,1,0,0,0,0|1,0,1]=4 4274 B6R0.5 ClCCC(O)(C)C Amb17610968 [1,1,0,0,0,0|1,0,1]=4 4275 B6R0.5 NCCC(O)(C)C Amb10067081 [1,1,0,0,0,0|1,0,1]=4 4276 B6R0.5 NNCC(O)(C)C Amb13952537 [1,1,0,0,0,0|2,0,0]=4 4277 B6R0.5 O=CCC(F)(F)F Amb19894451 [1,1,0,0,0,0|2,0,0]=4 4278 B6R0.5 O=CC[N+](C)(C)C Amb10069442 [1,1,0,0,0,0|1,0,0]=3 4279 B6R0.5 OCCP(O)(O)=O Amb22388824 [1,1,0,0,0,0|2,0,0]=4 4280 B6R0.5 OCCS(O)(=O)=O Amb22274016 [1,1,0,0,0,0|2,0,0]=4 4281 B6R0.5 OCCS(O)(=O)=O Amb22360755 [1,1,0,0,0,0|2,0,0]=4 4282 B6R0.5 OCCS(O)(=O)=O Amb22751389 [1,1,0,0,0,0|2,0,0]=4 4283 B6R0.5 OCC[N+](C)(C)C Amb16193270 [1,1,0,0,0,0|1,0,1]=4 4284 B6R0.5 ON=CC(C)(C)C Amb10808658 [1,1,0,0,0,0|1,0,1]=4 4285 B6R0.5 OS(=O)(=O)CCBr Amb17938633 [1,1,0,0,0,0|2,0,0]=4 4286 B6R0.5 OS(=O)(=O)CCS Amb22337599 [1,1,0,0,0,0|2,0,0]=4 4287 B6R0.5 OS(=O)(=O)CCS Amb22337676 [1,1,0,0,0,0|2,0,0]=4 4288 B6R0.5 O\N=C/C(N)(C)C Amb2227048 [1,1,0,0,0,0|1,0,1]=4 4289 B6R0.5 [15NH2]CCS(O)(=O)=O Amb22363139 [1,1,0,0,0,0|2,0,0]=4 4290 B6R0.7 CC(=C)C(C)(C)O Amb22228300 [0,1,0,0,1,0|2,0,0]=4 4291 B6R0.7 CC(=O)C(Br)(C)C Amb2389573 [0,1,0,0,1,0|1,0,0]=3 4292 B6R0.7 CC(=O)C(C)(C)F Amb24479081 [0,1,0,0,1,0|1,0,0]=3 4293 B6R0.7 CC(=O)C(C)(C)N Amb22283888 [0,1,0,0,1,0|1,0,0]=3 4294 B6R0.7 CC(=O)C(C)(O)O Amb25237362 [0,1,0,0,1,0|2,0,0]=4 4295 B6R0.7 CC(=O)C(N)(C)C Amb1087903 [0,1,0,0,1,0|1,0,0]=3 4296 B6R0.7 CC(=O)[N+](C)(C)C Amb25737047 [0,1,0,0,1,0|2,0,0]=4 4297 B6R0.7 CC(=O)[Si](C)(C)C Amb19894190 [0,1,0,0,1,0|1,1,0]=4 4298 B6R0.7 CC(C(N)(C)C)O Amb17470362 [0,1,0,0,1,0|1,0,1]=4 4299 B6R0.7 CC(C)(Br)C(=O)Cl Amb18090808 [0,1,0,0,1,0|1,0,0]=3 4300 B6R0.7 CC(C)(C)C(=C)Cl Amb25145025 [0,1,0,0,1,0|2,0,0]=4 4301 B6R0.7 CC(C)(C)C(=N)[NH3+] Amb24122610 [0,1,0,0,1,0|2,0,0]=4 4302 B6R0.7 CC(C)(C)C(=O)Br Amb25684718 [0,1,0,0,1,0|1,0,0]=3 4303 B6R0.7 CC(C)(C)C(=O)S Amb20240548 [0,1,0,0,1,0|0,1,0]=3 4304 B6R0.7 CC(C)(C)C(O)=O Amb22360669 [0,1,0,0,1,0|0,0,0]=2 4305 B6R0.7 CC(C)(C)C(O)O Amb25226243 [0,1,0,0,1,0|0,0,2]=4 4306 B6R0.7 CC(C)(C)C([O-])=O Amb22523341 [0,1,0,0,1,0|0,0,1]=3 4307 B6R0.7 CC(C)(C)C([O-])=O Amb24325153 [0,1,0,0,1,0|0,0,1]=3 4308 B6R0.7 CC(C)(C)S(=O)Cl Amb20670879 [0,1,0,0,1,0|2,0,0]=4 4309 B6R0.7 CC(C)(C)S(O)=O Amb25194337 [0,1,0,0,1,0|1,0,0]=3 4310 B6R0.7 CC(C)(C)[15N+]([O-])=O Amb22367464 [0,1,0,0,1,0|1,0,1]=4 4311 B6R0.7 CC(C)(Cl)C(=O)Cl Amb20668299 [0,1,0,0,1,0|1,0,0]=3 4312 B6R0.7 CC(C)(Cl)C(N)=O Amb24122839 [0,1,0,0,1,0|1,0,0]=3 4313 B6R0.7 CC(C)(F)C(=O)Cl Amb24055889 [0,1,0,0,1,0|1,0,0]=3 4314 B6R0.7 CC(C)(F)C(N)=N Amb25131688 [0,1,0,0,1,0|2,0,0]=4 4315 B6R0.7 CC(C)(F)C(N)=O Amb20671475 [0,1,0,0,1,0|1,0,0]=3 4316 B6R0.7 CC(C)(I)C(N)=O Amb25186301 [0,1,0,0,1,0|1,0,0]=3 4317 B6R0.7 CC(C)(N)C(=O)Cl Amb24479876 [0,1,0,0,1,0|1,0,0]=3 4318 B6R0.7 CC(C)(N)C(N)=N Amb23596457 [0,1,0,0,1,0|2,0,0]=4 4319 B6R0.7 CC(C)(N)C(N)=S Amb19374913 [0,1,0,0,1,0|1,1,0]=4 4320 B6R0.7 CC(C)(N)P(O)=O Amb24479807 [0,1,0,0,1,0|1,0,0]=3 4321 B6R0.7 CC(C)(O)C([O-])=O Amb22343241 [0,1,0,0,1,0|0,0,1]=3 4322 B6R0.7 CC(C)(P)C(O)=O Amb25836244 [0,1,0,0,1,0|0,0,0]=2 4323 B6R0.7 CC(C)(S)C(N)=O Amb25366790 [0,1,0,0,1,0|1,0,0]=3 4324 B6R0.7 CC(C)([15NH2])C(O)=O Amb22367632 [0,1,0,0,1,0|0,0,0]=2 4325 B6R0.7 CC(C)P(=O)(Cl)Cl Amb22047311 [0,1,0,0,1,0|2,0,0]=4 4326 B6R0.7 CC(C)S(=O)(=O)Br Amb23555499 [0,1,0,0,1,0|1,0,1]=4 4327 B6R0.7 CC(C)S(C)(=O)=O Amb22731818 [0,1,0,0,1,0|1,0,1]=4 4328 B6R0.7 CC(C)S([O-])(=O)=O Amb25107958 [0,1,0,0,1,0|1,0,1]=4 4329 B6R0.7 CC(C)[Si](C)(C)O Amb25252163 [0,1,0,0,1,0|1,1,0]=4 4330 B6R0.7 CC(Cl)(Br)C(O)=O Amb24739657 [0,1,0,0,1,0|1,0,0]=3 4331 B6R0.7 CC(Cl)(Cl)C(N)=O Amb22229722 [0,1,0,0,1,0|2,0,0]=4 4332 B6R0.7 CC(Cl)(Cl)C(O)=O Amb22352970 [0,1,0,0,1,0|1,0,0]=3 4333 B6R0.7 CC(Cl)(Cl)C([O-])=O Amb22524772 [0,1,0,0,1,0|1,0,1]=4 4334 B6R0.7 CC(Cl)P(O)(O)=O Amb25774503 [0,1,0,0,1,0|2,0,0]=4 4335 B6R0.7 CC(F)(Br)C(O)=O Amb19895446 [0,1,0,0,1,0|1,0,0]=3 4336 B6R0.7 CC(F)(Cl)C(O)=O Amb22011870 [0,1,0,0,1,0|1,0,0]=3 4337 B6R0.7 CC(F)(F)C(=O)Cl Amb25795425 [0,1,0,0,1,0|2,0,0]=4 4338 B6R0.7 CC(F)(F)C([O-])=O Amb22008197 [0,1,0,0,1,0|1,0,1]=4 4339 B6R0.7 CC(N)(Cl)C(O)=O Amb25040032 [0,1,0,0,1,0|1,0,0]=3 4340 B6R0.7 CC(N)(N)C(O)=O Amb24479882 [0,1,0,0,1,0|1,0,0]=3 4341 B6R0.7 CC(N)S(O)(=O)=O Amb24629730 [0,1,0,0,1,0|2,0,0]=4 4342 B6R0.7 CC(O)(O)C(N)=O Amb24746269 [0,1,0,0,1,0|2,0,0]=4 4343 B6R0.7 CC(O)(O)C(O)=O Amb25337924 [0,1,0,0,1,0|1,0,0]=3 4344 B6R0.7 CC(O)C(C)(C)S Amb24405348 [0,1,0,0,1,0|1,0,1]=4 4345 B6R0.7 CC(O)C(C)(C)[NH3+] Amb24108497 [0,1,0,0,1,0|1,0,1]=4 4346 B6R0.7 CC(O)P(O)(O)=O Amb22832005 [0,1,0,0,1,0|2,0,0]=4 4347 B6R0.7 CC(P)(P)C(O)=O Amb25330045 [0,1,0,0,1,0|1,0,0]=3 4348 B6R0.7 CC(S(=O)(=O)F)C Amb10609990 [0,1,0,0,1,0|1,0,1]=4 4349 B6R0.7 CC(S(=O)(=O)N)C Amb10068444 [0,1,0,0,1,0|1,0,1]=4 4350 B6R0.7 CC(S(=O)N)(C)C Amb10070669 [0,1,0,0,1,0|2,0,0]=4 4351 B6R0.7 CC(S)(S)C(O)=O Amb24687073 [0,1,0,0,1,0|1,0,0]=3 4352 B6R0.7 CN(C)P(O)(O)=O Amb24604756 [0,1,0,0,1,0|2,0,0]=4 4353 B6R0.7 CS(=O)C(C)(C)C Amb22045227 [0,1,0,0,1,0|2,0,0]=4 4354 B6R0.7 C[C@@H](C(C)(C)C)O Amb13952950 [0,1,0,0,1,0|1,0,1]=4 4355 B6R0.7 C[C@@H](O)C(C)(C)O Amb25810584 [0,1,0,0,1,0|1,0,1]=4 4356 B6R0.7 C[C@@](N)(Cl)C(O)=O Amb24479866 [0,1,0,0,1,0|1,0,0]=3 4357 B6R0.7 C[C@@](N)(F)C(O)=O Amb25810196 [0,1,0,0,1,0|1,0,0]=3 4358 B6R0.7 C[C@@](N)(S)C(O)=O Amb25108484 [0,1,0,0,1,0|1,0,0]=3 4359 B6R0.7 C[C@H](C(C)(C)C)O Amb13952951 [0,1,0,0,1,0|1,0,1]=4 4360 B6R0.7 C[C@H](O)C(C)(C)O Amb25809855 [0,1,0,0,1,0|1,0,1]=4 4361 B6R0.7 C[C@](N)(F)C(O)=O Amb24333513 [0,1,0,0,1,0|1,0,0]=3 4362 B6R0.7 NC(=N)C(C)(C)C Amb1146075 [0,1,0,0,1,0|2,0,0]=4 4363 B6R0.7 NC(=O)C(Br)(C)C Amb10071123 [0,1,0,0,1,0|1,0,0]=3 4364 B6R0.7 NC(=O)C(C)(C)C Amb1151239 [0,1,0,0,1,0|1,0,0]=3 4365 B6R0.7 NC(=O)C(F)(F)C Amb10838721 [0,1,0,0,1,0|2,0,0]=4 4366 B6R0.7 NC(=O)C(N)(C)C Amb10608162 [0,1,0,0,1,0|1,0,0]=3 4367 B6R0.7 NC(=O)C(N)(C)C Amb10609802 [0,1,0,0,1,0|1,0,0]=3 4368 B6R0.7 NC(=S)C(C)(C)C Amb1141999 [0,1,0,0,1,0|1,1,0]=4 4369 B6R0.7 OB(C(C)(C)C)O Amb1629697 [0,1,0,0,1,0|1,0,1]=4 4370 B6R0.7 OC(=O)C(Br)(Br)F Amb10839150 [0,1,0,0,1,0|2,0,0]=4 4371 B6R0.7 OC(=O)C(Cl)(Br)Br Amb22732050 [0,1,0,0,1,0|2,0,0]=4 4372 B6R0.7 OC(=O)C(F)(Cl)Br Amb24528668 [0,1,0,0,1,0|2,0,0]=4 4373 B6R0.7 OC(=O)C(F)(Cl)Cl Amb22738911 [0,1,0,0,1,0|2,0,0]=4 4374 B6R0.7 OC(=O)C(F)(F)F Amb16231989 [0,1,0,0,1,0|2,0,0]=4 4375 B6R0.7 OC(=O)C(F)(F)F Amb17608071 [0,1,0,0,1,0|2,0,0]=4 4376 B6R0.7 OC(=O)C(F)(F)F Amb19883782 [0,1,0,0,1,0|2,0,0]=4 4377 B6R0.7 OC(=O)C(F)(F)F Amb22053635 [0,1,0,0,1,0|2,0,0]=4 4378 B6R0.7 OC(=O)C(F)(F)F Amb22353311 [0,1,0,0,1,0|2,0,0]=4 4379 B6R0.7 OC(=O)C(F)(F)F Amb22491943 [0,1,0,0,1,0|2,0,0]=4 4380 B6R0.7 OC(=O)C(F)(F)F Amb22737374 [0,1,0,0,1,0|2,0,0]=4 4381 B6R0.7 OC(=O)C(F)(F)F Amb22740169 [0,1,0,0,1,0|2,0,0]=4 4382 B6R0.7 OC(=O)C(F)(F)F Amb23439505 [0,1,0,0,1,0|2,0,0]=4 4383 B6R0.7 OC(=O)C(F)(F)F Amb25365165 [0,1,0,0,1,0|2,0,0]=4 4384 B6R0.7 OC(=O)C(F)(F)I Amb22738912 [0,1,0,0,1,0|2,0,0]=4 4385 B6R0.7 OC(=O)C(I)(I)I Amb17621003 [0,1,0,0,1,0|2,0,0]=4 4386 B6R0.7 OC(=O)C(O)(C)C Amb1159101 [0,1,0,0,1,0|0,0,0]=2 4387 B6R0.7 OC(=O)C(O)(F)F Amb22351389 [0,1,0,0,1,0|2,0,0]=4 4388 B6R0.7 OC(=O)C(S)(C)C Amb17501520 [0,1,0,0,1,0|0,0,0]=2 4389 B6R0.7 O[13C](=O)C(Br)(Br)Br Amb22367415 [0,1,0,0,1,0|2,0,0]=4 4390 B6R0.7 O[13C](=O)C(Cl)(Br)Br Amb22367328 [0,1,0,0,1,0|2,0,0]=4 4391 B6R0.7 O[13C](=O)C(Cl)(Cl)Cl Amb22351251 [0,1,0,0,1,0|2,0,0]=4 4392 B6R0.7 O[13C](=O)[13C](Cl)(Cl)Cl Amb22056277 [0,1,0,0,1,0|2,0,0]=4 4393 B6R0.7 [2H]C(C)(N)C(O)=O Amb22353531 [0,1,0,0,1,0|1,0,0]=3 4394 B6R0.7 [2H]C(C)(N)[13C](O)=O Amb22367245 [0,1,0,0,1,0|1,0,0]=3 4395 B6R0.7 [2H]C([13CH3])(N)C(O)=O Amb22351832 [0,1,0,0,1,0|1,0,0]=3 4396 B6R0.7 [2H]C([2H])(C)C(O)=O Amb22366992 [0,1,0,0,1,0|1,0,0]=3 4397 B6R0.7 [2H]C([2H])(N)C(O)=O Amb22366882 [0,1,0,0,1,0|2,0,0]=4 4398 B6R0.7 [2H]C([2H])([2H])C(O)=O Amb22362628 [0,1,0,0,1,0|2,0,0]=4 4399 B6R0.7 [2H]C([2H])([2H])[13C](O)=O Amb22732622 [0,1,0,0,1,0|2,0,0]=4 4400 B6R0.7 [2H][13C](C)(N)C(O)=O Amb22367247 [0,1,0,0,1,0|1,0,0]=3 4401 B6R0.7 [2H][13C]([2H])(Br)[13C](O)=O Amb22338931 [0,1,0,0,1,0|2,0,0]=4 4402 B6R0.7 [2H][13C]([2H])([2H])C(O)=O Amb22351444 [0,1,0,0,1,0|2,0,0]=4 4403 B6R0.7 [2H][13C]([2H])([2H])[13C](O)=O Amb22733383 [0,1,0,0,1,0|2,0,0]=4 4404 B6R0.7 [2H][C@@](C)(N)C(O)=O Amb22800178 [0,1,0,0,1,0|1,0,0]=3 4405 B6R0.7 [O-]C(=O)C(C)(C)C Amb16192974 [0,1,0,0,1,0|0,0,1]=3 4406 B8R0.9 BrCC(=O)NCC(C)C Amb10608023 [0,1,0,0,0,1|1,0,0]=3 4407 B8R0.9 C#CC(N)CCC(O)=O Amb22352566 [0,1,0,0,0,1|1,0,1]=4 4408 B8R0.9 C=CC(N)CCC(O)=O Amb22056347 [0,1,0,0,0,1|1,0,1]=4 4409 B8R0.9 C=CC(O)CCC(O)=O Amb25785193 [0,1,0,0,0,1|1,0,1]=4 4410 B8R0.9 C=C[C@H](N)CCC(O)=O Amb25694354 [0,1,0,0,0,1|1,0,1]=4 4411 B8R0.9 CC(=CCC(O)=O)C#N Amb25175102 [0,1,0,0,0,1|0,0,2]=4 4412 B8R0.9 CC(=O)CCC(Br)CCl Amb24480346 [0,1,0,0,0,1|2,0,0]=4 4413 B8R0.9 CC(=O)CCC(Cl)CO Amb25274671 [0,1,0,0,0,1|2,0,0]=4 4414 B8R0.9 CC(=O)CCC(F)CBr Amb25201516 [0,1,0,0,0,1|2,0,0]=4 4415 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,1,0,0,0,1|2,0,0]=4 4416 B8R0.9 CC(=O)CCC(N)CO Amb25257834 [0,1,0,0,0,1|2,0,0]=4 4417 B8R0.9 CC(=O)CCC(O)CCl Amb25118823 [0,1,0,0,0,1|2,0,0]=4 4418 B8R0.9 CC(=O)COC(=O)OC Amb25177471 [0,1,0,0,0,1|1,0,1]=4 4419 B8R0.9 CC(=O)CSC(=O)OC Amb25318847 [0,1,0,0,0,1|1,0,1]=4 4420 B8R0.9 CC(=O)NCC(=O)NO Amb25340085 [0,1,0,0,0,1|1,0,1]=4 4421 B8R0.9 CC(=O)NCC(F)CBr Amb24676009 [0,1,0,0,0,1|2,0,0]=4 4422 B8R0.9 CC(=O)NCC(N)CO Amb25276356 [0,1,0,0,0,1|2,0,0]=4 4423 B8R0.9 CC(=O)NCC(O)CCl Amb22235217 [0,1,0,0,0,1|2,0,0]=4 4424 B8R0.9 CC(=O)NCC(O)CN Amb25139837 [0,1,0,0,0,1|2,0,0]=4 4425 B8R0.9 CC(=O)NCC(O)CO Amb24359036 [0,1,0,0,0,1|2,0,0]=4 4426 B8R0.9 CC(=O)NC[C@@H](O)CCl Amb22746506 [0,1,0,0,0,1|2,0,0]=4 4427 B8R0.9 CC(=O)NC[C@H](O)CCl Amb25760218 [0,1,0,0,0,1|2,0,0]=4 4428 B8R0.9 CC(=O)OCC(Br)CCl Amb24713634 [0,1,0,0,0,1|2,0,0]=4 4429 B8R0.9 CC(=O)OCC(CCl)O Amb17593815 [0,1,0,0,0,1|2,0,0]=4 4430 B8R0.9 CC(=O)OCC(Cl)CBr Amb25113223 [0,1,0,0,0,1|2,0,0]=4 4431 B8R0.9 CC(=O)OCC(Cl)CCl Amb24415406 [0,1,0,0,0,1|2,0,0]=4 4432 B8R0.9 CC(=O)OCC(F)CBr Amb25275153 [0,1,0,0,0,1|2,0,0]=4 4433 B8R0.9 CC(=O)OCC(O)CBr Amb24443015 [0,1,0,0,0,1|2,0,0]=4 4434 B8R0.9 CC(=O)OCC(O)CF Amb24386984 [0,1,0,0,0,1|2,0,0]=4 4435 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,1,0,0,0,1|2,0,0]=4 4436 B8R0.9 CC(=O)OC[C@@H](Cl)CCl Amb24470042 [0,1,0,0,0,1|2,0,0]=4 4437 B8R0.9 CC(=O)OC[C@@H](O)CBr Amb25232647 [0,1,0,0,0,1|2,0,0]=4 4438 B8R0.9 CC(=O)OC[C@H](Cl)CCl Amb25300289 [0,1,0,0,0,1|2,0,0]=4 4439 B8R0.9 CC(=O)SCC(Cl)CCl Amb24572286 [0,1,0,0,0,1|2,0,0]=4 4440 B8R0.9 CC(=O)SCC(N)CO Amb25245383 [0,1,0,0,0,1|2,0,0]=4 4441 B8R0.9 CC(=O)SCC(O)CO Amb25105864 [0,1,0,0,0,1|2,0,0]=4 4442 B8R0.9 CC(Br)COC(=O)CCl Amb25301888 [0,1,0,0,0,1|2,0,0]=4 4443 B8R0.9 CC(Br)COC(=O)CS Amb24680305 [0,1,0,0,0,1|1,1,0]=4 4444 B8R0.9 CC(C#C)OCC(O)=O Amb25092433 [0,1,0,0,0,1|0,0,1]=3 4445 B8R0.9 CC(C#N)NCC(N)=O Amb18981185 [0,1,0,0,0,1|1,0,1]=4 4446 B8R0.9 CC(C#N)NCC(O)=O Amb18293465 [0,1,0,0,0,1|0,0,1]=3 4447 B8R0.9 CC(C#N)SCC(C)=O Amb25134370 [0,1,0,0,0,1|1,0,1]=4 4448 B8R0.9 CC(C#N)SCC(N)=O Amb25691103 [0,1,0,0,0,1|1,0,1]=4 4449 B8R0.9 CC(C#N)SCC(O)=O Amb18293809 [0,1,0,0,0,1|0,0,1]=3 4450 B8R0.9 CC(C)=CCC(=C)C=O Amb25092965 [0,1,0,0,0,1|1,0,1]=4 4451 B8R0.9 CC(C)=CNC(=O)OC Amb25146144 [0,1,0,0,0,1|0,0,2]=4 4452 B8R0.9 CC(C)C=C=C(C)CO Amb25358163 [0,1,0,0,0,1|1,0,1]=4 4453 B8R0.9 CC(C)CCC(=O)C=C Amb25341966 [0,1,0,0,0,1|1,0,0]=3 4454 B8R0.9 CC(C)CCC(=O)CBr Amb24374602 [0,1,0,0,0,1|1,0,0]=3 4455 B8R0.9 CC(C)CCC(=O)CCl Amb20668816 [0,1,0,0,0,1|1,0,0]=3 4456 B8R0.9 CC(C)CCC(=O)CO Amb25053147 [0,1,0,0,0,1|0,0,0]=2 4457 B8R0.9 CC(C)CCC(Br)C=O Amb24480019 [0,1,0,0,0,1|1,0,1]=4 4458 B8R0.9 CC(C)CCC(C)=CBr Amb24425146 [0,1,0,0,0,1|2,0,0]=4 4459 B8R0.9 CC(C)CCC(C)=NN Amb25256965 [0,1,0,0,0,1|2,0,0]=4 4460 B8R0.9 CC(C)CCC(C)=NO Amb25235824 [0,1,0,0,0,1|1,0,0]=3 4461 B8R0.9 CC(C)CCC(C)C=O Amb24478638 [0,1,0,0,0,1|1,0,1]=4 4462 B8R0.9 CC(C)CCC(C)CO Amb24478637 [0,1,0,0,0,1|1,0,1]=4 4463 B8R0.9 CC(C)CCC(C)NO Amb25778747 [0,1,0,0,0,1|1,0,1]=4 4464 B8R0.9 CC(C)CCC(N)CO Amb18832528 [0,1,0,0,0,1|1,0,1]=4 4465 B8R0.9 CC(C)CCC(O)C#C Amb25207509 [0,1,0,0,0,1|1,0,1]=4 4466 B8R0.9 CC(C)CCC(O)C=O Amb24607253 [0,1,0,0,0,1|0,0,1]=3 4467 B8R0.9 CC(C)CCC(O)CC Amb19944686 [0,1,0,0,0,1|1,0,1]=4 4468 B8R0.9 CC(C)CCC(O)OC Amb25320255 [0,1,0,0,0,1|0,0,2]=4 4469 B8R0.9 CC(C)CCN(C)C=O Amb24725180 [0,1,0,0,0,1|2,0,0]=4 4470 B8R0.9 CC(C)CC[C@@H](O)C#C Amb24353164 [0,1,0,0,0,1|1,0,1]=4 4471 B8R0.9 CC(C)CC[C@@H](O)CC Amb25267597 [0,1,0,0,0,1|1,0,1]=4 4472 B8R0.9 CC(C)CC[C@H](C)CO Amb25781634 [0,1,0,0,0,1|1,0,1]=4 4473 B8R0.9 CC(C)CC[C@H](O)C#C Amb24532923 [0,1,0,0,0,1|1,0,1]=4 4474 B8R0.9 CC(C)CC\C(\C)=N/O Amb24547350 [0,1,0,0,0,1|1,0,0]=3 4475 B8R0.9 CC(C)CC\C(\C)=N\O Amb22732538 [0,1,0,0,0,1|1,0,0]=3 4476 B8R0.9 CC(C)CNC(=N)CCl Amb25336484 [0,1,0,0,0,1|2,0,0]=4 4477 B8R0.9 CC(C)CNC(=N)CO Amb23515001 [0,1,0,0,0,1|1,0,0]=3 4478 B8R0.9 CC(C)CNC(=O)CI Amb23447333 [0,1,0,0,0,1|1,0,0]=3 4479 B8R0.9 CC(C)CNC(=O)NCl Amb24465680 [0,1,0,0,0,1|1,0,0]=3 4480 B8R0.9 CC(C)CN[C@@H](C)CO Amb24673564 [0,1,0,0,0,1|1,0,1]=4 4481 B8R0.9 CC(C)COC(=C)CCl Amb24394716 [0,1,0,0,0,1|2,0,0]=4 4482 B8R0.9 CC(C)COC(=O)CBr Amb22036611 [0,1,0,0,0,1|1,0,0]=3 4483 B8R0.9 CC(C)COC(=O)CN Amb19011993 [0,1,0,0,0,1|1,0,0]=3 4484 B8R0.9 CC(C)COC(=O)NN Amb25145008 [0,1,0,0,0,1|1,0,0]=3 4485 B8R0.9 CC(C)COC(=O)NO Amb24481916 [0,1,0,0,0,1|0,0,0]=2 4486 B8R0.9 CC(C)COC(C)CO Amb24395755 [0,1,0,0,0,1|1,0,1]=4 4487 B8R0.9 CC(C)COC(C)ON Amb24481690 [0,1,0,0,0,1|1,0,1]=4 4488 B8R0.9 CC(C)CSC(=S)NN Amb24477801 [0,1,0,0,0,1|1,1,0]=4 4489 B8R0.9 CC(C)CSC(C)C=O Amb25695882 [0,1,0,0,0,1|1,0,1]=4 4490 B8R0.9 CC(C)CSC(N)=NN Amb25346517 [0,1,0,0,0,1|2,0,0]=4 4491 B8R0.9 CC(C)C\C=C(/C)\C=O Amb25055531 [0,1,0,0,0,1|1,0,0]=3 4492 B8R0.9 CC(C)C\C=C(/F)\C=O Amb24631174 [0,1,0,0,0,1|1,0,0]=3 4493 B8R0.9 CC(C)C\C=C(\C)/C=O Amb24573481 [0,1,0,0,0,1|1,0,0]=3 4494 B8R0.9 CC(C)C\C=C(\C)/CBr Amb25288179 [0,1,0,0,0,1|2,0,0]=4 4495 B8R0.9 CC(C)NCC(=C)C#N Amb18642251 [0,1,0,0,0,1|2,0,0]=4 4496 B8R0.9 CC(C)NCC(=O)C#C Amb24746396 [0,1,0,0,0,1|1,0,0]=3 4497 B8R0.9 CC(C)NCC(C)=CBr Amb25065306 [0,1,0,0,0,1|2,0,0]=4 4498 B8R0.9 CC(C)NCC(C)OC Amb19025031 [0,1,0,0,0,1|1,0,1]=4 4499 B8R0.9 CC(C)NCC(N)CO Amb24570954 [0,1,0,0,0,1|1,0,1]=4 4500 B8R0.9 CC(C)NCC(O)C=C Amb24470640 [0,1,0,0,0,1|1,0,1]=4 4501 B8R0.9 CC(C)NCC(O)CBr Amb25717709 [0,1,0,0,0,1|1,0,1]=4 4502 B8R0.9 CC(C)NCC(O)CC Amb18304016 [0,1,0,0,0,1|1,0,1]=4 4503 B8R0.9 CC(C)NCC(O)CCl Amb18644496 [0,1,0,0,0,1|1,0,1]=4 4504 B8R0.9 CC(C)NCC(O)CF Amb24709218 [0,1,0,0,0,1|1,0,1]=4 4505 B8R0.9 CC(C)NCC(O)CN Amb18560964 [0,1,0,0,0,1|1,0,1]=4 4506 B8R0.9 CC(C)NC[C@@H](O)CCl Amb24387963 [0,1,0,0,0,1|1,0,1]=4 4507 B8R0.9 CC(C)NC[C@@H](O)CO Amb22225216 [0,1,0,0,0,1|0,0,2]=4 4508 B8R0.9 CC(C)NC[C@H](O)CO Amb22226523 [0,1,0,0,0,1|0,0,2]=4 4509 B8R0.9 CC(C)NC\C(\C)=C/Cl Amb24340272 [0,1,0,0,0,1|2,0,0]=4 4510 B8R0.9 CC(C)NNC(=O)CN Amb25146096 [0,1,0,0,0,1|2,0,0]=4 4511 B8R0.9 CC(C)OCC(=C)C=O Amb25294437 [0,1,0,0,0,1|1,0,0]=3 4512 B8R0.9 CC(C)OCC(=C)CN Amb24763256 [0,1,0,0,0,1|2,0,0]=4 4513 B8R0.9 CC(C)OCC(=C)CS Amb24350998 [0,1,0,0,0,1|1,1,0]=4 4514 B8R0.9 CC(C)OCC(=C)NN Amb24528632 [0,1,0,0,0,1|2,0,0]=4 4515 B8R0.9 CC(C)OCC(=O)C=C Amb24614526 [0,1,0,0,0,1|1,0,0]=3 4516 B8R0.9 CC(C)OCC(=O)CCl Amb24481789 [0,1,0,0,0,1|1,0,0]=3 4517 B8R0.9 CC(C)OCC(=O)CN Amb24481788 [0,1,0,0,0,1|1,0,0]=3 4518 B8R0.9 CC(C)OCC(Br)C=O Amb25147129 [0,1,0,0,0,1|1,0,1]=4 4519 B8R0.9 CC(C)OCC(Br)CO Amb24635733 [0,1,0,0,0,1|1,0,1]=4 4520 B8R0.9 CC(C)OCC(F)CO Amb25129541 [0,1,0,0,0,1|1,0,1]=4 4521 B8R0.9 CC(C)OCC(N)=NN Amb25776097 [0,1,0,0,0,1|2,0,0]=4 4522 B8R0.9 CC(C)OCC(O)CC Amb25372259 [0,1,0,0,0,1|1,0,1]=4 4523 B8R0.9 CC(C)OCC(O)CCl Amb22359767 [0,1,0,0,0,1|1,0,1]=4 4524 B8R0.9 CC(C)OCC(O)CI Amb20668786 [0,1,0,0,0,1|1,0,1]=4 4525 B8R0.9 CC(C)OCC(O)CO Amb24384701 [0,1,0,0,0,1|0,0,2]=4 4526 B8R0.9 CC(C)OC[C@@H](O)CCl Amb25189071 [0,1,0,0,0,1|1,0,1]=4 4527 B8R0.9 CC(C)OC[C@@H](O)CN Amb25357930 [0,1,0,0,0,1|1,0,1]=4 4528 B8R0.9 CC(C)OC[C@@H](O)CO Amb25042803 [0,1,0,0,0,1|0,0,2]=4 4529 B8R0.9 CC(C)OC\C(\C)=C/Cl Amb24366067 [0,1,0,0,0,1|2,0,0]=4 4530 B8R0.9 CC(C)O\C=C(\Br)/C=O Amb24670208 [0,1,0,0,0,1|1,0,1]=4 4531 B8R0.9 CC(C)O\C=C(\Cl)/C=O Amb24666776 [0,1,0,0,0,1|1,0,1]=4 4532 B8R0.9 CC(C)SCC(=C)CN Amb24349514 [0,1,0,0,0,1|2,0,0]=4 4533 B8R0.9 CC(C)SCC(=O)C#C Amb24479927 [0,1,0,0,0,1|1,0,0]=3 4534 B8R0.9 CC(C)SCC(=O)NO Amb25741291 [0,1,0,0,0,1|0,0,0]=2 4535 B8R0.9 CC(C)SCC(C)=CCl Amb25115633 [0,1,0,0,0,1|2,0,0]=4 4536 B8R0.9 CC(C)SCC(C)CO Amb24739480 [0,1,0,0,0,1|1,0,1]=4 4537 B8R0.9 CC(C)SCC(Cl)=CCl Amb25099625 [0,1,0,0,0,1|2,0,0]=4 4538 B8R0.9 CC(C)SCC(N)=NN Amb25287684 [0,1,0,0,0,1|2,0,0]=4 4539 B8R0.9 CC(C)SCC(N)=NO Amb25771404 [0,1,0,0,0,1|1,0,0]=3 4540 B8R0.9 CC(C)SCC(N)CO Amb25092343 [0,1,0,0,0,1|1,0,1]=4 4541 B8R0.9 CC(C)SCC(O)CN Amb18303997 [0,1,0,0,0,1|1,0,1]=4 4542 B8R0.9 CC(C)SCC(O)CO Amb24379752 [0,1,0,0,0,1|0,0,2]=4 4543 B8R0.9 CC(C)SC[C@@H](O)CN Amb24352373 [0,1,0,0,0,1|1,0,1]=4 4544 B8R0.9 CC(C)SC[C@H](O)CC Amb24363374 [0,1,0,0,0,1|1,0,1]=4 4545 B8R0.9 CC(C)\C=C\C(=C)CO Amb25266823 [0,1,0,0,0,1|1,0,1]=4 4546 B8R0.9 CC(C)\C=C\C(=O)CF Amb24395428 [0,1,0,0,0,1|1,0,1]=4 4547 B8R0.9 CC(C)\C=C\C(=O)NN Amb25090316 [0,1,0,0,0,1|1,0,1]=4 4548 B8R0.9 CC(C=C)NCC(N)=O Amb24592190 [0,1,0,0,0,1|1,0,1]=4 4549 B8R0.9 CC(C=C)NCC(O)=O Amb18310594 [0,1,0,0,0,1|0,0,1]=3 4550 B8R0.9 CC(C=C)OCC(O)=O Amb18642764 [0,1,0,0,0,1|0,0,1]=3 4551 B8R0.9 CC(C=C)SCC(O)=O Amb18311113 [0,1,0,0,0,1|0,0,1]=3 4552 B8R0.9 CC(CBr)CCC(O)=O Amb25806134 [0,1,0,0,0,1|0,0,0]=2 4553 B8R0.9 CC(CBr)COC(C)=O Amb22386917 [0,1,0,0,0,1|1,0,0]=3 4554 B8R0.9 CC(CC)=C=CC(O)=O Amb25378500 [0,1,0,0,0,1|0,0,2]=4 4555 B8R0.9 CC(CCC(C)=O)C#N Amb18642304 [0,1,0,0,0,1|1,0,1]=4 4556 B8R0.9 CC(CCC(C)=O)C=O Amb18642612 [0,1,0,0,0,1|1,0,1]=4 4557 B8R0.9 CC(CCC(N)=O)C#N Amb25146074 [0,1,0,0,0,1|1,0,1]=4 4558 B8R0.9 CC(CCC(N)=O)CN Amb24745140 [0,1,0,0,0,1|1,0,0]=3 4559 B8R0.9 CC(CCC(O)=O)=NN Amb24579336 [0,1,0,0,0,1|1,0,1]=4 4560 B8R0.9 CC(CCC(O)=O)=NO Amb25138471 [0,1,0,0,0,1|1,0,1]=4 4561 B8R0.9 CC(CCC(O)=O)C#N Amb18642500 [0,1,0,0,0,1|0,0,1]=3 4562 B8R0.9 CC(CCC(O)=O)C=C Amb18642631 [0,1,0,0,0,1|0,0,1]=3 4563 B8R0.9 CC(CC\C(=N/O)\N)C Amb10608991 [0,1,0,0,0,1|1,0,0]=3 4564 B8R0.9 CC(CC\C(=N\O)\N)C Amb10205331 [0,1,0,0,0,1|1,0,0]=3 4565 B8R0.9 CC(CCl)CCC(C)=C Amb25068704 [0,1,0,0,0,1|2,0,0]=4 4566 B8R0.9 CC(CCl)OCC(C)=O Amb25118198 [0,1,0,0,0,1|1,0,0]=3 4567 B8R0.9 CC(CCl)OCC(N)=O Amb25789772 [0,1,0,0,0,1|1,0,0]=3 4568 B8R0.9 CC(CN)CCC(O)=O Amb22059189 [0,1,0,0,0,1|0,0,0]=2 4569 B8R0.9 CC(CN)CNC(C)=O Amb18300590 [0,1,0,0,0,1|1,0,0]=3 4570 B8R0.9 CC(CN)NCC(=C)Cl Amb24732228 [0,1,0,0,0,1|2,0,0]=4 4571 B8R0.9 CC(CN)NC[C@H](C)O Amb25044715 [0,1,0,0,0,1|1,0,1]=4 4572 B8R0.9 CC(CN)OCC(C)=C Amb18630505 [0,1,0,0,0,1|2,0,0]=4 4573 B8R0.9 CC(CN)OCC(C)=O Amb18110559 [0,1,0,0,0,1|1,0,0]=3 4574 B8R0.9 CC(CN)OCC(O)=O Amb18629591 [0,1,0,0,0,1|0,0,0]=2 4575 B8R0.9 CC(CN)SCC(=C)Br Amb24391885 [0,1,0,0,0,1|2,0,0]=4 4576 B8R0.9 CC(CN)SCC(=C)Cl Amb25276051 [0,1,0,0,0,1|2,0,0]=4 4577 B8R0.9 CC(CN)SCC(C)O Amb24478776 [0,1,0,0,0,1|1,0,1]=4 4578 B8R0.9 CC(CN)SCC(N)=O Amb24753382 [0,1,0,0,0,1|1,0,0]=3 4579 B8R0.9 CC(CNC(=O)CBr)O Amb17322852 [0,1,0,0,0,1|2,0,0]=4 4580 B8R0.9 CC(CNC(=O)CCl)O Amb17324265 [0,1,0,0,0,1|2,0,0]=4 4581 B8R0.9 CC(CNC(N)=O)CN Amb18994081 [0,1,0,0,0,1|1,0,0]=3 4582 B8R0.9 CC(CO)CCC(C)=C Amb24389869 [0,1,0,0,0,1|2,0,0]=4 4583 B8R0.9 CC(CO)CN=C(C)N Amb24349921 [0,1,0,0,0,1|2,0,0]=4 4584 B8R0.9 CC(CO)CNC(C)=O Amb25050315 [0,1,0,0,0,1|1,0,0]=3 4585 B8R0.9 CC(CO)CNC(N)=O Amb18832521 [0,1,0,0,0,1|1,0,0]=3 4586 B8R0.9 CC(CO)CSC(C)=O Amb24466300 [0,1,0,0,0,1|1,0,0]=3 4587 B8R0.9 CC(CO)NCC(=C)Br Amb18303323 [0,1,0,0,0,1|2,0,0]=4 4588 B8R0.9 CC(CO)NCC(=C)Cl Amb18303324 [0,1,0,0,0,1|2,0,0]=4 4589 B8R0.9 CC(CO)NCC(C)=C Amb25289088 [0,1,0,0,0,1|2,0,0]=4 4590 B8R0.9 CC(CO)OCC(O)=O Amb25675017 [0,1,0,0,0,1|0,0,0]=2 4591 B8R0.9 CC(CO)SCC(=C)Br Amb25204830 [0,1,0,0,0,1|2,0,0]=4 4592 B8R0.9 CC(CO)SCC(C)=O Amb25195670 [0,1,0,0,0,1|1,0,0]=3 4593 B8R0.9 CC(CO)SCC(O)=O Amb18644427 [0,1,0,0,0,1|0,0,0]=2 4594 B8R0.9 CC(COC(C)=O)C#N Amb24395253 [0,1,0,0,0,1|1,0,1]=4 4595 B8R0.9 CC(COC(C)=O)C=O Amb18642789 [0,1,0,0,0,1|1,0,1]=4 4596 B8R0.9 CC(COC(C)=O)NN Amb24439584 [0,1,0,0,0,1|2,0,0]=4 4597 B8R0.9 CC(Cl)CNC(=O)CCl Amb24480042 [0,1,0,0,0,1|2,0,0]=4 4598 B8R0.9 CC(Cl)COC(=O)CCl Amb24710935 [0,1,0,0,0,1|2,0,0]=4 4599 B8R0.9 CC(Cl)COC(=O)CS Amb25061264 [0,1,0,0,0,1|1,1,0]=4 4600 B8R0.9 CC(N)CCC(=O)C#C Amb24401215 [0,1,0,0,0,1|2,0,0]=4 4601 B8R0.9 CC(N)CNC(=O)CN Amb24721129 [0,1,0,0,0,1|2,0,0]=4 4602 B8R0.9 CC(O)CCC(=O)NN Amb19748590 [0,1,0,0,0,1|2,0,0]=4 4603 B8R0.9 CC(O)CCC(C)=NO Amb24749620 [0,1,0,0,0,1|2,0,0]=4 4604 B8R0.9 CC(O)CCC(O)C=O Amb18642880 [0,1,0,0,0,1|1,0,1]=4 4605 B8R0.9 CC(O)CNC(=O)CO Amb25703101 [0,1,0,0,0,1|1,0,0]=3 4606 B8R0.9 CC(O)CNC(=O)CS Amb24744011 [0,1,0,0,0,1|1,1,0]=4 4607 B8R0.9 CC(O)CNC(C)CO Amb19005093 [0,1,0,0,0,1|1,0,1]=4 4608 B8R0.9 CC(O)COC(=O)CBr Amb25253067 [0,1,0,0,0,1|2,0,0]=4 4609 B8R0.9 CC(O)COC(C)CO Amb22167327 [0,1,0,0,0,1|1,0,1]=4 4610 B8R0.9 CC(O)CO[C@H](C)CO Amb25343738 [0,1,0,0,0,1|1,0,1]=4 4611 B8R0.9 CC(O)C\C=C(/Br)\C=O Amb24388944 [0,1,0,0,0,1|2,0,0]=4 4612 B8R0.9 CC(ON)CNC(=O)C Amb17138377 [0,1,0,0,0,1|2,0,0]=4 4613 B8R0.9 CCC(=N)NCC(C)C Amb25749440 [0,1,0,0,0,1|2,0,0]=4 4614 B8R0.9 CCC(=O)C#CC(C)C Amb25320012 [0,1,0,0,0,1|1,0,1]=4 4615 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,1,0,0,0,1|1,0,1]=4 4616 B8R0.9 CCC(=O)CCC(C)Cl Amb24571703 [0,1,0,0,0,1|2,0,0]=4 4617 B8R0.9 CCC(=O)CCN(C)C Amb24444934 [0,1,0,0,0,1|2,0,0]=4 4618 B8R0.9 CCC(=O)CO[SiH](C)C Amb24722809 [0,1,0,0,0,1|1,1,0]=4 4619 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,1,0,0,0,1|1,0,1]=4 4620 B8R0.9 CCC(=O)NCC(C)C Amb17798304 [0,1,0,0,0,1|1,0,0]=3 4621 B8R0.9 CCC(=O)NCC(C)N Amb18631378 [0,1,0,0,0,1|2,0,0]=4 4622 B8R0.9 CCC(=O)NC[C@@H](C)O Amb25297640 [0,1,0,0,0,1|2,0,0]=4 4623 B8R0.9 CCC(=O)NOC(C)C Amb24614549 [0,1,0,0,0,1|2,0,0]=4 4624 B8R0.9 CCC(=O)OCC(C)Cl Amb24729543 [0,1,0,0,0,1|2,0,0]=4 4625 B8R0.9 CCC(=O)OCC(O)=O Amb18642872 [0,1,0,0,0,1|1,0,1]=4 4626 B8R0.9 CCC(=O)SCC(C)Br Amb24398920 [0,1,0,0,0,1|2,0,0]=4 4627 B8R0.9 CCC(=O)\C=C\C(C)C Amb24627284 [0,1,0,0,0,1|1,0,1]=4 4628 B8R0.9 CCC(=O)\C=N\C(C)C Amb24339763 [0,1,0,0,0,1|1,0,1]=4 4629 B8R0.9 CCC(=S)NCC(C)C Amb25840022 [0,1,0,0,0,1|1,1,0]=4 4630 B8R0.9 CCC(=S)SCC(O)=O Amb24480232 [0,1,0,0,0,1|1,0,1]=4 4631 B8R0.9 CCC(Br)CCC(=O)Cl Amb25352038 [0,1,0,0,0,1|2,0,0]=4 4632 B8R0.9 CCC(Br)CCC(C)=O Amb24480025 [0,1,0,0,0,1|2,0,0]=4 4633 B8R0.9 CCC(Br)\C=C\C(O)=O Amb18651360 [0,1,0,0,0,1|1,0,1]=4 4634 B8R0.9 CCC(C)=CCC(C)=O Amb24736154 [0,1,0,0,0,1|1,0,1]=4 4635 B8R0.9 CCC(C)C=CC(C)=O Amb24062970 [0,1,0,0,0,1|1,0,1]=4 4636 B8R0.9 CCC(C)CCB(O)O Amb25063737 [0,1,0,0,0,1|1,0,1]=4 4637 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,1,0,0,0,1|1,0,0]=3 4638 B8R0.9 CCC(C)CCC(C)O Amb22732215 [0,1,0,0,0,1|1,0,1]=4 4639 B8R0.9 CCC(C)CCC(O)=O Amb22352932 [0,1,0,0,0,1|0,0,0]=2 4640 B8R0.9 CCC(C)CNC(C)=N Amb25770210 [0,1,0,0,0,1|2,0,0]=4 4641 B8R0.9 CCC(C)CNC(N)=N Amb25810483 [0,1,0,0,0,1|2,0,0]=4 4642 B8R0.9 CCC(C)CNC(N)=S Amb24436213 [0,1,0,0,0,1|1,1,0]=4 4643 B8R0.9 CCC(C)COC(=O)Cl Amb20246588 [0,1,0,0,0,1|1,0,0]=3 4644 B8R0.9 CCC(C)COC(C)=O Amb20621577 [0,1,0,0,0,1|1,0,0]=3 4645 B8R0.9 CCC(C)COC(N)=O Amb25188918 [0,1,0,0,0,1|1,0,0]=3 4646 B8R0.9 CCC(C)CSC(N)=N Amb25306741 [0,1,0,0,0,1|2,0,0]=4 4647 B8R0.9 CCC(C)NCC(=C)Br Amb19005214 [0,1,0,0,0,1|2,0,0]=4 4648 B8R0.9 CCC(C)NCC(=C)Cl Amb19004829 [0,1,0,0,0,1|2,0,0]=4 4649 B8R0.9 CCC(C)NCC(C)=O Amb25062894 [0,1,0,0,0,1|1,0,0]=3 4650 B8R0.9 CCC(C)OCC(=C)Br Amb24740504 [0,1,0,0,0,1|2,0,0]=4 4651 B8R0.9 CCC(C)OCC(N)=N Amb24501524 [0,1,0,0,0,1|2,0,0]=4 4652 B8R0.9 CCC(C)OCC(O)=O Amb18307944 [0,1,0,0,0,1|0,0,0]=2 4653 B8R0.9 CCC(C)ONC(C)=O Amb24360136 [0,1,0,0,0,1|2,0,0]=4 4654 B8R0.9 CCC(C)ONC(N)=O Amb24618660 [0,1,0,0,0,1|2,0,0]=4 4655 B8R0.9 CCC(C)SCC(=C)Br Amb25696158 [0,1,0,0,0,1|2,0,0]=4 4656 B8R0.9 CCC(C)SCC(C)O Amb24738776 [0,1,0,0,0,1|1,0,1]=4 4657 B8R0.9 CCC(C)SC[C@@H](C)O Amb25283171 [0,1,0,0,0,1|1,0,1]=4 4658 B8R0.9 CCC(C)\C=C\C(O)=O Amb18988312 [0,1,0,0,0,1|0,0,1]=3 4659 B8R0.9 CCC(Cl)=CCC(O)=O Amb24580821 [0,1,0,0,0,1|1,0,1]=4 4660 B8R0.9 CCC(Cl)CCC(=O)Cl Amb24524189 [0,1,0,0,0,1|2,0,0]=4 4661 B8R0.9 CCC(Cl)CNC(C)=O Amb25292231 [0,1,0,0,0,1|2,0,0]=4 4662 B8R0.9 CCC(Cl)COC(N)=O Amb22274267 [0,1,0,0,0,1|2,0,0]=4 4663 B8R0.9 CCC(Cl)\C=C\C(O)=O Amb24714953 [0,1,0,0,0,1|1,0,1]=4 4664 B8R0.9 CCC(F)COC(C)=O Amb24361428 [0,1,0,0,0,1|2,0,0]=4 4665 B8R0.9 CCC(N)CCC(O)=O Amb21961489 [0,1,0,0,0,1|1,0,0]=3 4666 B8R0.9 CCC(N)CNC(C)=O Amb25256213 [0,1,0,0,0,1|2,0,0]=4 4667 B8R0.9 CCC(NCC(=C)C)C Amb17308623 [0,1,0,0,0,1|2,0,0]=4 4668 B8R0.9 CCC(O)CCC(C)=O Amb24586292 [0,1,0,0,0,1|2,0,0]=4 4669 B8R0.9 CCC(O)CNC(C)=O Amb24715716 [0,1,0,0,0,1|2,0,0]=4 4670 B8R0.9 CCC(O)NCC(O)=O Amb24445948 [0,1,0,0,0,1|1,0,0]=3 4671 B8R0.9 CCC(O)\C=C\C(O)=O Amb25328660 [0,1,0,0,0,1|1,0,1]=4 4672 B8R0.9 CCC(S)\C=C\C(O)=O Amb18124688 [0,1,0,0,0,1|1,0,1]=4 4673 B8R0.9 CCS(=O)CCC(C)C Amb24448788 [0,1,0,0,0,1|2,0,0]=4 4674 B8R0.9 CCS(=O)NCC(C)C Amb24597114 [0,1,0,0,0,1|2,0,0]=4 4675 B8R0.9 CC[C@@H](C)CCC(C)=O Amb24749043 [0,1,0,0,0,1|1,0,0]=3 4676 B8R0.9 CC[C@@H](C)CC[C@@H](C)O Amb22896942 [0,1,0,0,0,1|1,0,1]=4 4677 B8R0.9 CC[C@@H](C)CC[C@H](C)O Amb22896941 [0,1,0,0,0,1|1,0,1]=4 4678 B8R0.9 CC[C@@H](C)COC(N)=O Amb24586795 [0,1,0,0,0,1|1,0,0]=3 4679 B8R0.9 CC[C@@H](C)\C=C\C(O)=O Amb24117189 [0,1,0,0,0,1|0,0,1]=3 4680 B8R0.9 CC[C@@H](N)CCC(O)=O Amb25065764 [0,1,0,0,0,1|1,0,0]=3 4681 B8R0.9 CC[C@@H](O)C#CC(O)=O Amb25785824 [0,1,0,0,0,1|1,0,1]=4 4682 B8R0.9 CC[C@H](C)CC[C@@H](C)O Amb25055436 [0,1,0,0,0,1|1,0,1]=4 4683 B8R0.9 CC[C@H](C)COC(N)=O Amb24333141 [0,1,0,0,0,1|1,0,0]=3 4684 B8R0.9 CC[C@H](C)NCC(O)=O Amb25076151 [0,1,0,0,0,1|0,0,0]=2 4685 B8R0.9 CC[C@H](C)OCC(O)=O Amb25320561 [0,1,0,0,0,1|0,0,0]=2 4686 B8R0.9 CC[C@H](N)CCC(O)=O Amb25835678 [0,1,0,0,0,1|1,0,0]=3 4687 B8R0.9 CC[C@H](O)CCC(N)=O Amb25785287 [0,1,0,0,0,1|2,0,0]=4 4688 B8R0.9 CC[S+](C)CCC(O)=O Amb25794477 [0,1,0,0,0,1|1,0,0]=3 4689 B8R0.9 CC\C(\C)=C/CC(C)=O Amb24333826 [0,1,0,0,0,1|1,0,1]=4 4690 B8R0.9 CC\C(\C)=C\CC(C)=O Amb25773428 [0,1,0,0,0,1|1,0,1]=4 4691 B8R0.9 CN(C)CCC(=O)CS Amb25217335 [0,1,0,0,0,1|1,1,0]=4 4692 B8R0.9 CN(C)CNC(=O)C=C Amb25032104 [0,1,0,0,0,1|2,0,0]=4 4693 B8R0.9 CN(C)NCC(N)=NO Amb24434454 [0,1,0,0,0,1|2,0,0]=4 4694 B8R0.9 CN(CCC(O)=O)C=O Amb18984989 [0,1,0,0,0,1|1,0,1]=4 4695 B8R0.9 CN(CCC(O)=O)N=O Amb22729196 [0,1,0,0,0,1|2,0,0]=4 4696 B8R0.9 CN=C(N)SCC(C)C Amb24476741 [0,1,0,0,0,1|2,0,0]=4 4697 B8R0.9 CNC(=N)CCC(C)C Amb25303718 [0,1,0,0,0,1|2,0,0]=4 4698 B8R0.9 CNC(=N)COC(C)C Amb25321255 [0,1,0,0,0,1|2,0,0]=4 4699 B8R0.9 CNC(=N)NCC(O)=O Amb24655458 [0,1,0,0,0,1|1,0,1]=4 4700 B8R0.9 CNC(=N)SCC(O)=O Amb24403395 [0,1,0,0,0,1|1,0,1]=4 4701 B8R0.9 CNC(=O)CCC(C)Cl Amb25851798 [0,1,0,0,0,1|2,0,0]=4 4702 B8R0.9 CNC(=O)CCC(C)N Amb24477857 [0,1,0,0,0,1|2,0,0]=4 4703 B8R0.9 CNC(=O)CCC(O)C Amb17334125 [0,1,0,0,0,1|2,0,0]=4 4704 B8R0.9 CNC(=O)CCN(C)C Amb24735586 [0,1,0,0,0,1|2,0,0]=4 4705 B8R0.9 CNC(=O)CNC(O)=O Amb24740399 [0,1,0,0,0,1|1,0,1]=4 4706 B8R0.9 CNC(=O)COC(C)C Amb24481787 [0,1,0,0,0,1|1,0,0]=3 4707 B8R0.9 CNC(=O)CSC(C)C Amb25146039 [0,1,0,0,0,1|1,0,0]=3 4708 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,1,0,0,0,1|1,0,1]=4 4709 B8R0.9 CNC(=O)NCC(C)C Amb2132759 [0,1,0,0,0,1|1,0,0]=3 4710 B8R0.9 CNC(=O)NOC(C)C Amb24432071 [0,1,0,0,0,1|2,0,0]=4 4711 B8R0.9 CNC(=O)SCC(C)C Amb24454948 [0,1,0,0,0,1|1,0,0]=3 4712 B8R0.9 CNC(=O)SCC(O)=O Amb24763198 [0,1,0,0,0,1|1,0,1]=4 4713 B8R0.9 CNC(=S)SCC(O)=O Amb24649902 [0,1,0,0,0,1|1,0,1]=4 4714 B8R0.9 CNC(C)CCC(O)=O Amb25339418 [0,1,0,0,0,1|0,0,0]=2 4715 B8R0.9 CNC(C)CNC(N)=O Amb24405703 [0,1,0,0,0,1|1,0,0]=3 4716 B8R0.9 CNC(C)CNS(C)=O Amb24753150 [0,1,0,0,0,1|2,0,0]=4 4717 B8R0.9 COC(=N)CCN(C)C Amb25278317 [0,1,0,0,0,1|2,0,0]=4 4718 B8R0.9 COC(=N)COC(C)C Amb25725252 [0,1,0,0,0,1|1,0,0]=3 4719 B8R0.9 COC(=N)CSC(C)C Amb25321840 [0,1,0,0,0,1|1,0,0]=3 4720 B8R0.9 COC(=O)C#CC(C)O Amb24475136 [0,1,0,0,0,1|1,0,1]=4 4721 B8R0.9 COC(=O)CCC(=O)C Amb13777321 [0,1,0,0,0,1|1,0,1]=4 4722 B8R0.9 COC(=O)CCC(C)Br Amb24340280 [0,1,0,0,0,1|1,0,0]=3 4723 B8R0.9 COC(=O)CCC(C)Cl Amb24644384 [0,1,0,0,0,1|1,0,0]=3 4724 B8R0.9 COC(=O)CCC(C)N Amb18642842 [0,1,0,0,0,1|1,0,0]=3 4725 B8R0.9 COC(=O)CCC(Cl)Cl Amb25295532 [0,1,0,0,0,1|2,0,0]=4 4726 B8R0.9 COC(=O)CC[C@@H](C)Cl Amb24480241 [0,1,0,0,0,1|1,0,0]=3 4727 B8R0.9 COC(=O)CC[C@@H](C)N Amb24117060 [0,1,0,0,0,1|1,0,0]=3 4728 B8R0.9 COC(=O)CC[C@@H](C)O Amb22388487 [0,1,0,0,0,1|1,0,0]=3 4729 B8R0.9 COC(=O)CC[C@H](C)O Amb24351118 [0,1,0,0,0,1|1,0,0]=3 4730 B8R0.9 COC(=O)CNN(C)C Amb24693623 [0,1,0,0,0,1|1,0,0]=3 4731 B8R0.9 COC(=O)CNS(C)=O Amb24536728 [0,1,0,0,0,1|2,0,0]=4 4732 B8R0.9 COC(=O)COC(Cl)Cl Amb22230457 [0,1,0,0,0,1|2,0,0]=4 4733 B8R0.9 COC(=O)CSC(C)O Amb25032211 [0,1,0,0,0,1|1,0,0]=3 4734 B8R0.9 COC(=O)CSC(F)F Amb25834011 [0,1,0,0,0,1|2,0,0]=4 4735 B8R0.9 COC(=O)N=NC(C)N Amb25062994 [0,1,0,0,0,1|2,0,0]=4 4736 B8R0.9 COC(=O)NCC(C)C Amb17861777 [0,1,0,0,0,1|0,0,0]=2 4737 B8R0.9 COC(=O)NCC(F)F Amb24657916 [0,1,0,0,0,1|2,0,0]=4 4738 B8R0.9 COC(=O)NC[C@H](C)O Amb25111936 [0,1,0,0,0,1|1,0,0]=3 4739 B8R0.9 COC(=O)NNC(C)C Amb22496456 [0,1,0,0,0,1|1,0,0]=3 4740 B8R0.9 COC(=O)OCC(C)C Amb24416487 [0,1,0,0,0,1|0,0,0]=2 4741 B8R0.9 COC(=O)OCC(F)F Amb24088551 [0,1,0,0,0,1|2,0,0]=4 4742 B8R0.9 COC(=O)\C=C/C(C)C Amb10842318 [0,1,0,0,0,1|0,0,1]=3 4743 B8R0.9 COC(=O)\C=C\C(C)Br Amb25326817 [0,1,0,0,0,1|1,0,1]=4 4744 B8R0.9 COC(=O)\C=C\C(C)N Amb25212213 [0,1,0,0,0,1|1,0,1]=4 4745 B8R0.9 COC(=O)\C=C\N(C)C Amb15692783 [0,1,0,0,0,1|1,0,1]=4 4746 B8R0.9 COC(=O)\C=C\[C@@H](C)O Amb24446167 [0,1,0,0,0,1|1,0,1]=4 4747 B8R0.9 COC(=O)\C=C\[C@H](C)N Amb25797312 [0,1,0,0,0,1|1,0,1]=4 4748 B8R0.9 COC(=S)NCC(C)C Amb24400051 [0,1,0,0,0,1|0,1,0]=3 4749 B8R0.9 COC(=S)NCC(O)=O Amb25146013 [0,1,0,0,0,1|1,0,1]=4 4750 B8R0.9 COC(=S)SCC(C)O Amb24575769 [0,1,0,0,0,1|1,1,0]=4 4751 B8R0.9 COC(C)CCC(O)=O Amb24271104 [0,1,0,0,0,1|0,0,0]=2 4752 B8R0.9 COC(C)CNC(C)=O Amb24574997 [0,1,0,0,0,1|1,0,0]=3 4753 B8R0.9 COC(C)CNC(N)=N Amb24459639 [0,1,0,0,0,1|2,0,0]=4 4754 B8R0.9 COC(C)CNS(C)=O Amb25359541 [0,1,0,0,0,1|2,0,0]=4 4755 B8R0.9 COC(C)COC(C)=O Amb22734341 [0,1,0,0,0,1|1,0,0]=3 4756 B8R0.9 COC(C)OCC(C)=O Amb24378350 [0,1,0,0,0,1|1,0,0]=3 4757 B8R0.9 COC(C)OCC(C)O Amb25284474 [0,1,0,0,0,1|1,0,1]=4 4758 B8R0.9 COC(C)OCC(O)=O Amb24417299 [0,1,0,0,0,1|0,0,0]=2 4759 B8R0.9 COP(O)CCC(O)=O Amb22734636 [0,1,0,0,0,1|2,0,0]=4 4760 B8R0.9 CO[C@H](C)CCC(O)=O Amb24383667 [0,1,0,0,0,1|0,0,0]=2 4761 B8R0.9 CO\C(\O)=C/CN(C)C Amb24100291 [0,1,0,0,0,1|1,0,1]=4 4762 B8R0.9 CSC(=O)CCC(C)C Amb25743840 [0,1,0,0,0,1|0,1,0]=3 4763 B8R0.9 CSC(=O)NCC(C)C Amb24476657 [0,1,0,0,0,1|0,1,0]=3 4764 B8R0.9 CSC(=S)OCC(O)=O Amb25065342 [0,1,0,0,0,1|1,0,1]=4 4765 B8R0.9 CSC(=S)SCC(O)=O Amb24479938 [0,1,0,0,0,1|1,0,1]=4 4766 B8R0.9 CSC(C)CCC(O)=O Amb22059071 [0,1,0,0,0,1|0,0,0]=2 4767 B8R0.9 CSC(C)CNC(C)=O Amb25744770 [0,1,0,0,0,1|1,0,0]=3 4768 B8R0.9 CSC(C)CNC(N)=O Amb25688045 [0,1,0,0,0,1|1,0,0]=3 4769 B8R0.9 C[C@@H](CBr)CCC(O)=O Amb24458738 [0,1,0,0,0,1|0,0,0]=2 4770 B8R0.9 C[C@@H](CBr)COC(C)=O Amb24373843 [0,1,0,0,0,1|1,0,0]=3 4771 B8R0.9 C[C@@H](CC)CCC(=O)O Amb16231507 [0,1,0,0,0,1|0,0,0]=2 4772 B8R0.9 C[C@@H](CCC(C)=O)C=O Amb24441758 [0,1,0,0,0,1|1,0,1]=4 4773 B8R0.9 C[C@@H](CCC(O)=O)C=C Amb25859365 [0,1,0,0,0,1|0,0,1]=3 4774 B8R0.9 C[C@@H](CO)NCC(C)=O Amb24693447 [0,1,0,0,0,1|1,0,0]=3 4775 B8R0.9 C[C@@H](N)COC(=O)CN Amb25848264 [0,1,0,0,0,1|2,0,0]=4 4776 B8R0.9 C[C@@H](O)CC[C@H](C)CO Amb25271414 [0,1,0,0,0,1|1,0,1]=4 4777 B8R0.9 C[C@@H](O)CNC(=O)C#C Amb25185202 [0,1,0,0,0,1|2,0,0]=4 4778 B8R0.9 C[C@@H](O)CN[C@@H](C)CO Amb25112017 [0,1,0,0,0,1|1,0,1]=4 4779 B8R0.9 C[C@H](CCC(O)=O)C#C Amb25250566 [0,1,0,0,0,1|0,0,1]=3 4780 B8R0.9 C[C@H](CO)CC=C(C)C Amb25044656 [0,1,0,0,0,1|2,0,0]=4 4781 B8R0.9 C[C@H](CO)CNC(N)=O Amb25715034 [0,1,0,0,0,1|1,0,0]=3 4782 B8R0.9 C[C@H](CO)COC(C)=O Amb25846526 [0,1,0,0,0,1|1,0,0]=3 4783 B8R0.9 C[C@H](CO)SCC(C)=C Amb25052251 [0,1,0,0,0,1|2,0,0]=4 4784 B8R0.9 C[C@H](O)CCC(=O)NN Amb24395110 [0,1,0,0,0,1|2,0,0]=4 4785 B8R0.9 C[C@H](O)CNC(=O)C#C Amb25731135 [0,1,0,0,0,1|2,0,0]=4 4786 B8R0.9 C[C@H](O)CNC(=O)C=C Amb24702296 [0,1,0,0,0,1|2,0,0]=4 4787 B8R0.9 C[C@H](O)CNC(=O)CBr Amb24567754 [0,1,0,0,0,1|2,0,0]=4 4788 B8R0.9 C[C@H](O)CNC(C)CO Amb25700081 [0,1,0,0,0,1|1,0,1]=4 4789 B8R0.9 C[C@H](O)COC(=O)C=C Amb25284367 [0,1,0,0,0,1|2,0,0]=4 4790 B8R0.9 C[C@H](O)CSC(C)CO Amb25032273 [0,1,0,0,0,1|1,0,1]=4 4791 B8R0.9 C\C(\C=C)=C/CC(O)=O Amb25305754 [0,1,0,0,0,1|0,0,2]=4 4792 B8R0.9 C\C(\C=C\C(O)=O)=C/C Amb18642399 [0,1,0,0,0,1|0,0,2]=4 4793 B8R0.9 C\C(\CC)=C/CC(O)=O Amb22011800 [0,1,0,0,0,1|0,0,1]=3 4794 B8R0.9 C\C(\CCC(C)=O)=C/C Amb25768510 [0,1,0,0,0,1|1,0,1]=4 4795 B8R0.9 C\C(\CCC(C)=O)=C\C Amb24610198 [0,1,0,0,0,1|1,0,1]=4 4796 B8R0.9 C\C(\CCC(O)=O)=C\C Amb24681032 [0,1,0,0,0,1|0,0,1]=3 4797 B8R0.9 C\C(\CCC(O)=O)=N\N Amb24382718 [0,1,0,0,0,1|1,0,1]=4 4798 B8R0.9 C\C=C(/Br)\CCC(O)=O Amb25685237 [0,1,0,0,0,1|1,0,1]=4 4799 B8R0.9 C\C=C(\Br)/CCC(O)=O Amb25210030 [0,1,0,0,0,1|1,0,1]=4 4800 B8R0.9 C\C=C(\F)/CCC(O)=O Amb24670842 [0,1,0,0,0,1|1,0,1]=4 4801 B8R0.9 ClCC(=O)NCC(C)C Amb1160207 [0,1,0,0,0,1|1,0,0]=3 4802 B8R0.9 NC(=O)NCC(O)CO Amb25146091 [0,1,0,0,0,1|2,0,0]=4 4803 B8R0.9 NC(=O)NCC(S)CS Amb25337646 [0,1,0,0,0,1|2,0,0]=4 4804 B8R0.9 NC(=O)OCC(Br)CBr Amb22732242 [0,1,0,0,0,1|2,0,0]=4 4805 B8R0.9 NC(=O)OCC(O)CO Amb24683881 [0,1,0,0,0,1|2,0,0]=4 4806 B8R0.9 NC(C=C)CCC(=O)O Amb10843623 [0,1,0,0,0,1|1,0,1]=4 4807 B8R0.9 NC(CCC(O)=O)CO Amb18642916 [0,1,0,0,0,1|1,0,0]=3 4808 B8R0.9 NC(CF)CCC(N)=O Amb24599972 [0,1,0,0,0,1|2,0,0]=4 4809 B8R0.9 NC(CF)CCC(O)=O Amb19148378 [0,1,0,0,0,1|1,0,0]=3 4810 B8R0.9 NCC(=O)CC[13C](O)=O Amb22367280 [0,1,0,0,0,1|1,0,1]=4 4811 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,1,0,0,0,1|1,0,1]=4 4812 B8R0.9 NCC(=O)NCC(C)C Amb13951745 [0,1,0,0,0,1|1,0,0]=3 4813 B8R0.9 NCC(=O)OCC(O)=O Amb25710415 [0,1,0,0,0,1|1,0,1]=4 4814 B8R0.9 NCC(=O)[13CH2]CC(=O)O Amb17608125 [0,1,0,0,0,1|1,0,1]=4 4815 B8R0.9 NCC(=S)NCC(O)=O Amb25077168 [0,1,0,0,0,1|1,0,1]=4 4816 B8R0.9 NCC(N)CCC(O)=O Amb19328773 [0,1,0,0,0,1|1,0,0]=3 4817 B8R0.9 NCC(O)CCC(N)=O Amb24340194 [0,1,0,0,0,1|2,0,0]=4 4818 B8R0.9 NCC(O)CCC(O)=O Amb18124376 [0,1,0,0,0,1|1,0,0]=3 4819 B8R0.9 NCC(O)CCP(O)=O Amb24760103 [0,1,0,0,0,1|2,0,0]=4 4820 B8R0.9 NC[C@H](O)CCC(O)=O Amb24383262 [0,1,0,0,0,1|1,0,0]=3 4821 B8R0.9 NNC(=O)COC(C)C Amb2089067 [0,1,0,0,0,1|1,0,0]=3 4822 B8R0.9 NNC(=O)COC(C)C Amb2189164 [0,1,0,0,0,1|1,0,0]=3 4823 B8R0.9 N[13CH2]C(=O)CCC(O)=O Amb22367582 [0,1,0,0,0,1|1,0,1]=4 4824 B8R0.9 N[C@@H](CCC(O)=O)C=O Amb24347675 [0,1,0,0,0,1|1,0,1]=4 4825 B8R0.9 N[C@@H](CCC(O)=O)CO Amb24685421 [0,1,0,0,0,1|1,0,0]=3 4826 B8R0.9 N[C@H](C=C)CCC(=O)O Amb17621248 [0,1,0,0,0,1|1,0,1]=4 4827 B8R0.9 N[C@H](CCC(O)=O)CO Amb25352213 [0,1,0,0,0,1|1,0,0]=3 4828 B8R0.9 N[C@H](CF)CCC(O)=O Amb25339395 [0,1,0,0,0,1|1,0,0]=3 4829 B8R0.9 N[C@H](CO)CCC(N)=O Amb24368577 [0,1,0,0,0,1|2,0,0]=4 4830 B8R0.9 N[C@H](CS)CCC(O)=O Amb25348403 [0,1,0,0,0,1|1,0,0]=3 4831 B8R0.9 O=NN(CCC(=O)O)C Amb17618592 [0,1,0,0,0,1|2,0,0]=4 4832 B8R0.9 OC(=O)CCC(=O)CBr Amb18652012 [0,1,0,0,0,1|1,0,1]=4 4833 B8R0.9 OC(=O)CCC(=O)CCl Amb25736440 [0,1,0,0,0,1|1,0,1]=4 4834 B8R0.9 OC(=O)CCC(=O)CO Amb18642867 [0,1,0,0,0,1|1,0,1]=4 4835 B8R0.9 OC(=O)CCC(Br)CBr Amb24575822 [0,1,0,0,0,1|1,0,0]=3 4836 B8R0.9 OC(=O)CCC([NH3+])C=C Amb10845648 [0,1,0,0,0,1|1,0,1]=4 4837 B8R0.9 OC(=O)CNC(=O)CBr Amb18130258 [0,1,0,0,0,1|1,0,1]=4 4838 B8R0.9 OC(=O)CNC(=O)CCl Amb1144436 [0,1,0,0,0,1|1,0,1]=4 4839 B8R0.9 OC(=O)CNC(=O)CO Amb18124375 [0,1,0,0,0,1|1,0,1]=4 4840 B8R0.9 OC(=O)COC(=O)CCl Amb18644547 [0,1,0,0,0,1|1,0,1]=4 4841 B8R0.9 OC(CBr)\C=C\C(O)=O Amb18647817 [0,1,0,0,0,1|1,0,1]=4 4842 B8R0.9 OC(CCl)COS(O)=O Amb24726370 [0,1,0,0,0,1|2,0,0]=4 4843 B8R0.9 OC(CS)COP(O)=O Amb24523020 [0,1,0,0,0,1|2,0,0]=4 4844 B8R0.9 OCC(O)CCC(O)=O Amb18124400 [0,1,0,0,0,1|1,0,0]=3 4845 B8R0.9 OCC(O)COP(O)=O Amb25071391 [0,1,0,0,0,1|2,0,0]=4 4846 B8R0.9 OCC(O)\C=C\C(O)=O Amb18642875 [0,1,0,0,0,1|1,0,1]=4 4847 B8R0.9 OC[C@H](O)CCC(O)=O Amb24528896 [0,1,0,0,0,1|1,0,0]=3 4848 B8R0.9 ONC(=O)CCC(F)F Amb24414532 [0,1,0,0,0,1|2,0,0]=4 4849 B8R0.9 ONC(=O)COC(F)F Amb24457485 [0,1,0,0,0,1|2,0,0]=4 4850 B8R0.9 O\N=C(\CCN(C)C)/N Amb1118599 [0,1,0,0,0,1|2,0,0]=4 4851 B8R0.9 [O-][N+](=O)CC[C@H](CO)C Amb13883660 [0,1,0,0,0,1|1,0,1]=4 4852 B8R0.23 BrC(C(=O)O)CC(C)C Amb16233356 [0,1,0,0,0,1|0,0,0]=2 4853 B8R0.23 CC(=C)C(=O)CC(C)C Amb25222433 [0,1,0,0,0,1|2,0,0]=4 4854 B8R0.23 CC(=C)C(C)CC(O)=O Amb18642614 [0,1,0,0,0,1|0,0,2]=4 4855 B8R0.23 CC(=C)C(O)CC(O)=O Amb18642756 [0,1,0,0,0,1|0,0,2]=4 4856 B8R0.23 CC(=C)CC(=C)C(O)=O Amb24669131 [0,1,0,0,0,1|0,0,2]=4 4857 B8R0.23 CC(=C)CC(=O)C(C)C Amb25800567 [0,1,0,0,0,1|2,0,0]=4 4858 B8R0.23 CC(=C)CC(C)C(O)=O Amb24471924 [0,1,0,0,0,1|0,0,2]=4 4859 B8R0.23 CC(=C)CC(O)C(O)=O Amb24534477 [0,1,0,0,0,1|0,0,2]=4 4860 B8R0.23 CC(=C)C[C@@H](C(=O)O)C Amb10843988 [0,1,0,0,0,1|0,0,2]=4 4861 B8R0.23 CC(=C)C[C@@H](C)C(O)=O Amb24340253 [0,1,0,0,0,1|0,0,2]=4 4862 B8R0.23 CC(=C)C[C@@H](N)C(O)=O Amb22801689 [0,1,0,0,0,1|0,0,2]=4 4863 B8R0.23 CC(=C)C[C@H](N)C(O)=O Amb25757900 [0,1,0,0,0,1|0,0,2]=4 4864 B8R0.23 CC(=C)[C@@H](O)CC(O)=O Amb25789715 [0,1,0,0,0,1|0,0,2]=4 4865 B8R0.23 CC(=CC(O)=O)C(C)F Amb25108468 [0,1,0,0,0,1|1,0,1]=4 4866 B8R0.23 CC(=CC(O)=O)C(C)N Amb24339945 [0,1,0,0,0,1|1,0,1]=4 4867 B8R0.23 CC(=NN(C)C)C(O)=O Amb25044475 [0,1,0,0,0,1|1,0,1]=4 4868 B8R0.23 CC(=O)C(=C)CC(C)C Amb22277685 [0,1,0,0,0,1|1,0,0]=3 4869 B8R0.23 CC(=O)C(=O)CC(C)C Amb22489717 [0,1,0,0,0,1|1,0,0]=3 4870 B8R0.23 CC(=O)C(=O)CC(C)N Amb25769599 [0,1,0,0,0,1|2,0,0]=4 4871 B8R0.23 CC(=O)C(=O)CN(C)C Amb24694256 [0,1,0,0,0,1|2,0,0]=4 4872 B8R0.23 CC(=O)C(=O)OC(C)C Amb22232277 [0,1,0,0,0,1|1,0,1]=4 4873 B8R0.23 CC(=O)C(C)CC(O)=O Amb18292788 [0,1,0,0,0,1|1,0,1]=4 4874 B8R0.23 CC(=O)C(Cl)=NC(C)C Amb24512410 [0,1,0,0,0,1|1,0,1]=4 4875 B8R0.23 CC(=O)C(Cl)CC(O)=O Amb24426109 [0,1,0,0,0,1|1,0,1]=4 4876 B8R0.23 CC(=O)C(O)CC(O)=O Amb25341886 [0,1,0,0,0,1|1,0,1]=4 4877 B8R0.23 CC(=O)C(O)CN(C)C Amb24571624 [0,1,0,0,0,1|2,0,0]=4 4878 B8R0.23 CC(=O)C=C(Cl)C(C)C Amb24723397 [0,1,0,0,0,1|1,0,1]=4 4879 B8R0.23 CC(=O)CC(=O)C(O)=O Amb18642736 [0,1,0,0,0,1|1,0,1]=4 4880 B8R0.23 CC(=O)CC(=O)N(C)C Amb1152296 [0,1,0,0,0,1|2,0,0]=4 4881 B8R0.23 CC(=O)CC(=S)C(C)C Amb24632255 [0,1,0,0,0,1|1,0,0]=3 4882 B8R0.23 CC(=O)CC(Br)C(O)=O Amb24710683 [0,1,0,0,0,1|1,0,1]=4 4883 B8R0.23 CC(=O)CC(N)C(O)=O Amb18832532 [0,1,0,0,0,1|1,0,1]=4 4884 B8R0.23 CC(=O)CC(N)C(O)=O Amb22546289 [0,1,0,0,0,1|1,0,1]=4 4885 B8R0.23 CC(=O)CC(O)C(O)=O Amb22500917 [0,1,0,0,0,1|1,0,1]=4 4886 B8R0.23 CC(=O)C[C@@H](C)C(O)=O Amb24369598 [0,1,0,0,0,1|1,0,1]=4 4887 B8R0.23 CC(=O)C[C@@H](N)C(O)=O Amb22745939 [0,1,0,0,0,1|1,0,1]=4 4888 B8R0.23 CC(=O)C[C@H](O)C(O)=O Amb24358758 [0,1,0,0,0,1|1,0,1]=4 4889 B8R0.23 CC(=O)NC(O)C(O)=O Amb25146184 [0,1,0,0,0,1|1,0,1]=4 4890 B8R0.23 CC(=O)N[C@H](C)C(O)=O Amb19944277 [0,1,0,0,0,1|1,0,1]=4 4891 B8R0.23 CC(=O)OC(C)C(O)=O Amb22360672 [0,1,0,0,0,1|1,0,1]=4 4892 B8R0.23 CC(=O)SC(C)C(O)=O Amb25719066 [0,1,0,0,0,1|1,0,1]=4 4893 B8R0.23 CC(=O)[C@@H](C)CC(O)=O Amb25145964 [0,1,0,0,0,1|1,0,1]=4 4894 B8R0.23 CC(=O)[C@@H](N)CC(O)=O Amb25064775 [0,1,0,0,0,1|1,0,1]=4 4895 B8R0.23 CC(=O)[C@H](C)CC(O)=O Amb25360184 [0,1,0,0,0,1|1,0,1]=4 4896 B8R0.23 CC(=O)\C(\Cl)=N\C(C)C Amb25086712 [0,1,0,0,0,1|1,0,1]=4 4897 B8R0.23 CC(=S)CC(C)C(O)=O Amb24588975 [0,1,0,0,0,1|1,0,1]=4 4898 B8R0.23 CC(=S)N[C@@H](C)C(O)=O Amb24529119 [0,1,0,0,0,1|1,0,1]=4 4899 B8R0.23 CC(Br)CN(C)C(C)=O Amb24672871 [0,1,0,0,0,1|2,0,0]=4 4900 B8R0.23 CC(C(=O)N)CN(C)C Amb17231865 [0,1,0,0,0,1|2,0,0]=4 4901 B8R0.23 CC(C(=O)O)NC(C)C Amb10199874 [0,1,0,0,0,1|0,0,0]=2 4902 B8R0.23 CC(C(=O)O)NC(C)C Amb1110769 [0,1,0,0,0,1|0,0,0]=2 4903 B8R0.23 CC(C(=O)O)OC(C)C Amb10607866 [0,1,0,0,0,1|0,0,0]=2 4904 B8R0.23 CC(C(C)C)CC(=O)O Amb10844380 [0,1,0,0,0,1|0,0,0]=2 4905 B8R0.23 CC(C)=C(Br)CC(N)=O Amb24478813 [0,1,0,0,0,1|1,0,1]=4 4906 B8R0.23 CC(C)=C(C)CC(O)=O Amb18642613 [0,1,0,0,0,1|0,0,1]=3 4907 B8R0.23 CC(C)=C(Cl)CC(N)=O Amb24679667 [0,1,0,0,0,1|1,0,1]=4 4908 B8R0.23 CC(C)=CC(=O)C(O)=O Amb18642579 [0,1,0,0,0,1|0,0,2]=4 4909 B8R0.23 CC(C)=CC(C)C(C)=O Amb25749549 [0,1,0,0,0,1|1,0,1]=4 4910 B8R0.23 CC(C)=C[C@@H](C)C(O)=O Amb25794277 [0,1,0,0,0,1|0,0,1]=3 4911 B8R0.23 CC(C)=C[C@H](N)C(O)=O Amb24629144 [0,1,0,0,0,1|0,0,1]=3 4912 B8R0.23 CC(C)C(/C)=C/C(C)=O Amb17778974 [0,1,0,0,0,1|1,0,1]=4 4913 B8R0.23 CC(C)C(=C)CC(O)=O Amb25074109 [0,1,0,0,0,1|0,0,0]=2 4914 B8R0.23 CC(C)C(=O)CC(C)=O Amb17778966 [0,1,0,0,0,1|1,0,0]=3 4915 B8R0.23 CC(C)C(=O)CC(C)O Amb24416703 [0,1,0,0,0,1|1,0,1]=4 4916 B8R0.23 CC(C)C(=O)NC(N)=O Amb25716051 [0,1,0,0,0,1|1,0,1]=4 4917 B8R0.23 CC(C)C(Br)CC(N)=O Amb25706465 [0,1,0,0,0,1|1,0,0]=3 4918 B8R0.23 CC(C)C(C)CC(C)=O Amb25835876 [0,1,0,0,0,1|1,0,0]=3 4919 B8R0.23 CC(C)C(C)CC(N)=O Amb25146130 [0,1,0,0,0,1|1,0,0]=3 4920 B8R0.23 CC(C)C(C)NC(C)=O Amb23329033 [0,1,0,0,0,1|1,0,0]=3 4921 B8R0.23 CC(C)C(C)OC(C)=O Amb24458336 [0,1,0,0,0,1|1,0,0]=3 4922 B8R0.23 CC(C)C(C)O[N+]([O-])=O Amb25032143 [0,1,0,0,0,1|1,0,1]=4 4923 B8R0.23 CC(C)C(Cl)=CC(O)=O Amb24413053 [0,1,0,0,0,1|0,0,1]=3 4924 B8R0.23 CC(C)C(Cl)CC(=O)Cl Amb24479955 [0,1,0,0,0,1|1,0,0]=3 4925 B8R0.23 CC(C)C(Cl)SC(C)=O Amb24479957 [0,1,0,0,0,1|1,0,0]=3 4926 B8R0.23 CC(C)C(F)CC(O)=O Amb25854273 [0,1,0,0,0,1|0,0,0]=2 4927 B8R0.23 CC(C)C(N)=CC(O)=O Amb24481870 [0,1,0,0,0,1|0,0,1]=3 4928 B8R0.23 CC(C)C(N)CC(=O)Cl Amb24763731 [0,1,0,0,0,1|1,0,0]=3 4929 B8R0.23 CC(C)C(N)CC(=O)S Amb24477693 [0,1,0,0,0,1|0,1,0]=3 4930 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,1,0,0,0,1|1,0,0]=3 4931 B8R0.23 CC(C)C(N)CS(C)=O Amb25268163 [0,1,0,0,0,1|2,0,0]=4 4932 B8R0.23 CC(C)C(O)=CC(O)=O Amb24548066 [0,1,0,0,0,1|0,0,1]=3 4933 B8R0.23 CC(C)C(O)CC(C)=C Amb22228361 [0,1,0,0,0,1|2,0,0]=4 4934 B8R0.23 CC(C)C(O)CC(C)=O Amb24079595 [0,1,0,0,0,1|1,0,0]=3 4935 B8R0.23 CC(C)C(O)CC(N)=O Amb24481942 [0,1,0,0,0,1|1,0,0]=3 4936 B8R0.23 CC(C)C(O)C[N+]([O-])=O Amb25176366 [0,1,0,0,0,1|1,0,1]=4 4937 B8R0.23 CC(C)C(S)CC(C)=O Amb24736725 [0,1,0,0,0,1|1,0,0]=3 4938 B8R0.23 CC(C)CC(=C)C(N)=O Amb24369675 [0,1,0,0,0,1|1,0,0]=3 4939 B8R0.23 CC(C)CC(=C)C(O)=O Amb18642603 [0,1,0,0,0,1|0,0,0]=2 4940 B8R0.23 CC(C)CC(=O)C(C)O Amb25808608 [0,1,0,0,0,1|1,0,1]=4 4941 B8R0.23 CC(C)CC(=O)C(N)=N Amb24459793 [0,1,0,0,0,1|2,0,0]=4 4942 B8R0.23 CC(C)CC(=O)C(O)O Amb24524210 [0,1,0,0,0,1|0,0,2]=4 4943 B8R0.23 CC(C)CC(=O)C([O-])=O Amb21962530 [0,1,0,0,0,1|0,0,1]=3 4944 B8R0.23 CC(C)CC(=O)C([O-])=O Amb22360647 [0,1,0,0,0,1|0,0,1]=3 4945 B8R0.23 CC(C)CC(=O)[13C]([O-])=O Amb22353494 [0,1,0,0,0,1|0,0,1]=3 4946 B8R0.23 CC(C)CC(=O)[C@@H](C)O Amb25713683 [0,1,0,0,0,1|1,0,1]=4 4947 B8R0.23 CC(C)CC(Br)C(C)=C Amb24480024 [0,1,0,0,0,1|2,0,0]=4 4948 B8R0.23 CC(C)CC(Br)C(N)=O Amb24423796 [0,1,0,0,0,1|1,0,0]=3 4949 B8R0.23 CC(C)CC(C)C(C)=O Amb24640121 [0,1,0,0,0,1|1,0,0]=3 4950 B8R0.23 CC(C)CC(C)C(N)=N Amb24332069 [0,1,0,0,0,1|2,0,0]=4 4951 B8R0.23 CC(C)CC(C)C(N)=O Amb25733229 [0,1,0,0,0,1|1,0,0]=3 4952 B8R0.23 CC(C)CC(C)C(N)=S Amb24481694 [0,1,0,0,0,1|1,1,0]=4 4953 B8R0.23 CC(C)CC(C)C(O)=O Amb18975244 [0,1,0,0,0,1|0,0,0]=2 4954 B8R0.23 CC(C)CC(C)S([O-])=O Amb24371233 [0,1,0,0,0,1|1,0,1]=4 4955 B8R0.23 CC(C)CC(Cl)C(C)=C Amb25233440 [0,1,0,0,0,1|2,0,0]=4 4956 B8R0.23 CC(C)CC(Cl)C(N)=O Amb24534175 [0,1,0,0,0,1|1,0,0]=3 4957 B8R0.23 CC(C)CC(F)C(O)=O Amb24565634 [0,1,0,0,0,1|0,0,0]=2 4958 B8R0.23 CC(C)CC(N)B(O)O Amb25125820 [0,1,0,0,0,1|1,0,1]=4 4959 B8R0.23 CC(C)CC(N)C(C)=C Amb25764676 [0,1,0,0,0,1|2,0,0]=4 4960 B8R0.23 CC(C)CC(N)C(C)=O Amb18203220 [0,1,0,0,0,1|1,0,0]=3 4961 B8R0.23 CC(C)CC(N)C(C)=O Amb22899479 [0,1,0,0,0,1|1,0,0]=3 4962 B8R0.23 CC(C)CC(N)C(C)O Amb18642850 [0,1,0,0,0,1|1,0,1]=4 4963 B8R0.23 CC(C)CC(N)C(O)=O Amb22001061 [0,1,0,0,0,1|0,0,0]=2 4964 B8R0.23 CC(C)CC(N)[13C](O)=O Amb22363198 [0,1,0,0,0,1|0,0,0]=2 4965 B8R0.23 CC(C)CC(O)C(C)=C Amb25142332 [0,1,0,0,0,1|2,0,0]=4 4966 B8R0.23 CC(C)CC(O)C(C)O Amb24570892 [0,1,0,0,0,1|1,0,1]=4 4967 B8R0.23 CC(C)CC(S)C(O)=O Amb18296292 [0,1,0,0,0,1|0,0,0]=2 4968 B8R0.23 CC(C)CC([15NH2])C(O)=O Amb22351200 [0,1,0,0,0,1|0,0,0]=2 4969 B8R0.23 CC(C)CN(C)C(C)=N Amb25041352 [0,1,0,0,0,1|2,0,0]=4 4970 B8R0.23 CC(C)CN(C)C(C)=O Amb24545444 [0,1,0,0,0,1|1,0,0]=3 4971 B8R0.23 CC(C)C[13CH](N)C(O)=O Amb22351309 [0,1,0,0,0,1|0,0,0]=2 4972 B8R0.23 CC(C)C[13CH](N)[13C](O)=O Amb22367336 [0,1,0,0,0,1|0,0,0]=2 4973 B8R0.23 CC(C)C[C@@H](Br)C(=O)Cl Amb25290167 [0,1,0,0,0,1|1,0,0]=3 4974 B8R0.23 CC(C)C[C@@H](Br)C(N)=O Amb25310991 [0,1,0,0,0,1|1,0,0]=3 4975 B8R0.23 CC(C)C[C@@H](Br)C(O)=O Amb24648832 [0,1,0,0,0,1|0,0,0]=2 4976 B8R0.23 CC(C)C[C@@H](Cl)C(O)=O Amb22800398 [0,1,0,0,0,1|0,0,0]=2 4977 B8R0.23 CC(C)C[C@@H](F)C(O)=O Amb24616998 [0,1,0,0,0,1|0,0,0]=2 4978 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [0,1,0,0,0,1|1,0,0]=3 4979 B8R0.23 CC(C)C[C@@H]([15NH2])C(O)=O Amb22801141 [0,1,0,0,0,1|0,0,0]=2 4980 B8R0.23 CC(C)C[C@H](Br)C(O)=O Amb22226489 [0,1,0,0,0,1|0,0,0]=2 4981 B8R0.23 CC(C)C[C@H](Cl)C(N)=O Amb25145996 [0,1,0,0,0,1|1,0,0]=3 4982 B8R0.23 CC(C)C[C@H](Cl)C(O)=O Amb22388637 [0,1,0,0,0,1|0,0,0]=2 4983 B8R0.23 CC(C)C[C@H](N)B(O)O Amb24578467 [0,1,0,0,0,1|1,0,1]=4 4984 B8R0.23 CC(C)C[C@H](N)C(=O)Cl Amb25842766 [0,1,0,0,0,1|1,0,0]=3 4985 B8R0.23 CC(C)C[C@H](N)C(O)=O Amb22351113 [0,1,0,0,0,1|0,0,0]=2 4986 B8R0.23 CC(C)C[C@H](N)C(O)O Amb24353011 [0,1,0,0,0,1|0,0,2]=4 4987 B8R0.23 CC(C)C[C@H](N)[C@@H](C)O Amb25851073 [0,1,0,0,0,1|1,0,1]=4 4988 B8R0.23 CC(C)C[C@H](O)C(N)=O Amb24548495 [0,1,0,0,0,1|1,0,0]=3 4989 B8R0.23 CC(C)C[C@H](S)C(O)=O Amb24457027 [0,1,0,0,0,1|0,0,0]=2 4990 B8R0.23 CC(C)N(C)CC(C)=O Amb22587141 [0,1,0,0,0,1|1,0,0]=3 4991 B8R0.23 CC(C)N(C)CC(N)=O Amb24384718 [0,1,0,0,0,1|1,0,0]=3 4992 B8R0.23 CC(C)N(C)C[C@@H](C)O Amb24502340 [0,1,0,0,0,1|1,0,1]=4 4993 B8R0.23 CC(C)N(C)C[C@H](C)O Amb24616788 [0,1,0,0,0,1|1,0,1]=4 4994 B8R0.23 CC(C)N(N)CC(C)O Amb25734247 [0,1,0,0,0,1|1,0,1]=4 4995 B8R0.23 CC(C)N(O)CC(=C)Br Amb24367812 [0,1,0,0,0,1|2,0,0]=4 4996 B8R0.23 CC(C)N(O)CC(C)=C Amb24645766 [0,1,0,0,0,1|2,0,0]=4 4997 B8R0.23 CC(C)N(O)CC(N)=O Amb24481943 [0,1,0,0,0,1|1,0,0]=3 4998 B8R0.23 CC(C)N=C(Cl)C(O)=O Amb25799222 [0,1,0,0,0,1|0,0,1]=3 4999 B8R0.23 CC(C)NC(=O)C(=O)Cl Amb24746768 [0,1,0,0,0,1|1,0,1]=4 5000 B8R0.23 CC(C)NC(C)C(C)=O Amb18642711 [0,1,0,0,0,1|1,0,0]=3 5001 B8R0.23 CC(C)NC(C)C(C)O Amb24712201 [0,1,0,0,0,1|1,0,1]=4 5002 B8R0.23 CC(C)N[C@@H](C)C(N)=O Amb24749342 [0,1,0,0,0,1|1,0,0]=3 5003 B8R0.23 CC(C)N[C@H](C)C(N)=O Amb24680081 [0,1,0,0,0,1|1,0,0]=3 5004 B8R0.23 CC(C)OC(=O)C(O)=O Amb25709215 [0,1,0,0,0,1|0,0,1]=3 5005 B8R0.23 CC(C)SC(F)C(O)=O Amb24671129 [0,1,0,0,0,1|0,0,0]=2 5006 B8R0.23 CC(C)S[C@@H](C)C(O)=O Amb25108429 [0,1,0,0,0,1|0,0,0]=2 5007 B8R0.23 CC(C)[13CH2][13C](=O)[13C]([O-])=O Amb22055839 [0,1,0,0,0,1|0,0,1]=3 5008 B8R0.23 CC(C)[C@@H](N)CC(C)=C Amb25821833 [0,1,0,0,0,1|2,0,0]=4 5009 B8R0.23 CC(C)[C@@H](N)CC(O)=O Amb22226647 [0,1,0,0,0,1|0,0,0]=2 5010 B8R0.23 CC(C)[C@@H](O)CC(C)=C Amb25069574 [0,1,0,0,0,1|2,0,0]=4 5011 B8R0.23 CC(C)[C@@H](O)CC(C)=O Amb25147078 [0,1,0,0,0,1|1,0,0]=3 5012 B8R0.23 CC(C)[C@@H](O)CC(O)=O Amb25761246 [0,1,0,0,0,1|0,0,0]=2 5013 B8R0.23 CC(C)[C@H](C)CC(C)=O Amb25188966 [0,1,0,0,0,1|1,0,0]=3 5014 B8R0.23 CC(C)[C@H](N)CC(C)=C Amb24715099 [0,1,0,0,0,1|2,0,0]=4 5015 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,1,0,0,0,1|1,0,0]=3 5016 B8R0.23 CC(C)[C@H](N)CC(O)=O Amb20240790 [0,1,0,0,0,1|0,0,0]=2 5017 B8R0.23 CC(C)[C@H](O)C=C(C)C Amb25188977 [0,1,0,0,0,1|2,0,0]=4 5018 B8R0.23 CC(C)[C@H](O)CC(C)=C Amb25721776 [0,1,0,0,0,1|2,0,0]=4 5019 B8R0.23 CC(C)[C@H](O)CC(C)=O Amb25135567 [0,1,0,0,0,1|1,0,0]=3 5020 B8R0.23 CC(C)[C@H](O)CC(O)=O Amb24561913 [0,1,0,0,0,1|0,0,0]=2 5021 B8R0.23 CC(C)[C@H](O)C[C@@H](C)O Amb25229464 [0,1,0,0,0,1|1,0,1]=4 5022 B8R0.23 CC(C)\C(\Br)=C\C(O)=O Amb25074552 [0,1,0,0,0,1|0,0,1]=3 5023 B8R0.23 CC(C)\C=C(/F)\C(O)=O Amb18642877 [0,1,0,0,0,1|0,0,1]=3 5024 B8R0.23 CC(CC(C)=O)C(C)O Amb24339979 [0,1,0,0,0,1|2,0,0]=4 5025 B8R0.23 CC(CC(C)N)C(O)=O Amb20620336 [0,1,0,0,0,1|1,0,0]=3 5026 B8R0.23 CC(CC(C)O)C(C)=O Amb25682085 [0,1,0,0,0,1|2,0,0]=4 5027 B8R0.23 CC(CC(F)F)C(O)=O Amb22896466 [0,1,0,0,0,1|2,0,0]=4 5028 B8R0.23 CC(CC(O)=O)C(C)N Amb23536744 [0,1,0,0,0,1|1,0,0]=3 5029 B8R0.23 CC(CC(O)=O)N(C)N Amb25699365 [0,1,0,0,0,1|2,0,0]=4 5030 B8R0.23 CC(CC(O)=O)S(C)=O Amb18974545 [0,1,0,0,0,1|2,0,0]=4 5031 B8R0.23 CC(CN(C(C)C)C)O Amb17334133 [0,1,0,0,0,1|1,0,1]=4 5032 B8R0.23 CC(CN(C)O)C(O)=O Amb24540617 [0,1,0,0,0,1|2,0,0]=4 5033 B8R0.23 CC(CS(C)=O)C(O)=O Amb18974546 [0,1,0,0,0,1|2,0,0]=4 5034 B8R0.23 CC(Cl)CC(Cl)C(C)=O Amb25700978 [0,1,0,0,0,1|2,0,0]=4 5035 B8R0.23 CC(Cl)CN(C)C(C)=O Amb25325778 [0,1,0,0,0,1|2,0,0]=4 5036 B8R0.23 CC(F)CC(N)C(O)=O Amb25803619 [0,1,0,0,0,1|1,0,0]=3 5037 B8R0.23 CC(N(C)C)CC(=O)N Amb17231867 [0,1,0,0,0,1|2,0,0]=4 5038 B8R0.23 CC(N(CC(=O)O)C)C Amb10609863 [0,1,0,0,0,1|0,0,0]=2 5039 B8R0.23 CC(N)C(=O)CC(N)=O Amb24712024 [0,1,0,0,0,1|2,0,0]=4 5040 B8R0.23 CC(N)CN(C)C(C)=O Amb24096452 [0,1,0,0,0,1|2,0,0]=4 5041 B8R0.23 CC(N)CN(C)C(N)=O Amb18203178 [0,1,0,0,0,1|2,0,0]=4 5042 B8R0.23 CC(NC(=O)C(=O)C)C Amb17399820 [0,1,0,0,0,1|1,0,1]=4 5043 B8R0.23 CC(NC(C)=O)C(C)O Amb25188915 [0,1,0,0,0,1|2,0,0]=4 5044 B8R0.23 CC(NC(C)=O)N(C)C Amb25064332 [0,1,0,0,0,1|2,0,0]=4 5045 B8R0.23 CC(NN(C)C)C(O)=O Amb24523085 [0,1,0,0,0,1|1,0,0]=3 5046 B8R0.23 CC(NS(C)=O)C(O)=O Amb25241916 [0,1,0,0,0,1|2,0,0]=4 5047 B8R0.23 CC(O)C(C)CC(O)=O Amb18293276 [0,1,0,0,0,1|1,0,0]=3 5048 B8R0.23 CC(O)C(O)CC(C)=O Amb25708226 [0,1,0,0,0,1|2,0,0]=4 5049 B8R0.23 CC(O)CC(=O)C(O)=O Amb25789747 [0,1,0,0,0,1|1,0,0]=3 5050 B8R0.23 CC(O)CC(C)C(O)=O Amb18293277 [0,1,0,0,0,1|1,0,0]=3 5051 B8R0.23 CC(O)CC(N)C(O)=O Amb18642918 [0,1,0,0,0,1|1,0,0]=3 5052 B8R0.23 CC(O)CC(O)C(N)=O Amb24523077 [0,1,0,0,0,1|2,0,0]=4 5053 B8R0.23 CC(O)CN(C)C(C)=O Amb24072011 [0,1,0,0,0,1|2,0,0]=4 5054 B8R0.23 CC(O)CN(C)C(N)=O Amb25214415 [0,1,0,0,0,1|2,0,0]=4 5055 B8R0.23 CC(OC(C)=O)C(C)Br Amb25321799 [0,1,0,0,0,1|2,0,0]=4 5056 B8R0.23 CC(OC(C)=O)C(C)Cl Amb24480182 [0,1,0,0,0,1|2,0,0]=4 5057 B8R0.23 CC(OC(F)F)C(O)=O Amb24358717 [0,1,0,0,0,1|2,0,0]=4 5058 B8R0.23 CC(OC(N)=O)N(C)C Amb24616794 [0,1,0,0,0,1|2,0,0]=4 5059 B8R0.23 CC(S(=O)CC(=O)O)C Amb10608021 [0,1,0,0,0,1|0,0,0]=2 5060 B8R0.23 CC(S)CC(O)C(O)=O Amb25032270 [0,1,0,0,0,1|1,0,0]=3 5061 B8R0.23 CC(\C(=C\C(=O)O)\C)C Amb17506861 [0,1,0,0,0,1|0,0,1]=3 5062 B8R0.23 CN(C(=O)CC(=O)O)C Amb17399822 [0,1,0,0,0,1|1,0,0]=3 5063 B8R0.23 CN(C)C(=O)CC(N)=O Amb17760295 [0,1,0,0,0,1|2,0,0]=4 5064 B8R0.23 CN(C)CC(=C)C(=O)Cl Amb25381232 [0,1,0,0,0,1|2,0,0]=4 5065 B8R0.23 CN(C)CC(F)C(O)=O Amb25178248 [0,1,0,0,0,1|1,0,0]=3 5066 B8R0.23 CN(C)CC(N)C(N)=O Amb18984335 [0,1,0,0,0,1|2,0,0]=4 5067 B8R0.23 CN(C)CC(N)C(O)=O Amb22352274 [0,1,0,0,0,1|1,0,0]=3 5068 B8R0.23 CN(C)CC(N)C(O)=O Amb23558085 [0,1,0,0,0,1|1,0,0]=3 5069 B8R0.23 CN(C)CC(O)C(N)=O Amb24333804 [0,1,0,0,0,1|2,0,0]=4 5070 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb19889770 [0,1,0,0,0,1|1,0,0]=3 5071 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb22800468 [0,1,0,0,0,1|1,0,0]=3 5072 B8R0.23 CN(C)C[C@H](N)C(O)=O Amb24078627 [0,1,0,0,0,1|1,0,0]=3 5073 B8R0.23 CN(C)C[C@H](O)C(O)=O Amb24372674 [0,1,0,0,0,1|1,0,0]=3 5074 B8R0.23 CN(N)C(=O)CC(O)=O Amb25326354 [0,1,0,0,0,1|2,0,0]=4 5075 B8R0.23 CS(=N)CC(N)C(O)=O Amb24374643 [0,1,0,0,0,1|2,0,0]=4 5076 B8R0.23 CS(=O)CC(N)C(O)=O Amb18125279 [0,1,0,0,0,1|2,0,0]=4 5077 B8R0.23 CS(=O)CC(O)C(O)=O Amb24692848 [0,1,0,0,0,1|2,0,0]=4 5078 B8R0.23 CS(=O)C[C@@H](C(=O)O)N Amb16232229 [0,1,0,0,0,1|2,0,0]=4 5079 B8R0.23 CS(=O)C[C@@H](N)C(O)=O Amb22745418 [0,1,0,0,0,1|2,0,0]=4 5080 B8R0.23 C[C@@H](C(=O)O)CC(C)C Amb10844070 [0,1,0,0,0,1|0,0,0]=2 5081 B8R0.23 C[C@@H](C(C)C)CC(=O)O Amb10844387 [0,1,0,0,0,1|0,0,0]=2 5082 B8R0.23 C[C@@H](CC(O)=O)C(Cl)Cl Amb24480304 [0,1,0,0,0,1|2,0,0]=4 5083 B8R0.23 C[C@@H](Cl)[C@H](C)OC(=O)Cl Amb25765785 [0,1,0,0,0,1|2,0,0]=4 5084 B8R0.23 C[C@@H](N)CN(C)C(C)=O Amb24465078 [0,1,0,0,0,1|2,0,0]=4 5085 B8R0.23 C[C@@H](N)[C@@H](O)CC(O)=O Amb25188895 [0,1,0,0,0,1|1,0,0]=3 5086 B8R0.23 C[C@@H](N)[C@H](O)CP(O)=O Amb25236573 [0,1,0,0,0,1|2,0,0]=4 5087 B8R0.23 C[C@@H](NC(C)=O)[C@@H](C)Br Amb24366649 [0,1,0,0,0,1|2,0,0]=4 5088 B8R0.23 C[C@@H](O)CC(=O)C(O)=O Amb25239377 [0,1,0,0,0,1|1,0,0]=3 5089 B8R0.23 C[C@@H](O)CN(C)C(C)=O Amb24416218 [0,1,0,0,0,1|2,0,0]=4 5090 B8R0.23 C[C@@H](O)C[C@H](N)C(O)=O Amb25162814 [0,1,0,0,0,1|1,0,0]=3 5091 B8R0.23 C[C@@H](O)[C@@H](O)CC(O)=O Amb25267600 [0,1,0,0,0,1|1,0,0]=3 5092 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22168848 [0,1,0,0,0,1|1,0,0]=3 5093 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22756696 [0,1,0,0,0,1|1,0,0]=3 5094 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)Br Amb24480012 [0,1,0,0,0,1|2,0,0]=4 5095 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)Cl Amb25146769 [0,1,0,0,0,1|2,0,0]=4 5096 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)O Amb25333442 [0,1,0,0,0,1|2,0,0]=4 5097 B8R0.23 C[C@@H](OC(C)=O)[C@H](C)Br Amb24432955 [0,1,0,0,0,1|2,0,0]=4 5098 B8R0.23 C[C@@H](OC(C)=O)[C@H](C)Cl Amb24740430 [0,1,0,0,0,1|2,0,0]=4 5099 B8R0.23 C[C@@H](OC(F)F)C(O)=O Amb24389309 [0,1,0,0,0,1|2,0,0]=4 5100 B8R0.23 C[C@H](C(=O)O)CC(C)C Amb10844071 [0,1,0,0,0,1|0,0,0]=2 5101 B8R0.23 C[C@H](C(=O)O)CN(C)C Amb10844031 [0,1,0,0,0,1|1,0,0]=3 5102 B8R0.23 C[C@H](Cl)C[C@H](N)C(O)=O Amb25849347 [0,1,0,0,0,1|1,0,0]=3 5103 B8R0.23 C[C@H](N)[C@@H](O)CC(O)=O Amb25727721 [0,1,0,0,0,1|1,0,0]=3 5104 B8R0.23 C[C@H](NC(C)=O)[C@@H](C)Br Amb25075106 [0,1,0,0,0,1|2,0,0]=4 5105 B8R0.23 C[C@H](NC(C)=O)[C@@H](C)O Amb25132762 [0,1,0,0,0,1|2,0,0]=4 5106 B8R0.23 C[C@H](NC(N)=O)[C@@H](C)Br Amb24480158 [0,1,0,0,0,1|2,0,0]=4 5107 B8R0.23 C[C@H](NC(N)=O)[C@@H](C)O Amb24562842 [0,1,0,0,0,1|2,0,0]=4 5108 B8R0.23 C[C@H](O)CC(=O)C(O)=O Amb25859340 [0,1,0,0,0,1|1,0,0]=3 5109 B8R0.23 C[C@H](O)CN(C)C(C)=O Amb24553313 [0,1,0,0,0,1|2,0,0]=4 5110 B8R0.23 C[C@H](O)C[C@@H](C)C(O)=O Amb25114249 [0,1,0,0,0,1|1,0,0]=3 5111 B8R0.23 C[C@H](O)C[C@H](N)C(O)=O Amb24461394 [0,1,0,0,0,1|1,0,0]=3 5112 B8R0.23 C[C@H](OC(C)=O)[C@@H](C)Br Amb24558149 [0,1,0,0,0,1|2,0,0]=4 5113 B8R0.23 C[C@H](OC(C)=O)[C@@H](C)O Amb24642757 [0,1,0,0,0,1|2,0,0]=4 5114 B8R0.23 C[S+](C)CC(=O)C(O)=O Amb24524581 [0,1,0,0,0,1|1,0,0]=3 5115 B8R0.23 C[S+](C)CC(N)C([O-])=O Amb25242630 [0,1,0,0,0,1|1,0,1]=4 5116 B8R0.23 C[S+](C)CC(O)C(O)=O Amb24373144 [0,1,0,0,0,1|1,0,0]=3 5117 B8R0.23 C\C(=C/C(C)C)\C(O)=O Amb18642616 [0,1,0,0,0,1|0,0,1]=3 5118 B8R0.23 C\C(=C/C(C)O)\C(O)=O Amb18642769 [0,1,0,0,0,1|1,0,1]=4 5119 B8R0.23 C\C(=C/C(O)=O)\C(C)F Amb25331272 [0,1,0,0,0,1|1,0,1]=4 5120 B8R0.23 C\C(=C/C(O)=O)\[C@@H](C)N Amb24477674 [0,1,0,0,0,1|1,0,1]=4 5121 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)N Amb24394205 [0,1,0,0,0,1|1,0,1]=4 5122 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)O Amb24340136 [0,1,0,0,0,1|1,0,1]=4 5123 B8R0.23 C\C(=C/[C@@H](C)N)\C(O)=O Amb24476675 [0,1,0,0,0,1|1,0,1]=4 5124 B8R0.23 C\C(=C\C(C)=O)\C(C)C Amb25706913 [0,1,0,0,0,1|1,0,1]=4 5125 B8R0.23 C\C(=C\C(C)C)\C(C)=O Amb25679812 [0,1,0,0,0,1|1,0,1]=4 5126 B8R0.23 C\C(=C\C(C)N)\C(O)=O Amb25731207 [0,1,0,0,0,1|1,0,1]=4 5127 B8R0.23 C\C(=C\C(C)O)\C(O)=O Amb24548753 [0,1,0,0,0,1|1,0,1]=4 5128 B8R0.23 C\C(=C\N(C)C)\C(O)=O Amb24740153 [0,1,0,0,0,1|1,0,1]=4 5129 B8R0.23 C\C(\Cl)=C\C(Cl)C(O)=O Amb24710290 [0,1,0,0,0,1|1,0,1]=4 5130 B8R0.23 ClC(C(=O)O)CC(C)C Amb17593753 [0,1,0,0,0,1|0,0,0]=2 5131 B8R0.23 F[C@H](C(=O)O)CC(C)C Amb10841083 [0,1,0,0,0,1|0,0,0]=2 5132 B8R0.23 NC(C(=O)O)CC(F)F Amb13952714 [0,1,0,0,0,1|2,0,0]=4 5133 B8R0.23 NC(C(=O)O)CC(F)F Amb13952720 [0,1,0,0,0,1|2,0,0]=4 5134 B8R0.23 NC(C(C)C)CC(=O)O Amb2436060 [0,1,0,0,0,1|0,0,0]=2 5135 B8R0.23 NC(CC(F)Cl)C(O)=O Amb24339513 [0,1,0,0,0,1|2,0,0]=4 5136 B8R0.23 NC(CC(O)=O)C(F)F Amb23570587 [0,1,0,0,0,1|2,0,0]=4 5137 B8R0.23 N[C@@H](C(=O)N)CC(C)C Amb16183944 [0,1,0,0,0,1|1,0,0]=3 5138 B8R0.23 N[C@@H](C(C)C)CC(=O)O Amb16184024 [0,1,0,0,0,1|0,0,0]=2 5139 B8R0.23 N[C@@H](CC(Cl)Cl)C(O)=O Amb24746791 [0,1,0,0,0,1|2,0,0]=4 5140 B8R0.23 N[C@H](C(=O)N)CC(C)C Amb10670112 [0,1,0,0,0,1|1,0,0]=3 5141 B8R0.23 N[C@H](C(C)C)CC(=O)O Amb16184030 [0,1,0,0,0,1|0,0,0]=2 5142 B8R0.23 N[C@H](CC(F)F)C(O)=O Amb25117310 [0,1,0,0,0,1|2,0,0]=4 5143 B8R0.23 OC(=O)C(Cl)CC(Cl)Cl Amb25350003 [0,1,0,0,0,1|2,0,0]=4 5144 B8R0.23 OC(=O)CC(=O)C(=O)C Amb17593364 [0,1,0,0,0,1|1,0,1]=4 5145 B8R0.23 OC(=O)CN(C(=O)C)C Amb1111693 [0,1,0,0,0,1|1,0,1]=4 5146 B8R0.23 OC(=O)CS(=O)C(F)F Amb18979309 [0,1,0,0,0,1|2,0,0]=4 5147 B8R0.23 OC(=O)C[C@@H]([C@@H](O)C)N Amb16184021 [0,1,0,0,0,1|1,0,0]=3 5148 B8R0.23 OC(=O)[C@@H](Cl)CC(Cl)Cl Amb25061364 [0,1,0,0,0,1|2,0,0]=4 5149 B8R0.23 OC(C(C)C)CC(=O)O Amb17231878 [0,1,0,0,0,1|0,0,0]=2 5150 B8R0.23 OC(CC(F)F)C(O)=O Amb25274709 [0,1,0,0,0,1|2,0,0]=4 5151 B8R0.23 OC(O)C[C@@H](O)C(O)=O Amb24524214 [0,1,0,0,0,1|2,0,0]=4 5152 B8R0.23 O[C@H](C(=O)O)CC(C)C Amb16232074 [0,1,0,0,0,1|0,0,0]=2 5153 B8R0.23 O[C@H](CC(F)F)C(O)=O Amb24641140 [0,1,0,0,0,1|2,0,0]=4 5154 B8R0.23 [13CH3][13CH]([13CH3])[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337118 [0,1,0,0,0,1|0,0,0]=2 5155 B8R0.29 C([2H])(NCC(=O)O)([2H])[2H] Amb17620034 [0,1,0,0,0,1|2,0,0]=4 5156 B8R0.29 CC(=C)CCC(C)(C)C Amb24712961 [0,1,0,0,0,1|2,0,0]=4 5157 B8R0.29 CC(=C)CNC(C)(C)C Amb18988470 [0,1,0,0,0,1|2,0,0]=4 5158 B8R0.29 CC(=C)CSC(C)(C)C Amb25249058 [0,1,0,0,0,1|2,0,0]=4 5159 B8R0.29 CC(=N)NCC(C)(C)C Amb24381819 [0,1,0,0,0,1|2,0,0]=4 5160 B8R0.29 CC(=O)C#CC(C)(C)C Amb25721375 [0,1,0,0,0,1|1,0,1]=4 5161 B8R0.29 CC(=O)C#CC(C)(C)Cl Amb24577769 [0,1,0,0,0,1|1,0,1]=4 5162 B8R0.29 CC(=O)C#CC(C)(C)O Amb25282796 [0,1,0,0,0,1|1,0,1]=4 5163 B8R0.29 CC(=O)CNC(C)(C)C Amb1091895 [0,1,0,0,0,1|1,0,0]=3 5164 B8R0.29 CC(=O)CNC(C)(C)C Amb22283961 [0,1,0,0,0,1|1,0,0]=3 5165 B8R0.29 CC(=O)NCC(C)(C)C Amb23247439 [0,1,0,0,0,1|1,0,0]=3 5166 B8R0.29 CC(=O)NCC(C)(C)N Amb18642812 [0,1,0,0,0,1|1,0,0]=3 5167 B8R0.29 CC(=O)NCC(C)(C)O Amb25082896 [0,1,0,0,0,1|1,0,0]=3 5168 B8R0.29 CC(=O)NC[Si](C)(C)Cl Amb24709920 [0,1,0,0,0,1|1,1,0]=4 5169 B8R0.29 CC(=O)NNC(C)(C)C Amb25746149 [0,1,0,0,0,1|2,0,0]=4 5170 B8R0.29 CC(=O)OCC(C)(C)F Amb24748637 [0,1,0,0,0,1|1,0,0]=3 5171 B8R0.29 CC(=O)OCC(C)(C)N Amb25843473 [0,1,0,0,0,1|1,0,0]=3 5172 B8R0.29 CC(=O)ONC(C)(C)C Amb22263962 [0,1,0,0,0,1|2,0,0]=4 5173 B8R0.29 CC(=O)ONC(C)(C)C Amb24744725 [0,1,0,0,0,1|2,0,0]=4 5174 B8R0.29 CC(=O)SSC(C)(C)C Amb25080492 [0,1,0,0,0,1|2,0,0]=4 5175 B8R0.29 CC(=O)\C=C\C(C)(C)Cl Amb24619610 [0,1,0,0,0,1|1,0,1]=4 5176 B8R0.29 CC(=O)\C=C\C(C)(C)O Amb25142884 [0,1,0,0,0,1|1,0,1]=4 5177 B8R0.29 CC(=S)NCC(C)(C)C Amb24349663 [0,1,0,0,0,1|1,1,0]=4 5178 B8R0.29 CC(C)(Br)\C=C\C(O)=O Amb25178813 [0,1,0,0,0,1|0,0,1]=3 5179 B8R0.29 CC(C)(C)C#CC(O)=O Amb22496786 [0,1,0,0,0,1|0,0,1]=3 5180 B8R0.29 CC(C)(C)CCB(O)O Amb24502180 [0,1,0,0,0,1|1,0,1]=4 5181 B8R0.29 CC(C)(C)CCC(=O)Cl Amb25105178 [0,1,0,0,0,1|1,0,0]=3 5182 B8R0.29 CC(C)(C)CCC(N)=N Amb24412583 [0,1,0,0,0,1|2,0,0]=4 5183 B8R0.29 CC(C)(C)CNC(N)=N Amb24502295 [0,1,0,0,0,1|2,0,0]=4 5184 B8R0.29 CC(C)(C)CNC(N)=O Amb20623709 [0,1,0,0,0,1|1,0,0]=3 5185 B8R0.29 CC(C)(C)CNC(N)=S Amb24380096 [0,1,0,0,0,1|1,1,0]=4 5186 B8R0.29 CC(C)(C)COC(N)=O Amb25190252 [0,1,0,0,0,1|1,0,0]=3 5187 B8R0.29 CC(C)(C)N=NC(N)=O Amb24452670 [0,1,0,0,0,1|2,0,0]=4 5188 B8R0.29 CC(C)(C)NCC(=C)Br Amb18523760 [0,1,0,0,0,1|2,0,0]=4 5189 B8R0.29 CC(C)(C)NCC(=C)Cl Amb18969565 [0,1,0,0,0,1|2,0,0]=4 5190 B8R0.29 CC(C)(C)NCC(=O)Cl Amb22739730 [0,1,0,0,0,1|1,0,0]=3 5191 B8R0.29 CC(C)(C)NCS([O-])=O Amb24633998 [0,1,0,0,0,1|1,0,1]=4 5192 B8R0.29 CC(C)(C)NNC(N)=O Amb24624658 [0,1,0,0,0,1|2,0,0]=4 5193 B8R0.29 CC(C)(C)OCC(=O)Cl Amb24414017 [0,1,0,0,0,1|1,0,0]=3 5194 B8R0.29 CC(C)(C)OCC(N)=O Amb22228918 [0,1,0,0,0,1|1,0,0]=3 5195 B8R0.29 CC(C)(C)OCC([O-])=O Amb22754771 [0,1,0,0,0,1|0,0,1]=3 5196 B8R0.29 CC(C)(C)ONC(N)=O Amb24387085 [0,1,0,0,0,1|2,0,0]=4 5197 B8R0.29 CC(C)(C)SCC(=C)Br Amb25691631 [0,1,0,0,0,1|2,0,0]=4 5198 B8R0.29 CC(C)(C)SCC(=C)Cl Amb25130393 [0,1,0,0,0,1|2,0,0]=4 5199 B8R0.29 CC(C)(C)\C=C\C(N)=O Amb24477842 [0,1,0,0,0,1|1,0,1]=4 5200 B8R0.29 CC(C)(Cl)CCC(O)=O Amb18644451 [0,1,0,0,0,1|0,0,0]=2 5201 B8R0.29 CC(C)(Cl)COC(N)=O Amb25188841 [0,1,0,0,0,1|1,0,0]=3 5202 B8R0.29 CC(C)(N)CCC(=C)Cl Amb25265259 [0,1,0,0,0,1|2,0,0]=4 5203 B8R0.29 CC(C)(N)CNC(N)=N Amb25146007 [0,1,0,0,0,1|2,0,0]=4 5204 B8R0.29 CC(C)(N)COP(O)=O Amb25111079 [0,1,0,0,0,1|1,0,0]=3 5205 B8R0.29 CC(C)(O)C#CC(N)=O Amb25309417 [0,1,0,0,0,1|1,0,1]=4 5206 B8R0.29 CC(C)(O)CCB(O)O Amb24544502 [0,1,0,0,0,1|1,0,1]=4 5207 B8R0.29 CC(C)(O)CCC(N)=S Amb25777865 [0,1,0,0,0,1|1,1,0]=4 5208 B8R0.29 CC(C)(O)CCC([O-])=O Amb24271108 [0,1,0,0,0,1|0,0,1]=3 5209 B8R0.29 CC(C)(O)CNC(N)=N Amb24436490 [0,1,0,0,0,1|2,0,0]=4 5210 B8R0.29 CC(C)(O)\C=C\C(O)=O Amb18642770 [0,1,0,0,0,1|0,0,1]=3 5211 B8R0.29 CC(C)(S)CCC(O)=O Amb22489759 [0,1,0,0,0,1|0,0,0]=2 5212 B8R0.29 CC(C)([NH3+])CCC(O)=O Amb22372040 [0,1,0,0,0,1|0,0,0]=2 5213 B8R0.29 CC(C)=CCC(C)(C)N Amb25146192 [0,1,0,0,0,1|2,0,0]=4 5214 B8R0.29 CC(C)=CCP(O)(O)=O Amb25308177 [0,1,0,0,0,1|1,0,1]=4 5215 B8R0.29 CC(C)CCS(=O)(=O)Br Amb23555504 [0,1,0,0,0,1|1,0,1]=4 5216 B8R0.29 CC(C)CCS(=O)(=O)Cl Amb18289340 [0,1,0,0,0,1|1,0,1]=4 5217 B8R0.29 CC(C)CCS(C)(=O)=O Amb25049892 [0,1,0,0,0,1|1,0,1]=4 5218 B8R0.29 CC(C)CCS(N)(=O)=O Amb18791482 [0,1,0,0,0,1|1,0,1]=4 5219 B8R0.29 CC(C)CNS(N)(=O)=O Amb24462446 [0,1,0,0,0,1|1,0,1]=4 5220 B8R0.29 CC(C)COP(C)(=O)Cl Amb24481755 [0,1,0,0,0,1|2,0,0]=4 5221 B8R0.29 CC(C)COP(C)(C)=O Amb25042087 [0,1,0,0,0,1|2,0,0]=4 5222 B8R0.29 CC(C)COP(C)(O)=O Amb24117879 [0,1,0,0,0,1|1,0,0]=3 5223 B8R0.29 CC(C)COP(O)(O)=O Amb25264732 [0,1,0,0,0,1|1,0,0]=3 5224 B8R0.29 CC(C)COS(C)(=O)=O Amb22388880 [0,1,0,0,0,1|1,0,1]=4 5225 B8R0.29 CC(C)COS(O)(=O)=O Amb25200264 [0,1,0,0,0,1|1,0,0]=3 5226 B8R0.29 CC(CNC(C)(C)C)O Amb17138374 [0,1,0,0,0,1|1,0,1]=4 5227 B8R0.29 CC(CNS(=O)(=O)Cl)C Amb17193918 [0,1,0,0,0,1|1,0,1]=4 5228 B8R0.29 CC(COS(=O)[O-])([NH3+])C Amb10552435 [0,1,0,0,0,1|1,0,1]=4 5229 B8R0.29 CC(Cl)COS(O)(=O)=O Amb24479974 [0,1,0,0,0,1|2,0,0]=4 5230 B8R0.29 CC(F)(F)CCC(=O)Cl Amb25086105 [0,1,0,0,0,1|2,0,0]=4 5231 B8R0.29 CC(F)(F)\C=C\C(O)=O Amb22295928 [0,1,0,0,0,1|1,0,1]=4 5232 B8R0.29 CC(N)(F)CCC(O)=O Amb24672870 [0,1,0,0,0,1|1,0,0]=3 5233 B8R0.29 CC(N)CCP(C)(O)=O Amb25765644 [0,1,0,0,0,1|2,0,0]=4 5234 B8R0.29 CC(N)CCS(O)(=O)=O Amb24522970 [0,1,0,0,0,1|2,0,0]=4 5235 B8R0.29 CC(N)CSP(O)(O)=O Amb24649696 [0,1,0,0,0,1|2,0,0]=4 5236 B8R0.29 CC(O)(O)NCC(O)=O Amb24715373 [0,1,0,0,0,1|1,0,0]=3 5237 B8R0.29 CC(O)CCC(C)(C)Cl Amb24355214 [0,1,0,0,0,1|1,0,1]=4 5238 B8R0.29 CC(O)CCC(C)(C)F Amb24757018 [0,1,0,0,0,1|1,0,1]=4 5239 B8R0.29 CC(O)CCC(C)(C)N Amb18642848 [0,1,0,0,0,1|1,0,1]=4 5240 B8R0.29 CC(O)COP(O)(O)=O Amb17673332 [0,1,0,0,0,1|2,0,0]=4 5241 B8R0.29 CS(=O)(=O)OCC(O)=O Amb25783884 [0,1,0,0,0,1|2,0,0]=4 5242 B8R0.29 CS(=O)CCC(C)(C)N Amb24538977 [0,1,0,0,0,1|2,0,0]=4 5243 B8R0.29 CS(=O)NCC(C)(C)N Amb25263937 [0,1,0,0,0,1|2,0,0]=4 5244 B8R0.29 CS(=O)NCC(C)(C)O Amb25177000 [0,1,0,0,0,1|2,0,0]=4 5245 B8R0.29 CS(C)(=O)=NCC(N)=O Amb24572132 [0,1,0,0,0,1|2,0,0]=4 5246 B8R0.29 C[C@@H](N)CCS(O)(=O)=O Amb22799661 [0,1,0,0,0,1|2,0,0]=4 5247 B8R0.29 C[C@@H](O)COC(C)(C)C Amb19929334 [0,1,0,0,0,1|1,0,1]=4 5248 B8R0.29 C[C@H](N)CCS(O)(=O)=O Amb25342455 [0,1,0,0,0,1|2,0,0]=4 5249 B8R0.29 C[C@H](O)COC(C)(C)C Amb19929322 [0,1,0,0,0,1|1,0,1]=4 5250 B8R0.29 C[C@H](O)COP(O)(O)=O Amb25687780 [0,1,0,0,0,1|2,0,0]=4 5251 B8R0.29 C[N+](C)(C)CCC(N)=O Amb24482186 [0,1,0,0,0,1|2,0,0]=4 5252 B8R0.29 C[N+](C)(C)CCC(O)=O Amb24117222 [0,1,0,0,0,1|1,0,0]=3 5253 B8R0.29 C[Si](C)(C)CCC(N)=O Amb25745193 [0,1,0,0,0,1|1,1,0]=4 5254 B8R0.29 C[Si](C)(C)CCC(O)=O Amb19894136 [0,1,0,0,0,1|0,1,0]=3 5255 B8R0.29 C[Si](C)(C)CCC(O)=O Amb22274047 [0,1,0,0,0,1|0,1,0]=3 5256 B8R0.29 C[Si](C)(C)CCC([O-])=O Amb24121542 [0,1,0,0,0,1|0,1,1]=4 5257 B8R0.29 C[Si](C)(C)CNC(N)=O Amb19944636 [0,1,0,0,0,1|1,1,0]=4 5258 B8R0.29 C[Si](C)(C)COC(N)=O Amb25307228 [0,1,0,0,0,1|1,1,0]=4 5259 B8R0.29 C[Si](C)(C)OCC(=O)Cl Amb25281946 [0,1,0,0,0,1|1,1,0]=4 5260 B8R0.29 C[Si](C)(C)\C=C\C(O)=O Amb25380054 [0,1,0,0,0,1|0,1,1]=4 5261 B8R0.29 C[Si](C)(O)CCC(O)=O Amb24680973 [0,1,0,0,0,1|0,1,0]=3 5262 B8R0.29 ClC(=O)OCC(C)(C)C Amb10844667 [0,1,0,0,0,1|1,0,0]=3 5263 B8R0.29 NC(=O)C#CC(C)(C)C Amb10552858 [0,1,0,0,0,1|1,0,1]=4 5264 B8R0.29 OC(=O)CCC(Br)(F)F Amb10838819 [0,1,0,0,0,1|2,0,0]=4 5265 B8R0.29 OC(=O)CCC(F)(Cl)Cl Amb25062982 [0,1,0,0,0,1|2,0,0]=4 5266 B8R0.29 OC(=O)CCC(N)(C)C Amb13951332 [0,1,0,0,0,1|0,0,0]=2 5267 B8R0.29 OC(=O)CCP(=O)(O)C Amb1792559 [0,1,0,0,0,1|2,0,0]=4 5268 B8R0.29 OC(=O)CNC(C)(C)C Amb10610332 [0,1,0,0,0,1|0,0,0]=2 5269 B8R0.29 OC(=O)CNC(O)(O)O Amb24671331 [0,1,0,0,0,1|2,0,0]=4 5270 B8R0.29 OC(=O)CNS(=O)(=O)C Amb1120433 [0,1,0,0,0,1|2,0,0]=4 5271 B8R0.29 OC(=O)CSS(=O)(=O)C Amb17610576 [0,1,0,0,0,1|2,0,0]=4 5272 B8R0.29 [O-]C(=O)CC[Si](C)(C)C Amb10563760 [0,1,0,0,0,1|0,1,1]=4 5273 B8R0.29 [O-]C(=O)CNC(C)(C)C Amb10576193 [0,1,0,0,0,1|0,0,1]=3 5274 B8R0.2 C=C(C(O)CO)C(O)=O Amb18642874 [0,2,0,0,0,0|1,0,1]=4 5275 B8R0.2 C=CC(=C)C(C(C)C)O Amb10569073 [0,2,0,0,0,0|2,0,0]=4 5276 B8R0.2 C=CC(O)C(N)C(O)=O Amb18642830 [0,2,0,0,0,0|1,0,1]=4 5277 B8R0.2 C=C[C@@H](O)[C@H](N)C(O)=O Amb25111565 [0,2,0,0,0,0|1,0,1]=4 5278 B8R0.2 C=C[C@H](O)[C@H](N)C(O)=O Amb25328036 [0,2,0,0,0,0|1,0,1]=4 5279 B8R0.2 CC(=C)C(C)C(=O)CO Amb25262676 [0,2,0,0,0,0|0,0,2]=4 5280 B8R0.2 CC(=C)[C@@H](N)C(=O)OC Amb24744947 [0,2,0,0,0,0|0,0,2]=4 5281 B8R0.2 CC(=C=O)C(O)N(C)C Amb24456847 [0,2,0,0,0,0|2,0,0]=4 5282 B8R0.2 CC(=CO)C(=O)C(C)C Amb24610087 [0,2,0,0,0,0|1,0,1]=4 5283 B8R0.2 CC(=NO)C(=O)C(C)C Amb24564247 [0,2,0,0,0,0|1,0,1]=4 5284 B8R0.2 CC(=O)C(=C)C(C)CO Amb24588893 [0,2,0,0,0,0|1,0,1]=4 5285 B8R0.2 CC(=O)C(=C)[C@@H](C)CO Amb25064620 [0,2,0,0,0,0|1,0,1]=4 5286 B8R0.2 CC(=O)C(=O)C(C)OC Amb25730184 [0,2,0,0,0,0|1,0,1]=4 5287 B8R0.2 CC(=O)C(Br)C(=O)OC Amb22499701 [0,2,0,0,0,0|1,0,1]=4 5288 B8R0.2 CC(=O)C(C)C(=O)NO Amb24096632 [0,2,0,0,0,0|1,0,1]=4 5289 B8R0.2 CC(=O)C(N)C(=O)OC Amb21520335 [0,2,0,0,0,0|1,0,1]=4 5290 B8R0.2 CC(=O)C(N)C(=O)OC Amb22491080 [0,2,0,0,0,0|1,0,1]=4 5291 B8R0.2 CC(=O)C(O)C(=O)CO Amb25082771 [0,2,0,0,0,0|1,0,1]=4 5292 B8R0.2 CC(=O)C(O)C(Cl)CC Amb24588006 [0,2,0,0,0,0|2,0,0]=4 5293 B8R0.2 CC(=O)[C@H](C)C(=O)OC Amb24378331 [0,2,0,0,0,0|1,0,1]=4 5294 B8R0.2 CC(=O)[C@H](O)C(=O)CO Amb25756996 [0,2,0,0,0,0|1,0,1]=4 5295 B8R0.2 CC(=O)[C@H](O)[C@H](O)CO Amb24477828 [0,2,0,0,0,0|2,0,0]=4 5296 B8R0.2 CC(C#C)C(N)C(O)=O Amb25726710 [0,2,0,0,0,0|0,0,1]=3 5297 B8R0.2 CC(C#C)C(O)C(O)=O Amb24417906 [0,2,0,0,0,0|0,0,1]=3 5298 B8R0.2 CC(C#N)C(=O)C(O)=O Amb24680177 [0,2,0,0,0,0|0,0,2]=4 5299 B8R0.2 CC(C(C)Br)C(=O)OC Amb25046683 [0,2,0,0,0,0|1,0,0]=3 5300 B8R0.2 CC(C(C)C#C)C(N)=O Amb24683648 [0,2,0,0,0,0|1,0,1]=4 5301 B8R0.2 CC(C(C)C#C)C(O)=O Amb25848905 [0,2,0,0,0,0|0,0,1]=3 5302 B8R0.2 CC(C(C)C#N)C(O)=O Amb25062368 [0,2,0,0,0,0|0,0,1]=3 5303 B8R0.2 CC(C(C)C=C)C(C)=O Amb25732466 [0,2,0,0,0,0|1,0,1]=4 5304 B8R0.2 CC(C(C)C=C)C(O)=O Amb18642611 [0,2,0,0,0,0|0,0,1]=3 5305 B8R0.2 CC(C(C)C=O)C(O)=O Amb24468282 [0,2,0,0,0,0|0,0,1]=3 5306 B8R0.2 CC(C(C)CN)P(O)=O Amb24623943 [0,2,0,0,0,0|1,0,0]=3 5307 B8R0.2 CC(C(C)CO)C(C)=O Amb25127275 [0,2,0,0,0,0|1,0,0]=3 5308 B8R0.2 CC(C(C)Cl)C(=O)OC Amb24635801 [0,2,0,0,0,0|1,0,0]=3 5309 B8R0.2 CC(C(C)Cl)S(=O)OC Amb24480066 [0,2,0,0,0,0|2,0,0]=4 5310 B8R0.2 CC(C(C)N)C(=O)C#C Amb25232031 [0,2,0,0,0,0|2,0,0]=4 5311 B8R0.2 CC(C(C)N)C(=O)NC Amb25296975 [0,2,0,0,0,0|2,0,0]=4 5312 B8R0.2 CC(C(C)N)C(=O)NO Amb24355745 [0,2,0,0,0,0|1,0,0]=3 5313 B8R0.2 CC(C(C)N)C(=O)OC Amb18642841 [0,2,0,0,0,0|1,0,0]=3 5314 B8R0.2 CC(C(C)O)C(=O)OC Amb22059109 [0,2,0,0,0,0|1,0,0]=3 5315 B8R0.2 CC(C(C)S)C(=O)NN Amb25704051 [0,2,0,0,0,0|2,0,0]=4 5316 B8R0.2 CC(C(C)S)C(=O)OC Amb25682049 [0,2,0,0,0,0|1,0,0]=3 5317 B8R0.2 CC(C(F)CC)C(O)=O Amb25836213 [0,2,0,0,0,0|1,0,0]=3 5318 B8R0.2 CC(C(F)CN)P(O)=O Amb24524185 [0,2,0,0,0,0|2,0,0]=4 5319 B8R0.2 CC(C(N)=NO)N(C)C Amb25240509 [0,2,0,0,0,0|2,0,0]=4 5320 B8R0.2 CC(C(N)=O)N(C)CO Amb24744516 [0,2,0,0,0,0|2,0,0]=4 5321 B8R0.2 CC(C(N)CC)C(O)=O Amb18832531 [0,2,0,0,0,0|1,0,0]=3 5322 B8R0.2 CC(C(N)CN)C(O)=O Amb24532823 [0,2,0,0,0,0|1,0,0]=3 5323 B8R0.2 CC(C(O)=O)N(C)C=O Amb18284942 [0,2,0,0,0,0|1,0,1]=4 5324 B8R0.2 CC(C(O)=O)N(C)N=O Amb25041960 [0,2,0,0,0,0|2,0,0]=4 5325 B8R0.2 CC(C(O)C#C)C(O)=O Amb25123215 [0,2,0,0,0,0|1,0,1]=4 5326 B8R0.2 CC(C(O)C=C)C(O)=O Amb18642774 [0,2,0,0,0,0|1,0,1]=4 5327 B8R0.2 CC(C)=C(C)C(=O)OC Amb25706600 [0,2,0,0,0,0|0,0,2]=4 5328 B8R0.2 CC(C)C(=N)C(=O)C=C Amb25712901 [0,2,0,0,0,0|1,0,1]=4 5329 B8R0.2 CC(C)C(=O)C(=O)C=C Amb25346688 [0,2,0,0,0,0|1,0,1]=4 5330 B8R0.2 CC(C)C(=O)\C(\Cl)=N\O Amb25759621 [0,2,0,0,0,0|1,0,1]=4 5331 B8R0.2 CC(C)C(Br)C(=O)C#N Amb24711291 [0,2,0,0,0,0|1,0,0]=3 5332 B8R0.2 CC(C)C(Br)C(N)CO Amb25690781 [0,2,0,0,0,0|1,0,1]=4 5333 B8R0.2 CC(C)C(C)C(=O)C=C Amb25743709 [0,2,0,0,0,0|1,0,0]=3 5334 B8R0.2 CC(C)C(C)C(=O)CN Amb25147105 [0,2,0,0,0,0|1,0,0]=3 5335 B8R0.2 CC(C)C(C)C(=O)NC Amb25755854 [0,2,0,0,0,0|1,0,0]=3 5336 B8R0.2 CC(C)C(C)C(=O)NN Amb25212802 [0,2,0,0,0,0|1,0,0]=3 5337 B8R0.2 CC(C)C(C)C(C)C=O Amb24711554 [0,2,0,0,0,0|1,0,1]=4 5338 B8R0.2 CC(C)C(C)C(N)=NN Amb24477855 [0,2,0,0,0,0|2,0,0]=4 5339 B8R0.2 CC(C)C(C)C(O)C#C Amb25117071 [0,2,0,0,0,0|1,0,1]=4 5340 B8R0.2 CC(C)C(C)C(O)C#N Amb24458497 [0,2,0,0,0,0|1,0,1]=4 5341 B8R0.2 CC(C)C(C)C(O)C=C Amb25745421 [0,2,0,0,0,0|1,0,1]=4 5342 B8R0.2 CC(C)C(C)C(O)CC Amb25353205 [0,2,0,0,0,0|1,0,1]=4 5343 B8R0.2 CC(C)C(C)C(O)CO Amb25093306 [0,2,0,0,0,0|0,0,2]=4 5344 B8R0.2 CC(C)C(C)C(O)OC Amb24675326 [0,2,0,0,0,0|0,0,2]=4 5345 B8R0.2 CC(C)C(C)N(C)C=O Amb25147030 [0,2,0,0,0,0|2,0,0]=4 5346 B8R0.2 CC(C)C(Cl)C(=O)C#N Amb24739558 [0,2,0,0,0,0|1,0,0]=3 5347 B8R0.2 CC(C)C(Cl)C(=O)CCl Amb24596915 [0,2,0,0,0,0|1,0,0]=3 5348 B8R0.2 CC(C)C(Cl)C(=O)OC Amb18799367 [0,2,0,0,0,0|0,0,0]=2 5349 B8R0.2 CC(C)C(Cl)C(Cl)=NO Amb25053881 [0,2,0,0,0,0|1,0,0]=3 5350 B8R0.2 CC(C)C(Cl)\C(\C)=C\C Amb25108655 [0,2,0,0,0,0|2,0,0]=4 5351 B8R0.2 CC(C)C(Cl)\C(\C)=N\C Amb25299443 [0,2,0,0,0,0|2,0,0]=4 5352 B8R0.2 CC(C)C(F)C(=O)NC Amb24748061 [0,2,0,0,0,0|1,0,0]=3 5353 B8R0.2 CC(C)C(F)C(=O)NO Amb25092451 [0,2,0,0,0,0|0,0,0]=2 5354 B8R0.2 CC(C)C(F)C(=O)OC Amb25144176 [0,2,0,0,0,0|0,0,0]=2 5355 B8R0.2 CC(C)C(F)C(O)CO Amb24412920 [0,2,0,0,0,0|0,0,2]=4 5356 B8R0.2 CC(C)C(N)C(=C)CC Amb23536644 [0,2,0,0,0,0|2,0,0]=4 5357 B8R0.2 CC(C)C(N)C(=O)C#C Amb24376987 [0,2,0,0,0,0|1,0,0]=3 5358 B8R0.2 CC(C)C(N)C(=O)C=C Amb25315007 [0,2,0,0,0,0|1,0,0]=3 5359 B8R0.2 CC(C)C(N)C(=O)CC Amb23536939 [0,2,0,0,0,0|1,0,0]=3 5360 B8R0.2 CC(C)C(N)C(=O)CCl Amb18644035 [0,2,0,0,0,0|1,0,0]=3 5361 B8R0.2 CC(C)C(N)C(=O)NC Amb20668407 [0,2,0,0,0,0|1,0,0]=3 5362 B8R0.2 CC(C)C(N)C(=O)NN Amb18061950 [0,2,0,0,0,0|1,0,0]=3 5363 B8R0.2 CC(C)C(N)C(=O)OCl Amb25211695 [0,2,0,0,0,0|0,0,0]=2 5364 B8R0.2 CC(C)C(N)C(C)=C=C Amb24480326 [0,2,0,0,0,0|2,0,0]=4 5365 B8R0.2 CC(C)C(N)C(O)C#C Amb25102594 [0,2,0,0,0,0|1,0,1]=4 5366 B8R0.2 CC(C)C(N)C(O)CC Amb23536962 [0,2,0,0,0,0|1,0,1]=4 5367 B8R0.2 CC(C)C(O)C(=C)C=O Amb25830547 [0,2,0,0,0,0|1,0,0]=3 5368 B8R0.2 CC(C)C(O)C(=C)CBr Amb25162172 [0,2,0,0,0,0|2,0,0]=4 5369 B8R0.2 CC(C)C(O)C(=C)CN Amb25304286 [0,2,0,0,0,0|2,0,0]=4 5370 B8R0.2 CC(C)C(O)C(=O)NC Amb24743373 [0,2,0,0,0,0|1,0,0]=3 5371 B8R0.2 CC(C)C(O)C(=O)NO Amb25071171 [0,2,0,0,0,0|0,0,0]=2 5372 B8R0.2 CC(C)C(O)C(=O)OC Amb24093829 [0,2,0,0,0,0|0,0,0]=2 5373 B8R0.2 CC(C)C(O)C(C)=C=C Amb25357486 [0,2,0,0,0,0|2,0,0]=4 5374 B8R0.2 CC(C)C(O)C(C)C=O Amb18642804 [0,2,0,0,0,0|1,0,1]=4 5375 B8R0.2 CC(C)C(O)C(C)OC Amb24463235 [0,2,0,0,0,0|1,0,1]=4 5376 B8R0.2 CC(C)C(O)C(N)C=O Amb24540093 [0,2,0,0,0,0|1,0,1]=4 5377 B8R0.2 CC(C)C(O)C(N)CO Amb18124387 [0,2,0,0,0,0|1,0,1]=4 5378 B8R0.2 CC(C)C(O)C(O)CO Amb24471450 [0,2,0,0,0,0|0,0,2]=4 5379 B8R0.2 CC(C)C(O)\C(\N)=N/O Amb19737368 [0,2,0,0,0,0|1,0,0]=3 5380 B8R0.2 CC(C)C(S)C(=O)NN Amb25130001 [0,2,0,0,0,0|1,0,0]=3 5381 B8R0.2 CC(C)N(C)C(=O)C#C Amb25730850 [0,2,0,0,0,0|2,0,0]=4 5382 B8R0.2 CC(C)N(C)C(=O)CI Amb25278164 [0,2,0,0,0,0|2,0,0]=4 5383 B8R0.2 CC(C)N(O)C(=O)CN Amb25324350 [0,2,0,0,0,0|2,0,0]=4 5384 B8R0.2 CC(C)[C@@H](Br)[C@@H](N)CO Amb24480089 [0,2,0,0,0,0|1,0,1]=4 5385 B8R0.2 CC(C)[C@@H](C)[C@H](O)CC Amb25332389 [0,2,0,0,0,0|1,0,1]=4 5386 B8R0.2 CC(C)[C@@H](Cl)[C@@H](N)CO Amb24738832 [0,2,0,0,0,0|1,0,1]=4 5387 B8R0.2 CC(C)[C@@H](Cl)[C@@H](O)CO Amb25264604 [0,2,0,0,0,0|0,0,2]=4 5388 B8R0.2 CC(C)[C@@H](N)C(=O)CCl Amb24744707 [0,2,0,0,0,0|1,0,0]=3 5389 B8R0.2 CC(C)[C@@H](N)C(=O)NC Amb18538476 [0,2,0,0,0,0|1,0,0]=3 5390 B8R0.2 CC(C)[C@@H](N)C(=O)NO Amb24476696 [0,2,0,0,0,0|0,0,0]=2 5391 B8R0.2 CC(C)[C@@H](O)C(=C)C=C Amb24613827 [0,2,0,0,0,0|2,0,0]=4 5392 B8R0.2 CC(C)[C@@H](O)C(=O)NN Amb25725418 [0,2,0,0,0,0|1,0,0]=3 5393 B8R0.2 CC(C)[C@@H](O)C(=O)OC Amb22388621 [0,2,0,0,0,0|0,0,0]=2 5394 B8R0.2 CC(C)[C@@H](O)C(C)C=O Amb24741875 [0,2,0,0,0,0|1,0,1]=4 5395 B8R0.2 CC(C)[C@@H](O)[C@@H](C)C=O Amb24694088 [0,2,0,0,0,0|1,0,1]=4 5396 B8R0.2 CC(C)[C@@H](O)[C@@H](C)CO Amb24642403 [0,2,0,0,0,0|1,0,1]=4 5397 B8R0.2 CC(C)[C@@H](O)[C@@H](O)CO Amb25283235 [0,2,0,0,0,0|0,0,2]=4 5398 B8R0.2 CC(C)[C@@H](O)[C@H](N)CO Amb25673750 [0,2,0,0,0,0|1,0,1]=4 5399 B8R0.2 CC(C)[C@@H](O)[C@H](O)C=C Amb24554521 [0,2,0,0,0,0|1,0,1]=4 5400 B8R0.2 CC(C)[C@@H](O)\C(\C)=C/C Amb24718291 [0,2,0,0,0,0|2,0,0]=4 5401 B8R0.2 CC(C)[C@H](C)C(=O)CC Amb25116502 [0,2,0,0,0,0|1,0,0]=3 5402 B8R0.2 CC(C)[C@H](Cl)[C@@H](O)CO Amb24753484 [0,2,0,0,0,0|0,0,2]=4 5403 B8R0.2 CC(C)[C@H](N)C(=O)OBr Amb25337637 [0,2,0,0,0,0|0,0,0]=2 5404 B8R0.2 CC(C)[C@H](N)C(C)=C=C Amb24477813 [0,2,0,0,0,0|2,0,0]=4 5405 B8R0.2 CC(C)[C@H](N)[C@@H](O)CC Amb24477738 [0,2,0,0,0,0|1,0,1]=4 5406 B8R0.2 CC(C)[C@H](N)[C@H](O)C#C Amb25077166 [0,2,0,0,0,0|1,0,1]=4 5407 B8R0.2 CC(C)[C@H](N)[C@H](O)C=C Amb24476694 [0,2,0,0,0,0|1,0,1]=4 5408 B8R0.2 CC(C)[C@H](N)[C@H](O)CCl Amb25293165 [0,2,0,0,0,0|1,0,1]=4 5409 B8R0.2 CC(C)[C@H](O)C(=C)C=C Amb25731006 [0,2,0,0,0,0|2,0,0]=4 5410 B8R0.2 CC(C)[C@H](O)C(=O)OC Amb22228179 [0,2,0,0,0,0|0,0,0]=2 5411 B8R0.2 CC(C)[C@H](O)C(C)CO Amb25255977 [0,2,0,0,0,0|1,0,1]=4 5412 B8R0.2 CC(C)[C@H](O)[C@@H](C)CO Amb25356836 [0,2,0,0,0,0|1,0,1]=4 5413 B8R0.2 CC(C=C)C(Br)C(O)=O Amb25102712 [0,2,0,0,0,0|0,0,1]=3 5414 B8R0.2 CC(C=C)C(F)C(C)=O Amb25839816 [0,2,0,0,0,0|1,0,1]=4 5415 B8R0.2 CC(C=C)C(F)C(O)=O Amb24426918 [0,2,0,0,0,0|0,0,1]=3 5416 B8R0.2 CC(C=C)C(N)C(O)=O Amb18989861 [0,2,0,0,0,0|0,0,1]=3 5417 B8R0.2 CC(C=C)C(O)C(O)=O Amb18642750 [0,2,0,0,0,0|0,0,1]=3 5418 B8R0.2 CC(C=O)C(N)C(O)=O Amb24374650 [0,2,0,0,0,0|0,0,1]=3 5419 B8R0.2 CC(CBr)N(C)C(C)=O Amb25303453 [0,2,0,0,0,0|2,0,0]=4 5420 B8R0.2 CC(CC)=C(F)C(O)=O Amb25305731 [0,2,0,0,0,0|0,0,2]=4 5421 B8R0.2 CC(CC)C(Cl)C(=O)Cl Amb24635851 [0,2,0,0,0,0|1,0,0]=3 5422 B8R0.2 CC(CC)C(N)C(=O)S Amb24753871 [0,2,0,0,0,0|0,1,0]=3 5423 B8R0.2 CC(CC)C(N)C(N)=S Amb19374909 [0,2,0,0,0,0|1,1,0]=4 5424 B8R0.2 CC(CC)C(N)P(O)=O Amb24480138 [0,2,0,0,0,0|1,0,0]=3 5425 B8R0.2 CC(CC)C(N)P(O)O Amb24739487 [0,2,0,0,0,0|1,0,1]=4 5426 B8R0.2 CC(CC)C(O)C(C)=C Amb24478684 [0,2,0,0,0,0|2,0,0]=4 5427 B8R0.2 CC(CC)C(O)C(N)=O Amb24112761 [0,2,0,0,0,0|1,0,0]=3 5428 B8R0.2 CC(CC)C(O)C(O)=O Amb18288809 [0,2,0,0,0,0|0,0,0]=2 5429 B8R0.2 CC(CC)C([15NH2])C(O)=O Amb22732430 [0,2,0,0,0,0|0,0,0]=2 5430 B8R0.2 CC(CC)[C@@H](Br)C(O)=O Amb25706427 [0,2,0,0,0,0|0,0,0]=2 5431 B8R0.2 CC(CC)[C@@H](Cl)C(O)=O Amb25360795 [0,2,0,0,0,0|0,0,0]=2 5432 B8R0.2 CC(CC)[C@@H](N)C(N)=O Amb18538475 [0,2,0,0,0,0|1,0,0]=3 5433 B8R0.2 CC(CC)[C@@H](O)C(O)=O Amb25083795 [0,2,0,0,0,0|0,0,0]=2 5434 B8R0.2 CC(CC)[C@@H]([NH3+])C(N)=S Amb23437729 [0,2,0,0,0,0|1,1,0]=4 5435 B8R0.2 CC(CC)[C@H](F)C(O)=O Amb25679990 [0,2,0,0,0,0|0,0,0]=2 5436 B8R0.2 CC(CC)[C@H](O)C(O)=O Amb24700212 [0,2,0,0,0,0|0,0,0]=2 5437 B8R0.2 CC(CCl)N(C)C(C)=O Amb25329970 [0,2,0,0,0,0|2,0,0]=4 5438 B8R0.2 CC(CCl)[C@H](N)C(O)=O Amb24458196 [0,2,0,0,0,0|0,0,0]=2 5439 B8R0.2 CC(CF)C(N)C(O)=O Amb25223334 [0,2,0,0,0,0|0,0,0]=2 5440 B8R0.2 CC(CN)C(N)C(O)=O Amb25824065 [0,2,0,0,0,0|0,0,0]=2 5441 B8R0.2 CC(CN)C(O)C(C)=C Amb25102667 [0,2,0,0,0,0|2,0,0]=4 5442 B8R0.2 CC(CN)C(O)C(O)=O Amb18642919 [0,2,0,0,0,0|0,0,0]=2 5443 B8R0.2 CC(CN)N(C)C(C)=O Amb18251128 [0,2,0,0,0,0|2,0,0]=4 5444 B8R0.2 CC(CN)N(C)C(N)=O Amb18251133 [0,2,0,0,0,0|2,0,0]=4 5445 B8R0.2 CC(CO)=C(N)C(O)=O Amb25031515 [0,2,0,0,0,0|0,0,2]=4 5446 B8R0.2 CC(CO)=C(O)C(O)=O Amb25757908 [0,2,0,0,0,0|0,0,2]=4 5447 B8R0.2 CC(CO)N(C)C(N)=O Amb24481821 [0,2,0,0,0,0|2,0,0]=4 5448 B8R0.2 CC(CO)[C@@H](O)C(C)=C Amb25284368 [0,2,0,0,0,0|2,0,0]=4 5449 B8R0.2 CC(Cl)C(Br)C(=O)OC Amb25123870 [0,2,0,0,0,0|1,0,0]=3 5450 B8R0.2 CC(Cl)C(N)C(=O)OC Amb18644494 [0,2,0,0,0,0|1,0,0]=3 5451 B8R0.2 CC(Cl)C(S)C(=O)OC Amb24595377 [0,2,0,0,0,0|1,0,0]=3 5452 B8R0.2 CC(F)C(Br)C(=O)OC Amb25086610 [0,2,0,0,0,0|1,0,0]=3 5453 B8R0.2 CC(F)C(O)C(=O)OC Amb24648246 [0,2,0,0,0,0|1,0,0]=3 5454 B8R0.2 CC(N)C(C)C(=O)NN Amb25189012 [0,2,0,0,0,0|2,0,0]=4 5455 B8R0.2 CC(N)C(O)C(=O)NC Amb24752298 [0,2,0,0,0,0|2,0,0]=4 5456 B8R0.2 CC(NC)C(N)C(O)=O Amb18642890 [0,2,0,0,0,0|0,0,0]=2 5457 B8R0.2 CC(NC)C(O)C(C)=C Amb25311078 [0,2,0,0,0,0|2,0,0]=4 5458 B8R0.2 CC(NC)C(O)C(O)=O Amb24477689 [0,2,0,0,0,0|0,0,0]=2 5459 B8R0.2 CC(O)C(=O)C(=O)CO Amb24408420 [0,2,0,0,0,0|1,0,1]=4 5460 B8R0.2 CC(O)C(Br)C(=O)OC Amb24415051 [0,2,0,0,0,0|1,0,0]=3 5461 B8R0.2 CC(O)C(Br)C(C)CO Amb25799666 [0,2,0,0,0,0|1,0,1]=4 5462 B8R0.2 CC(O)C(Cl)C(=O)OC Amb25269533 [0,2,0,0,0,0|1,0,0]=3 5463 B8R0.2 CC(O)C(F)C(=O)OC Amb24481911 [0,2,0,0,0,0|1,0,0]=3 5464 B8R0.2 CC(O)C(N)C(=O)NC Amb24705029 [0,2,0,0,0,0|2,0,0]=4 5465 B8R0.2 CC(O)C(N)C(=O)NN Amb25343283 [0,2,0,0,0,0|2,0,0]=4 5466 B8R0.2 CC(O)C(N)C(O)=NO Amb24539768 [0,2,0,0,0,0|1,0,1]=4 5467 B8R0.2 CC(O)C(O)C(C)CC Amb25818364 [0,2,0,0,0,0|1,0,1]=4 5468 B8R0.2 CC(O)C(O)C(O)C=O Amb24711583 [0,2,0,0,0,0|1,0,1]=4 5469 B8R0.2 CC(O)[C@H](N)C(=O)NC Amb25366384 [0,2,0,0,0,0|2,0,0]=4 5470 B8R0.2 CC(O)[C@H](N)C(=O)OC Amb25213074 [0,2,0,0,0,0|1,0,0]=3 5471 B8R0.2 CC(OC)C(Cl)C(C)=O Amb24480084 [0,2,0,0,0,0|1,0,0]=3 5472 B8R0.2 CC(OC)C(O)C(C)=C Amb24690397 [0,2,0,0,0,0|2,0,0]=4 5473 B8R0.2 CC(OC)C(O)C(N)=O Amb25706543 [0,2,0,0,0,0|1,0,0]=3 5474 B8R0.2 CC(OC)[C@@H](N)C(O)=O Amb25733335 [0,2,0,0,0,0|0,0,0]=2 5475 B8R0.2 CC(SC)C(N)C(O)=O Amb22228563 [0,2,0,0,0,0|0,0,0]=2 5476 B8R0.2 CC([C@@H](C)O)C(=O)OC Amb25077967 [0,2,0,0,0,0|1,0,0]=3 5477 B8R0.2 CC([C@H](C)O)C(=O)OC Amb25788911 [0,2,0,0,0,0|1,0,0]=3 5478 B8R0.2 CCC(=C)C(C)C(O)=O Amb25228831 [0,2,0,0,0,0|0,0,2]=4 5479 B8R0.2 CCC(=C)C(N)C(O)=O Amb18642707 [0,2,0,0,0,0|0,0,2]=4 5480 B8R0.2 CCC(=C)[C@H](N)C(O)=O Amb25828765 [0,2,0,0,0,0|0,0,2]=4 5481 B8R0.2 CCC(=O)C(C)N(C)C Amb25849660 [0,2,0,0,0,0|2,0,0]=4 5482 B8R0.2 CCC(=S)[C@H](N)C(O)=O Amb25111086 [0,2,0,0,0,0|1,0,1]=4 5483 B8R0.2 CCC(Br)C(Br)C(O)=O Amb24478770 [0,2,0,0,0,0|1,0,0]=3 5484 B8R0.2 CCC(C(C(=O)N)N)C Amb1105283 [0,2,0,0,0,0|1,0,0]=3 5485 B8R0.2 CCC(C(C(=O)N)N)C Amb1152621 [0,2,0,0,0,0|1,0,0]=3 5486 B8R0.2 CCC(C(C(=O)O)C)O Amb10844267 [0,2,0,0,0,0|1,0,0]=3 5487 B8R0.2 CCC(C(C(=O)O)Cl)C Amb17593752 [0,2,0,0,0,0|0,0,0]=2 5488 B8R0.2 CCC(C)C(=C)C(O)=O Amb18642655 [0,2,0,0,0,0|0,0,1]=3 5489 B8R0.2 CCC(C)C(=O)C(O)=O Amb22731530 [0,2,0,0,0,0|0,0,1]=3 5490 B8R0.2 CCC(C)C(=O)C([O-])=O Amb22055837 [0,2,0,0,0,0|0,0,2]=4 5491 B8R0.2 CCC(C)C(C)C(N)=O Amb24746800 [0,2,0,0,0,0|1,0,0]=3 5492 B8R0.2 CCC(C)C(C)C(N)=S Amb24504575 [0,2,0,0,0,0|1,1,0]=4 5493 B8R0.2 CCC(C)C(C)C(O)=O Amb18290719 [0,2,0,0,0,0|0,0,0]=2 5494 B8R0.2 CCC(C)N(C)C(=O)Cl Amb25680235 [0,2,0,0,0,0|2,0,0]=4 5495 B8R0.2 CCC(C)[C@H](C)[C@H](C)O Amb24748768 [0,2,0,0,0,0|1,0,1]=4 5496 B8R0.2 CCC(F)C(N)C(O)=O Amb24764202 [0,2,0,0,0,0|1,0,0]=3 5497 B8R0.2 CCC(N)C(=C)C(O)=O Amb24558624 [0,2,0,0,0,0|1,0,1]=4 5498 B8R0.2 CCC(O)C(N)C(O)=O Amb18203168 [0,2,0,0,0,0|1,0,0]=3 5499 B8R0.2 CCC(O)C(O)C(C)=O Amb24736298 [0,2,0,0,0,0|2,0,0]=4 5500 B8R0.2 CCC(O)C(O)C(O)=O Amb24441607 [0,2,0,0,0,0|1,0,0]=3 5501 B8R0.2 CCC(O)[C@@H](N)C(O)=O Amb22750712 [0,2,0,0,0,0|1,0,0]=3 5502 B8R0.2 CCC(O)[C@H](N)C(O)=O Amb24364655 [0,2,0,0,0,0|1,0,0]=3 5503 B8R0.2 CCC(S)C(N)C(O)=O Amb24365228 [0,2,0,0,0,0|1,0,0]=3 5504 B8R0.2 CCC(S)[C@@H](N)C(O)=O Amb24604283 [0,2,0,0,0,0|1,0,0]=3 5505 B8R0.2 CCC([13CH3])[13C](=O)[13C]([O-])=O Amb22055838 [0,2,0,0,0,0|0,0,2]=4 5506 B8R0.2 CCC([C@@H](C(=O)N)N)C Amb17231868 [0,2,0,0,0,0|1,0,0]=3 5507 B8R0.2 CCC([C@@H](C(=O)O)C)C Amb10844495 [0,2,0,0,0,0|0,0,0]=2 5508 B8R0.2 CCC([C@@H](C(=O)O)N)C Amb10844501 [0,2,0,0,0,0|0,0,0]=2 5509 B8R0.2 CCC([C@H](C(=O)O)N)C Amb10844500 [0,2,0,0,0,0|0,0,0]=2 5510 B8R0.2 CCN(C)C(C)C(N)=O Amb24467965 [0,2,0,0,0,0|2,0,0]=4 5511 B8R0.2 CCN(C)[C@H](C)C(O)=O Amb25073540 [0,2,0,0,0,0|1,0,0]=3 5512 B8R0.2 CCS(=O)C(C)C(O)=O Amb18984976 [0,2,0,0,0,0|2,0,0]=4 5513 B8R0.2 CC[C@@H](C)C(=O)C(O)=O Amb25129590 [0,2,0,0,0,0|0,0,1]=3 5514 B8R0.2 CC[C@@H](C)[C@H](C)C(C)=O Amb25024740 [0,2,0,0,0,0|1,0,0]=3 5515 B8R0.2 CC[C@@H](N)[C@H](O)C(O)=O Amb22831530 [0,2,0,0,0,0|1,0,0]=3 5516 B8R0.2 CC[C@@H](O)[C@@H](N)C(O)=O Amb24087716 [0,2,0,0,0,0|1,0,0]=3 5517 B8R0.2 CC[C@@H](O)[C@H](N)C(N)=O Amb24670277 [0,2,0,0,0,0|2,0,0]=4 5518 B8R0.2 CC[C@@H](O)[C@H](N)C(O)=O Amb24105353 [0,2,0,0,0,0|1,0,0]=3 5519 B8R0.2 CC[C@@H](O)[C@H](O)C(O)=O Amb24431211 [0,2,0,0,0,0|1,0,0]=3 5520 B8R0.2 CC[C@@H]([C@@H](C(=O)N)N)C Amb10878815 [0,2,0,0,0,0|1,0,0]=3 5521 B8R0.2 CC[C@@H]([C@@H](C(=O)O)Br)Br Amb16233350 [0,2,0,0,0,0|1,0,0]=3 5522 B8R0.2 CC[C@@H]([C@@H](C(=O)O)C)C Amb10844498 [0,2,0,0,0,0|0,0,0]=2 5523 B8R0.2 CC[C@@H]([C@H](C(=O)O)O)C Amb10576171 [0,2,0,0,0,0|0,0,0]=2 5524 B8R0.2 CC[C@H](C)C(=C)C(O)=O Amb24699439 [0,2,0,0,0,0|0,0,1]=3 5525 B8R0.2 CC[C@H](C)[C@@H](C)C(O)=O Amb25056174 [0,2,0,0,0,0|0,0,0]=2 5526 B8R0.2 CC[C@H](C)[C@H](C)C(N)=O Amb25076764 [0,2,0,0,0,0|1,0,0]=3 5527 B8R0.2 CC[C@H](N)C(=C)C(O)=O Amb24468573 [0,2,0,0,0,0|1,0,1]=4 5528 B8R0.2 CC[C@H](N)[C@@H](O)C(O)=O Amb24449588 [0,2,0,0,0,0|1,0,0]=3 5529 B8R0.2 CC[C@H](N)[C@H](O)C(O)=O Amb24477817 [0,2,0,0,0,0|1,0,0]=3 5530 B8R0.2 CC[C@H](O)[C@H](N)C(N)=O Amb25113391 [0,2,0,0,0,0|2,0,0]=4 5531 B8R0.2 CC[C@H]([C@@H](C(=O)O)N)C Amb10068321 [0,2,0,0,0,0|0,0,0]=2 5532 B8R0.2 CN(C)C(=C)C(=O)OC Amb22733347 [0,2,0,0,0,0|1,0,1]=4 5533 B8R0.2 CN(C=O)C(O)C(O)=O Amb24069122 [0,2,0,0,0,0|1,0,1]=4 5534 B8R0.2 CNC(=O)N(C)C(C)C Amb25691717 [0,2,0,0,0,0|2,0,0]=4 5535 B8R0.2 CNC(=O)[C@H](C(C)C)N Amb17231869 [0,2,0,0,0,0|1,0,0]=3 5536 B8R0.2 CNC(=O)[C@H](C)N(C)C Amb24606877 [0,2,0,0,0,0|2,0,0]=4 5537 B8R0.2 CNC(C)C(C)C(O)=O Amb25342967 [0,2,0,0,0,0|0,0,0]=2 5538 B8R0.2 CN[C@@H](C)[C@H](C)C(O)=O Amb25676912 [0,2,0,0,0,0|0,0,0]=2 5539 B8R0.2 COC(=N)N(C)C(C)C Amb25270125 [0,2,0,0,0,0|2,0,0]=4 5540 B8R0.2 COC(=O)C(=C(C)C)Br Amb17610027 [0,2,0,0,0,0|0,0,2]=4 5541 B8R0.2 COC(=O)C(=C)C(C)O Amb22351732 [0,2,0,0,0,0|1,0,1]=4 5542 B8R0.2 COC(=O)C(=O)C(Br)C Amb17621489 [0,2,0,0,0,0|1,0,1]=4 5543 B8R0.2 COC(=O)C(=O)C(C)C Amb17935756 [0,2,0,0,0,0|0,0,1]=3 5544 B8R0.2 COC(=O)C(=O)N(C)C Amb25085299 [0,2,0,0,0,0|1,0,1]=4 5545 B8R0.2 COC(=O)C(C(C)C)N Amb1104996 [0,2,0,0,0,0|0,0,0]=2 5546 B8R0.2 COC(=O)C(C)C(C)=O Amb17939472 [0,2,0,0,0,0|1,0,1]=4 5547 B8R0.2 COC(=O)C(C)C(O)=O Amb18642868 [0,2,0,0,0,0|1,0,1]=4 5548 B8R0.2 COC(=O)C(C)S(C)=O Amb18181669 [0,2,0,0,0,0|2,0,0]=4 5549 B8R0.2 COC(=O)C(F)C(Cl)Cl Amb25691403 [0,2,0,0,0,0|2,0,0]=4 5550 B8R0.2 COC(=O)C(F)C(F)Cl Amb24480201 [0,2,0,0,0,0|2,0,0]=4 5551 B8R0.2 COC(=O)C(N)C(F)F Amb25208569 [0,2,0,0,0,0|2,0,0]=4 5552 B8R0.2 COC(=O)C(N)C(O)=O Amb22491276 [0,2,0,0,0,0|1,0,1]=4 5553 B8R0.2 COC(=O)C(O)C(F)F Amb24747328 [0,2,0,0,0,0|2,0,0]=4 5554 B8R0.2 COC(=O)C(O)C(O)=O Amb25255680 [0,2,0,0,0,0|1,0,1]=4 5555 B8R0.2 COC(=O)[C@@H](C(C)C)N Amb10604149 [0,2,0,0,0,0|0,0,0]=2 5556 B8R0.2 COC(=O)[C@@H](C(C)C)N Amb16183873 [0,2,0,0,0,0|0,0,0]=2 5557 B8R0.2 COC(=O)[C@H](N)C(O)=O Amb24695000 [0,2,0,0,0,0|1,0,1]=4 5558 B8R0.2 COC(=O)[C@H]([C@H](O)C)N Amb10844890 [0,2,0,0,0,0|1,0,0]=3 5559 B8R0.2 COC(C(C(=O)O)Br)C Amb16233352 [0,2,0,0,0,0|0,0,0]=2 5560 B8R0.2 COC(C(C(=O)O)C)C Amb10844268 [0,2,0,0,0,0|0,0,0]=2 5561 B8R0.2 COC(C)C(=C)C(O)=O Amb25706403 [0,2,0,0,0,0|0,0,1]=3 5562 B8R0.2 COC(C)C(N)C(O)=O Amb17938689 [0,2,0,0,0,0|0,0,0]=2 5563 B8R0.2 COC(C)[C@H](C)C(O)=O Amb25722336 [0,2,0,0,0,0|0,0,0]=2 5564 B8R0.2 CO[C@@H](C)C(=O)C(O)=O Amb24597638 [0,2,0,0,0,0|0,0,1]=3 5565 B8R0.2 CO[C@@H](C)[C@@H](C)C(O)=O Amb25263126 [0,2,0,0,0,0|0,0,0]=2 5566 B8R0.2 CO[C@@H](Cl)[C@H](Cl)C(C)=O Amb25162294 [0,2,0,0,0,0|2,0,0]=4 5567 B8R0.2 CO[C@@H]([C@@H](C(=O)O)N)C Amb16183892 [0,2,0,0,0,0|0,0,0]=2 5568 B8R0.2 CO[C@@H]([C@H](C(=O)O)N)C Amb10603094 [0,2,0,0,0,0|0,0,0]=2 5569 B8R0.2 CO[C@H](C)[C@H](C)C(O)=O Amb24358364 [0,2,0,0,0,0|0,0,0]=2 5570 B8R0.2 CO[C@H]([C@@H](C(=O)O)C)C Amb10844258 [0,2,0,0,0,0|0,0,0]=2 5571 B8R0.2 CSC(C)C(C)C(O)=O Amb18644375 [0,2,0,0,0,0|0,0,0]=2 5572 B8R0.2 CS[C@@H](C)[C@H](C)C(O)=O Amb24552609 [0,2,0,0,0,0|0,0,0]=2 5573 B8R0.2 C[C@@H](C#C)[C@H](N)C(O)=O Amb25783160 [0,2,0,0,0,0|0,0,1]=3 5574 B8R0.2 C[C@@H](C(=O)NN)N(C)C Amb25266060 [0,2,0,0,0,0|2,0,0]=4 5575 B8R0.2 C[C@@H](C(O)=O)N(C)C=O Amb24558225 [0,2,0,0,0,0|1,0,1]=4 5576 B8R0.2 C[C@@H](C=C)[C@H](N)C(O)=O Amb24340139 [0,2,0,0,0,0|0,0,1]=3 5577 B8R0.2 C[C@@H](C=O)[C@H](N)C(O)=O Amb25142449 [0,2,0,0,0,0|0,0,1]=3 5578 B8R0.2 C[C@@H](CC)C(=O)C([O-])=O Amb22757032 [0,2,0,0,0,0|0,0,2]=4 5579 B8R0.2 C[C@@H](CC)C(Br)C(O)=O Amb24635596 [0,2,0,0,0,0|0,0,0]=2 5580 B8R0.2 C[C@@H](CC)C(F)C(O)=O Amb25042866 [0,2,0,0,0,0|0,0,0]=2 5581 B8R0.2 C[C@@H](CC)C(O)C(O)=O Amb25088995 [0,2,0,0,0,0|0,0,0]=2 5582 B8R0.2 C[C@@H](CC)[C@@H](Br)C(O)=O Amb23401386 [0,2,0,0,0,0|0,0,0]=2 5583 B8R0.2 C[C@@H](CC)[C@@H](S)C(O)=O Amb24388715 [0,2,0,0,0,0|0,0,0]=2 5584 B8R0.2 C[C@@H](CC)[C@H](Cl)C(O)=O Amb22388560 [0,2,0,0,0,0|0,0,0]=2 5585 B8R0.2 C[C@@H](CC)[C@H](N)C(O)=O Amb22351114 [0,2,0,0,0,0|0,0,0]=2 5586 B8R0.2 C[C@@H](CC)[C@H]([15NH2])C(O)=O Amb22337867 [0,2,0,0,0,0|0,0,0]=2 5587 B8R0.2 C[C@@H](CN)N(C)C(C)=O Amb25172190 [0,2,0,0,0,0|2,0,0]=4 5588 B8R0.2 C[C@@H](CO)[C@@H](N)C(O)=O Amb24117487 [0,2,0,0,0,0|0,0,0]=2 5589 B8R0.2 C[C@@H](CO)[C@H](N)C(O)=O Amb24117488 [0,2,0,0,0,0|0,0,0]=2 5590 B8R0.2 C[C@@H](Cl)[C@@H](N)C(=O)NO Amb24694002 [0,2,0,0,0,0|1,0,0]=3 5591 B8R0.2 C[C@@H](Cl)[C@H](Cl)C(=O)OC Amb24366616 [0,2,0,0,0,0|1,0,0]=3 5592 B8R0.2 C[C@@H](Cl)[C@H](O)C(=O)OC Amb25347697 [0,2,0,0,0,0|1,0,0]=3 5593 B8R0.2 C[C@@H](NC)[C@H](N)C(O)=O Amb24477707 [0,2,0,0,0,0|0,0,0]=2 5594 B8R0.2 C[C@@H](NC)[C@H](O)C(C)=C Amb25849330 [0,2,0,0,0,0|2,0,0]=4 5595 B8R0.2 C[C@@H](NC)[C@H](O)C(O)=O Amb25146143 [0,2,0,0,0,0|0,0,0]=2 5596 B8R0.2 C[C@@H](O)[C@@H](Br)[C@H](C)CO Amb24480008 [0,2,0,0,0,0|1,0,1]=4 5597 B8R0.2 C[C@@H](O)[C@@H](Cl)C(=O)OC Amb24479996 [0,2,0,0,0,0|1,0,0]=3 5598 B8R0.2 C[C@@H](O)[C@@H](N)C(=O)OC Amb22744992 [0,2,0,0,0,0|1,0,0]=3 5599 B8R0.2 C[C@@H](O)[C@@H](O)C(=O)OC Amb25320663 [0,2,0,0,0,0|1,0,0]=3 5600 B8R0.2 C[C@@H](O)[C@@H](O)[C@H](C)CC Amb24389196 [0,2,0,0,0,0|1,0,1]=4 5601 B8R0.2 C[C@@H](O)[C@@H](O)[C@H](O)C=O Amb22229972 [0,2,0,0,0,0|1,0,1]=4 5602 B8R0.2 C[C@@H](O)[C@H](Br)C(=O)OC Amb25109342 [0,2,0,0,0,0|1,0,0]=3 5603 B8R0.2 C[C@@H](O)[C@H](N)C(=O)NC Amb24671233 [0,2,0,0,0,0|2,0,0]=4 5604 B8R0.2 C[C@@H](O)[C@H](N)C(=O)NO Amb22800603 [0,2,0,0,0,0|1,0,0]=3 5605 B8R0.2 C[C@@H](O)[C@H](O)C(=O)CO Amb24625788 [0,2,0,0,0,0|1,0,0]=3 5606 B8R0.2 C[C@@H](O)[C@H](O)[C@@H](O)C=O Amb25803604 [0,2,0,0,0,0|1,0,1]=4 5607 B8R0.2 C[C@@H](OC)[C@@H](N)C(O)=O Amb23438804 [0,2,0,0,0,0|0,0,0]=2 5608 B8R0.2 C[C@@H](OC)[C@H](Br)C(=O)Cl Amb25325034 [0,2,0,0,0,0|1,0,0]=3 5609 B8R0.2 C[C@@H](OC)[C@H](Cl)C(O)=O Amb25701678 [0,2,0,0,0,0|0,0,0]=2 5610 B8R0.2 C[C@@H](OC)[C@H](N)C(O)=O Amb23438882 [0,2,0,0,0,0|0,0,0]=2 5611 B8R0.2 C[C@@H](OC)[C@H](O)C(O)=O Amb25316180 [0,2,0,0,0,0|0,0,0]=2 5612 B8R0.2 C[C@@H](SC)[C@@H](N)C(O)=O Amb24666742 [0,2,0,0,0,0|0,0,0]=2 5613 B8R0.2 C[C@@H]([C@@H](C)C=C)C(O)=O Amb24721924 [0,2,0,0,0,0|0,0,1]=3 5614 B8R0.2 C[C@@H]([C@@H](C)C=O)C(O)=O Amb24470204 [0,2,0,0,0,0|0,0,1]=3 5615 B8R0.2 C[C@@H]([C@@H](C)CO)C(O)=O Amb24696822 [0,2,0,0,0,0|0,0,0]=2 5616 B8R0.2 C[C@@H]([C@@H](C)N)C(=O)OC Amb24698063 [0,2,0,0,0,0|1,0,0]=3 5617 B8R0.2 C[C@@H]([C@@H](C)O)C(=O)OC Amb24363609 [0,2,0,0,0,0|1,0,0]=3 5618 B8R0.2 C[C@@H]([C@@H](O)CC)C(O)=O Amb24427100 [0,2,0,0,0,0|1,0,0]=3 5619 B8R0.2 C[C@@H]([C@H](N)CC)C(O)=O Amb24496209 [0,2,0,0,0,0|1,0,0]=3 5620 B8R0.2 C[C@@H]([C@H](O)C=C)C(O)=O Amb24622455 [0,2,0,0,0,0|1,0,1]=4 5621 B8R0.2 C[C@@H]([C@H](O)CC)C(O)=O Amb24472165 [0,2,0,0,0,0|1,0,0]=3 5622 B8R0.2 C[C@H](C(C)Br)C(=O)OC Amb25061347 [0,2,0,0,0,0|1,0,0]=3 5623 B8R0.2 C[C@H](C=C)[C@@H](N)C(O)=O Amb24460813 [0,2,0,0,0,0|0,0,1]=3 5624 B8R0.2 C[C@H](C=C)[C@H](Br)C(O)=O Amb25074908 [0,2,0,0,0,0|0,0,1]=3 5625 B8R0.2 C[C@H](C=C)[C@H](Cl)C(O)=O Amb24361246 [0,2,0,0,0,0|0,0,1]=3 5626 B8R0.2 C[C@H](C=C)[C@H](F)C(O)=O Amb25138124 [0,2,0,0,0,0|0,0,1]=3 5627 B8R0.2 C[C@H](C=O)[C@@H](O)C(C)=O Amb25768475 [0,2,0,0,0,0|1,0,1]=4 5628 B8R0.2 C[C@H](CC)C(N)C(O)=O Amb25206861 [0,2,0,0,0,0|0,0,0]=2 5629 B8R0.2 C[C@H](CC)[C@@H](Br)C(O)=O Amb24415133 [0,2,0,0,0,0|0,0,0]=2 5630 B8R0.2 C[C@H](CC)[C@H](Cl)C(O)=O Amb25147095 [0,2,0,0,0,0|0,0,0]=2 5631 B8R0.2 C[C@H](CC)[C@H](O)C(O)=O Amb25703176 [0,2,0,0,0,0|0,0,0]=2 5632 B8R0.2 C[C@H](CO)N(C)C(C)=O Amb24553314 [0,2,0,0,0,0|2,0,0]=4 5633 B8R0.2 C[C@H](CO)[C@@H](O)C(C)=C Amb24387757 [0,2,0,0,0,0|2,0,0]=4 5634 B8R0.2 C[C@H](Cl)[C@@H](N)C(=O)OC Amb24366062 [0,2,0,0,0,0|1,0,0]=3 5635 B8R0.2 C[C@H](Cl)[C@H](O)C(=O)OC Amb24479929 [0,2,0,0,0,0|1,0,0]=3 5636 B8R0.2 C[C@H](N)C(O)C(=O)OC Amb25238441 [0,2,0,0,0,0|1,0,0]=3 5637 B8R0.2 C[C@H](N)[C@H](O)C(=O)OC Amb24477818 [0,2,0,0,0,0|1,0,0]=3 5638 B8R0.2 C[C@H](NC)[C@@H](O)C(N)=O Amb25095009 [0,2,0,0,0,0|1,0,0]=3 5639 B8R0.2 C[C@H](NC)[C@H](O)C(O)=O Amb25755974 [0,2,0,0,0,0|0,0,0]=2 5640 B8R0.2 C[C@H](O)C(N)C(=O)OC Amb25302264 [0,2,0,0,0,0|1,0,0]=3 5641 B8R0.2 C[C@H](O)[C@@H](N)C(=O)NO Amb25063917 [0,2,0,0,0,0|1,0,0]=3 5642 B8R0.2 C[C@H](O)[C@@H](O)C(=O)OC Amb25763009 [0,2,0,0,0,0|1,0,0]=3 5643 B8R0.2 C[C@H](O)[C@@H](O)[C@@H](C)CC Amb25741416 [0,2,0,0,0,0|1,0,1]=4 5644 B8R0.2 C[C@H](O)[C@@H](O)[C@@H](O)C=O Amb24741570 [0,2,0,0,0,0|1,0,1]=4 5645 B8R0.2 C[C@H](O)[C@@H](O)[C@H](C)CC Amb25145311 [0,2,0,0,0,0|1,0,1]=4 5646 B8R0.2 C[C@H](O)[C@H](O)C(=O)OC Amb25327481 [0,2,0,0,0,0|1,0,0]=3 5647 B8R0.2 C[C@H](O)[C@H](O)[C@@H](C)CC Amb24735014 [0,2,0,0,0,0|1,0,1]=4 5648 B8R0.2 C[C@H](O)[C@H](O)[C@@H](C)CO Amb24697820 [0,2,0,0,0,0|1,0,1]=4 5649 B8R0.2 C[C@H](O)[C@H](O)[C@@H](O)C=O Amb22229973 [0,2,0,0,0,0|1,0,1]=4 5650 B8R0.2 C[C@H](OC)[C@@H](Br)C(O)=O Amb24480242 [0,2,0,0,0,0|0,0,0]=2 5651 B8R0.2 C[C@H](OC)[C@@H](O)C(O)=O Amb25140960 [0,2,0,0,0,0|0,0,0]=2 5652 B8R0.2 C[C@H](S)[C@@H](N)C(=O)OC Amb24420424 [0,2,0,0,0,0|1,0,0]=3 5653 B8R0.2 C[C@H]([C@@H](O)CC)C(C)=O Amb25096669 [0,2,0,0,0,0|2,0,0]=4 5654 B8R0.2 C[C@H]([C@H](C)C=C)C(C)=O Amb25266896 [0,2,0,0,0,0|1,0,1]=4 5655 B8R0.2 C[C@H]([C@H](C)C=C)C(O)=O Amb24528497 [0,2,0,0,0,0|0,0,1]=3 5656 B8R0.2 C[C@H]([C@H](C)O)C(=O)CC Amb25086603 [0,2,0,0,0,0|2,0,0]=4 5657 B8R0.2 C[C@H]([C@H](C)O)C(=O)OC Amb25762229 [0,2,0,0,0,0|1,0,0]=3 5658 B8R0.2 C[C@H]([C@H](N)CC)C(O)=O Amb25737884 [0,2,0,0,0,0|1,0,0]=3 5659 B8R0.2 C\C(=C/C)\C(C)C(C)=O Amb24689489 [0,2,0,0,0,0|1,0,1]=4 5660 B8R0.2 C\C(=C/C)\C(C)C(N)=O Amb24477780 [0,2,0,0,0,0|1,0,1]=4 5661 B8R0.2 C\C(=C/C)\C(N)C(O)=O Amb18642706 [0,2,0,0,0,0|0,0,1]=3 5662 B8R0.2 C\C(=C/C)\C(O)C(C)=O Amb25708298 [0,2,0,0,0,0|1,0,1]=4 5663 B8R0.2 C\C(=C/C)\C(O)C(N)=O Amb25082841 [0,2,0,0,0,0|1,0,1]=4 5664 B8R0.2 C\C(=C/C)\[C@@H](N)C(O)=O Amb24695637 [0,2,0,0,0,0|0,0,1]=3 5665 B8R0.2 C\C(=C/O)\C(=O)C(C)C Amb24577768 [0,2,0,0,0,0|1,0,1]=4 5666 B8R0.2 C\C(=C\C)\C(O)C(C)=O Amb24561282 [0,2,0,0,0,0|1,0,1]=4 5667 B8R0.2 C\C(=C\C)\C(O)C(N)=O Amb25243454 [0,2,0,0,0,0|1,0,1]=4 5668 B8R0.2 C\C(=C\C)\C(O)C(O)=O Amb24495368 [0,2,0,0,0,0|0,0,1]=3 5669 B8R0.2 C\C(=N/O)\C(=O)C(C)C Amb25806090 [0,2,0,0,0,0|1,0,1]=4 5670 B8R0.2 C\C(\C(C)C)=C(\C)/C=O Amb25365967 [0,2,0,0,0,0|1,0,1]=4 5671 B8R0.2 C\C(\C=O)=C(\O)/C(C)C Amb25785608 [0,2,0,0,0,0|1,0,1]=4 5672 B8R0.2 ClCC(C(C(=O)O)O)O Amb17593871 [0,2,0,0,0,0|1,0,0]=3 5673 B8R0.2 FC[C@H]([C@@H](C(=O)O)N)O Amb13883676 [0,2,0,0,0,0|1,0,0]=3 5674 B8R0.2 NC(=O)[C@@H](O)[C@@H](O)CO Amb24533413 [0,2,0,0,0,0|2,0,0]=4 5675 B8R0.2 NC(=O)[C@H](O)[C@H](O)CO Amb25146059 [0,2,0,0,0,0|2,0,0]=4 5676 B8R0.2 NC(C(O)CO)C(O)=O Amb18642974 [0,2,0,0,0,0|1,0,0]=3 5677 B8R0.2 NC(CF)C(F)C(O)=O Amb24340267 [0,2,0,0,0,0|1,0,0]=3 5678 B8R0.2 NC(CO)C(O)C(O)=O Amb25270055 [0,2,0,0,0,0|1,0,0]=3 5679 B8R0.2 NCC(O)C(F)P(O)=O Amb25725015 [0,2,0,0,0,0|2,0,0]=4 5680 B8R0.2 NC[C@@H](F)[C@@H](F)C(O)=O Amb25366211 [0,2,0,0,0,0|1,0,0]=3 5681 B8R0.2 NC[C@@H](F)[C@H](F)C(O)=O Amb24452574 [0,2,0,0,0,0|1,0,0]=3 5682 B8R0.2 NC[C@H](O)[C@@H](O)C(O)=O Amb25323660 [0,2,0,0,0,0|1,0,0]=3 5683 B8R0.2 NC[C@H](O)[C@H](O)C(O)=O Amb25242625 [0,2,0,0,0,0|1,0,0]=3 5684 B8R0.2 N[C@@H](C(O)CBr)C(O)=O Amb24391545 [0,2,0,0,0,0|1,0,0]=3 5685 B8R0.2 N[C@@H](C(O)CCl)C(N)=O Amb24543859 [0,2,0,0,0,0|2,0,0]=4 5686 B8R0.2 N[C@@H](C(O)CF)C(O)=O Amb24426022 [0,2,0,0,0,0|1,0,0]=3 5687 B8R0.2 N[C@@H](CO)[C@H](O)C(O)=O Amb25738857 [0,2,0,0,0,0|1,0,0]=3 5688 B8R0.2 N[C@@H]([C@@H](O)CBr)C(O)=O Amb24480277 [0,2,0,0,0,0|1,0,0]=3 5689 B8R0.2 N[C@@H]([C@@H](O)CO)C(N)=O Amb24717733 [0,2,0,0,0,0|2,0,0]=4 5690 B8R0.2 N[C@@H]([C@@H](O)CO)C(O)=O Amb25678241 [0,2,0,0,0,0|1,0,0]=3 5691 B8R0.2 N[C@@H]([C@H](N)CO)C(O)=O Amb24761920 [0,2,0,0,0,0|1,0,0]=3 5692 B8R0.2 N[C@@H]([C@H](O)CCl)C(O)=O Amb25324441 [0,2,0,0,0,0|1,0,0]=3 5693 B8R0.2 N[C@@H]([C@H](O)CO)C(O)=O Amb24674136 [0,2,0,0,0,0|1,0,0]=3 5694 B8R0.2 N[C@H](CO)[C@H](O)C(N)=O Amb24677605 [0,2,0,0,0,0|2,0,0]=4 5695 B8R0.2 N[C@H](CO)[C@H](O)C(O)=O Amb25090400 [0,2,0,0,0,0|1,0,0]=3 5696 B8R0.2 N[C@H]([C@@H](O)CO)C(=O)Cl Amb25707913 [0,2,0,0,0,0|2,0,0]=4 5697 B8R0.2 N[C@H]([C@@H](O)CO)C(O)=O Amb25836554 [0,2,0,0,0,0|1,0,0]=3 5698 B8R0.2 N[C@H]([C@H](O)CO)C(O)=O Amb24671346 [0,2,0,0,0,0|1,0,0]=3 5699 B8R0.2 O=C[C@@H]([C@@H]([C@H](O)C)O)O Amb10602917 [0,2,0,0,0,0|1,0,1]=4 5700 B8R0.2 OC(=O)C(Br)C(Br)CBr Amb22347644 [0,2,0,0,0,0|1,0,0]=3 5701 B8R0.2 OC(C(O)C=O)C(O)=O Amb18124399 [0,2,0,0,0,0|1,0,1]=4 5702 B8R0.2 OC(C(O)CBr)C(O)=O Amb24358122 [0,2,0,0,0,0|1,0,0]=3 5703 B8R0.2 OC(CF)C(Br)C(O)=O Amb25733261 [0,2,0,0,0,0|1,0,0]=3 5704 B8R0.2 OCC(O)C(O)C(O)=O Amb22495524 [0,2,0,0,0,0|1,0,0]=3 5705 B8R0.2 OC[C@@H](O)[C@H](O)C(O)=O Amb22801448 [0,2,0,0,0,0|1,0,0]=3 5706 B8R0.2 OC[C@H](O)[C@@H](O)C([O-])=O Amb17943095 [0,2,0,0,0,0|1,0,1]=4 5707 B8R0.2 OC[C@H](O)[C@H](O)C(O)=O Amb25223742 [0,2,0,0,0,0|1,0,0]=3 5708 B8R0.2 ONC(=O)C(C(C)C)N Amb2439843 [0,2,0,0,0,0|0,0,0]=2 5709 B8R0.2 O[C@@H]([C@H](O)CBr)C(O)=O Amb24426113 [0,2,0,0,0,0|1,0,0]=3 5710 B8R0.2 O[C@@H]([C@H](O)CCl)C(O)=O Amb25836734 [0,2,0,0,0,0|1,0,0]=3 5711 B8R0.2 SCC(C(C(=O)O)C)C Amb17593702 [0,2,0,0,0,0|0,0,0]=2 5712 B8R0.2 [14CH3][14CH]([14CH2][14CH3])[14CH](N)[14C](O)=O Amb22362774 [0,2,0,0,0,0|0,0,0]=2 5713 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22552521 [0,2,0,0,0,0|1,0,1]=4 5714 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22733096 [0,2,0,0,0,0|1,0,1]=4 5715 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22734344 [0,2,0,0,0,0|1,0,1]=4 5716 B8R0.2 [O-]C(=O)[C@@H](O)[C@H](O)CO Amb22744783 [0,2,0,0,0,0|1,0,1]=4 5717 B8R0.5 BrCCC(=O)NC(C)C Amb17327115 [0,2,0,0,0,0|2,0,0]=4 5718 B8R0.5 C#CCS(=O)CC(O)=O Amb24417332 [0,2,0,0,0,0|2,0,0]=4 5719 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb22746284 [0,2,0,0,0,0|1,0,0]=3 5720 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb24539924 [0,2,0,0,0,0|1,0,0]=3 5721 B8R0.5 C#CC[C@H](N)CC(O)=O Amb22226648 [0,2,0,0,0,0|1,0,0]=3 5722 B8R0.5 C#CC[C@H](N)CC(O)=O Amb24642007 [0,2,0,0,0,0|1,0,0]=3 5723 B8R0.5 C=C(CC=C)CC(O)=O Amb25261334 [0,2,0,0,0,0|0,0,2]=4 5724 B8R0.5 C=C=CC(N)CC(O)=O Amb24476615 [0,2,0,0,0,0|1,0,1]=4 5725 B8R0.5 C=CCC(CC(=O)C)C Amb17593320 [0,2,0,0,0,0|1,0,0]=3 5726 B8R0.5 C=CCC(N)CC(O)=O Amb22641964 [0,2,0,0,0,0|1,0,0]=3 5727 B8R0.5 C=CCC(O)CC(O)=O Amb18642785 [0,2,0,0,0,0|1,0,0]=3 5728 B8R0.5 C=CCS(=O)CC(=O)O Amb10608086 [0,2,0,0,0,0|2,0,0]=4 5729 B8R0.5 C=CC[C@@H](CC(=O)O)C Amb10844371 [0,2,0,0,0,0|0,0,0]=2 5730 B8R0.5 C=CC[C@@H](N)CC(O)=O Amb22746166 [0,2,0,0,0,0|1,0,0]=3 5731 B8R0.5 C=CC[C@@H](O)CC(N)=O Amb24680790 [0,2,0,0,0,0|2,0,0]=4 5732 B8R0.5 C=CC[C@H](CC(=O)O)C Amb10844336 [0,2,0,0,0,0|0,0,0]=2 5733 B8R0.5 CC#CC(O)CC(C)=O Amb24736733 [0,2,0,0,0,0|2,0,0]=4 5734 B8R0.5 CC(=C)CC(=O)COC Amb25142356 [0,2,0,0,0,0|0,0,2]=4 5735 B8R0.5 CC(=C)CC(=O)NOC Amb24573843 [0,2,0,0,0,0|0,0,2]=4 5736 B8R0.5 CC(=CC(O)=O)OCC Amb25770190 [0,2,0,0,0,0|0,0,2]=4 5737 B8R0.5 CC(=CC(O)=O)SCC Amb25229812 [0,2,0,0,0,0|0,0,2]=4 5738 B8R0.5 CC(=O)CC(=O)C=NO Amb25298403 [0,2,0,0,0,0|1,0,1]=4 5739 B8R0.5 CC(=O)CC(=O)CCO Amb25685471 [0,2,0,0,0,0|1,0,1]=4 5740 B8R0.5 CC(=O)CC(=O)NOC Amb24096697 [0,2,0,0,0,0|1,0,1]=4 5741 B8R0.5 CC(=O)CC(=O)OCC Amb22360190 [0,2,0,0,0,0|1,0,1]=4 5742 B8R0.5 CC(=O)CC(=O)OOC Amb24096083 [0,2,0,0,0,0|1,0,1]=4 5743 B8R0.5 CC(=O)CC(=O)\C=N\O Amb25713027 [0,2,0,0,0,0|1,0,1]=4 5744 B8R0.5 CC(=O)CN(C)CC=C Amb24752867 [0,2,0,0,0,0|2,0,0]=4 5745 B8R0.5 CC(=O)C[C@H](O)CCBr Amb24634001 [0,2,0,0,0,0|2,0,0]=4 5746 B8R0.5 CC(=O)C[C@H](O)CCO Amb24551545 [0,2,0,0,0,0|2,0,0]=4 5747 B8R0.5 CC(C)=CC(=O)C=NO Amb24721718 [0,2,0,0,0,0|0,0,2]=4 5748 B8R0.5 CC(C)=CC(=O)NOC Amb25746848 [0,2,0,0,0,0|0,0,2]=4 5749 B8R0.5 CC(C)CC(=O)CC=O Amb18642654 [0,2,0,0,0,0|0,0,1]=3 5750 B8R0.5 CC(C)CC(=O)CCN Amb24641510 [0,2,0,0,0,0|1,0,0]=3 5751 B8R0.5 CC(C)CC(=O)N=[N+]=[N-] Amb25202010 [0,2,0,0,0,0|1,0,0]=3 5752 B8R0.5 CC(C)CC(=O)OC=C Amb25333598 [0,2,0,0,0,0|0,0,0]=2 5753 B8R0.5 CC(C)CC(=O)\C=C/O Amb24466975 [0,2,0,0,0,0|0,0,0]=2 5754 B8R0.5 CC(C)CC(=O)\C=C\Cl Amb25377914 [0,2,0,0,0,0|1,0,0]=3 5755 B8R0.5 CC(C)CC(=O)\C=C\N Amb24532829 [0,2,0,0,0,0|1,0,0]=3 5756 B8R0.5 CC(C)CC(C)=C=CCl Amb25273910 [0,2,0,0,0,0|2,0,0]=4 5757 B8R0.5 CC(C)CC(C)=CC#N Amb25282412 [0,2,0,0,0,0|2,0,0]=4 5758 B8R0.5 CC(C)CC(C)=CCO Amb25042824 [0,2,0,0,0,0|1,0,0]=3 5759 B8R0.5 CC(C)CC(C)CC=O Amb18642682 [0,2,0,0,0,0|1,0,1]=4 5760 B8R0.5 CC(C)CC(C)CNO Amb25238605 [0,2,0,0,0,0|1,0,1]=4 5761 B8R0.5 CC(C)CC(C)NC=O Amb24477688 [0,2,0,0,0,0|1,0,1]=4 5762 B8R0.5 CC(C)CC(Cl)=CC=O Amb25326662 [0,2,0,0,0,0|1,0,0]=3 5763 B8R0.5 CC(C)CC(Cl)=CCO Amb25065426 [0,2,0,0,0,0|1,0,0]=3 5764 B8R0.5 CC(C)CC(Cl)COC Amb25085213 [0,2,0,0,0,0|1,0,1]=4 5765 B8R0.5 CC(C)CC(N)=CC#N Amb24641849 [0,2,0,0,0,0|2,0,0]=4 5766 B8R0.5 CC(C)CC(N)CCO Amb18203172 [0,2,0,0,0,0|1,0,1]=4 5767 B8R0.5 CC(C)CC(N)NC=O Amb25243005 [0,2,0,0,0,0|1,0,1]=4 5768 B8R0.5 CC(C)CC(O)CC=C Amb25298097 [0,2,0,0,0,0|1,0,1]=4 5769 B8R0.5 CC(C)CC(O)CCC Amb22730597 [0,2,0,0,0,0|1,0,1]=4 5770 B8R0.5 CC(C)CC(O)CCCl Amb25188911 [0,2,0,0,0,0|1,0,1]=4 5771 B8R0.5 CC(C)CC(O)CCO Amb23512717 [0,2,0,0,0,0|0,0,2]=4 5772 B8R0.5 CC(C)CC(O)CNC Amb19031253 [0,2,0,0,0,0|1,0,1]=4 5773 B8R0.5 CC(C)CC(O)COC Amb19301971 [0,2,0,0,0,0|0,0,2]=4 5774 B8R0.5 CC(C)CC(O)\C=C\C Amb24593851 [0,2,0,0,0,0|1,0,1]=4 5775 B8R0.5 CC(C)CS(=O)CCCl Amb25859078 [0,2,0,0,0,0|2,0,0]=4 5776 B8R0.5 CC(C)CS(=O)CCN Amb19011999 [0,2,0,0,0,0|2,0,0]=4 5777 B8R0.5 CC(C)C[C@@H](N)COC Amb18016632 [0,2,0,0,0,0|1,0,1]=4 5778 B8R0.5 CC(C)C[C@@H](O)C#CC Amb24412947 [0,2,0,0,0,0|1,0,1]=4 5779 B8R0.5 CC(C)C[C@@H](O)CCO Amb25343763 [0,2,0,0,0,0|0,0,2]=4 5780 B8R0.5 CC(C)C[C@@H](O)\C=C\C Amb24529069 [0,2,0,0,0,0|1,0,1]=4 5781 B8R0.5 CC(C)C[C@H](C)CCO Amb24456802 [0,2,0,0,0,0|1,0,1]=4 5782 B8R0.5 CC(C)C[C@H](N)CCO Amb24446600 [0,2,0,0,0,0|1,0,1]=4 5783 B8R0.5 CC(C)C[C@H](N)NC=O Amb24641394 [0,2,0,0,0,0|1,0,1]=4 5784 B8R0.5 CC(C)C[C@H](O)CC#N Amb24524302 [0,2,0,0,0,0|1,0,1]=4 5785 B8R0.5 CC(C)C[C@H](O)CCO Amb25129820 [0,2,0,0,0,0|0,0,2]=4 5786 B8R0.5 CC(C)C\C(\C)=C\C=O Amb18642447 [0,2,0,0,0,0|1,0,0]=3 5787 B8R0.5 CC(C)C\C(\Cl)=C/C=O Amb25827220 [0,2,0,0,0,0|1,0,0]=3 5788 B8R0.5 CC(C)NC(=O)C#CBr Amb24502220 [0,2,0,0,0,0|2,0,0]=4 5789 B8R0.5 CC(C)NC(=O)CNO Amb25250514 [0,2,0,0,0,0|1,0,0]=3 5790 B8R0.5 CC(C)NC(=O)\C=C\Br Amb25177572 [0,2,0,0,0,0|2,0,0]=4 5791 B8R0.5 CC(C)NC(=O)\C=C\Cl Amb25230631 [0,2,0,0,0,0|2,0,0]=4 5792 B8R0.5 CC(C)OC(=O)CC=C Amb24574775 [0,2,0,0,0,0|2,0,0]=4 5793 B8R0.5 CC(C)OC(=O)CC=O Amb18642762 [0,2,0,0,0,0|1,0,1]=4 5794 B8R0.5 CC(C)OC(=O)CCBr Amb24563382 [0,2,0,0,0,0|2,0,0]=4 5795 B8R0.5 CC(C)OC(=O)CCN Amb19234917 [0,2,0,0,0,0|2,0,0]=4 5796 B8R0.5 CC(C)OC(=O)CCS Amb22229342 [0,2,0,0,0,0|1,1,0]=4 5797 B8R0.5 CC(C)OC(=O)CNO Amb24524224 [0,2,0,0,0,0|1,0,0]=3 5798 B8R0.5 CC(C)OC(=O)N=[N+]=[N-] Amb25804105 [0,2,0,0,0,0|2,0,0]=4 5799 B8R0.5 CC(C)OC(=O)NC#N Amb25134950 [0,2,0,0,0,0|2,0,0]=4 5800 B8R0.5 CC(CC#C)CC(C)=O Amb24707587 [0,2,0,0,0,0|1,0,0]=3 5801 B8R0.5 CC(CC#C)NC(C)=O Amb24373503 [0,2,0,0,0,0|2,0,0]=4 5802 B8R0.5 CC(CC#C)OC(C)=O Amb25091916 [0,2,0,0,0,0|2,0,0]=4 5803 B8R0.5 CC(CC#C)OC(N)=O Amb24446613 [0,2,0,0,0,0|2,0,0]=4 5804 B8R0.5 CC(CC#N)CC(C)=O Amb24339577 [0,2,0,0,0,0|1,0,0]=3 5805 B8R0.5 CC(CC#N)CC(C)O Amb25052229 [0,2,0,0,0,0|1,0,1]=4 5806 B8R0.5 CC(CC#N)CC(O)=O Amb18642506 [0,2,0,0,0,0|0,0,0]=2 5807 B8R0.5 CC(CC#N)NC(C)=O Amb25061726 [0,2,0,0,0,0|2,0,0]=4 5808 B8R0.5 CC(CC(=O)N=C=O)C Amb17231845 [0,2,0,0,0,0|0,0,1]=3 5809 B8R0.5 CC(CC(C)=O)=CCCl Amb24581453 [0,2,0,0,0,0|1,0,1]=4 5810 B8R0.5 CC(CC(C)=O)=NOC Amb25179533 [0,2,0,0,0,0|1,0,1]=4 5811 B8R0.5 CC(CC(C)=O)N=[N+]=[N-] Amb24447192 [0,2,0,0,0,0|2,0,0]=4 5812 B8R0.5 CC(CC(C)=O)NC=O Amb24477804 [0,2,0,0,0,0|1,0,1]=4 5813 B8R0.5 CC(CC(N)=O)N=C=S Amb24590729 [0,2,0,0,0,0|1,0,1]=4 5814 B8R0.5 CC(CC(N)=O)NC#N Amb25115328 [0,2,0,0,0,0|1,0,1]=4 5815 B8R0.5 CC(CC(O)=O)NC=O Amb18967805 [0,2,0,0,0,0|0,0,1]=3 5816 B8R0.5 CC(CC=C)CC(O)=O Amb18642628 [0,2,0,0,0,0|0,0,0]=2 5817 B8R0.5 CC(CC=C)NC(N)=O Amb24412410 [0,2,0,0,0,0|2,0,0]=4 5818 B8R0.5 CC(CC=O)CC(C)=C Amb18642471 [0,2,0,0,0,0|2,0,0]=4 5819 B8R0.5 CC(CC=O)CC(C)O Amb25858195 [0,2,0,0,0,0|1,0,1]=4 5820 B8R0.5 CC(CC=O)NC(C)=O Amb25705280 [0,2,0,0,0,0|2,0,0]=4 5821 B8R0.5 CC(CC=O)OC(C)=O Amb18642743 [0,2,0,0,0,0|2,0,0]=4 5822 B8R0.5 CC(CCBr)CC(C)=O Amb24740003 [0,2,0,0,0,0|1,0,0]=3 5823 B8R0.5 CC(CCBr)NC(C)=O Amb25213338 [0,2,0,0,0,0|2,0,0]=4 5824 B8R0.5 CC(CCBr)OC(C)=O Amb25111237 [0,2,0,0,0,0|2,0,0]=4 5825 B8R0.5 CC(CCCl)CC(C)=O Amb25231057 [0,2,0,0,0,0|1,0,0]=3 5826 B8R0.5 CC(CCF)CC(O)=O Amb24477914 [0,2,0,0,0,0|0,0,0]=2 5827 B8R0.5 CC(CCN)CB(O)O Amb25337156 [0,2,0,0,0,0|1,0,1]=4 5828 B8R0.5 CC(CCN)CC(C)O Amb25064091 [0,2,0,0,0,0|1,0,1]=4 5829 B8R0.5 CC(CCN)CC(O)=O Amb20667689 [0,2,0,0,0,0|0,0,0]=2 5830 B8R0.5 CC(CCN)CC(O)=O Amb24376646 [0,2,0,0,0,0|0,0,0]=2 5831 B8R0.5 CC(CCN)NC(C)=O Amb18986174 [0,2,0,0,0,0|2,0,0]=4 5832 B8R0.5 CC(CCN)NC(N)=O Amb18985721 [0,2,0,0,0,0|2,0,0]=4 5833 B8R0.5 CC(CCO)=CC(O)=O Amb25213064 [0,2,0,0,0,0|0,0,2]=4 5834 B8R0.5 CC(CCO)CC(C)=C Amb24525539 [0,2,0,0,0,0|2,0,0]=4 5835 B8R0.5 CC(CCO)CC(C)=O Amb24563263 [0,2,0,0,0,0|1,0,0]=3 5836 B8R0.5 CC(CCO)CC(O)=O Amb18642882 [0,2,0,0,0,0|0,0,0]=2 5837 B8R0.5 CC(CCO)NC(N)=O Amb25043087 [0,2,0,0,0,0|2,0,0]=4 5838 B8R0.5 CC(CCO)OC(N)=O Amb25090414 [0,2,0,0,0,0|2,0,0]=4 5839 B8R0.5 CC(CCS)=CC(O)=O Amb25328912 [0,2,0,0,0,0|0,0,2]=4 5840 B8R0.5 CC(CN(C)C)=CCO Amb24412112 [0,2,0,0,0,0|2,0,0]=4 5841 B8R0.5 CC(CNC)=CC(O)=O Amb25126794 [0,2,0,0,0,0|0,0,2]=4 5842 B8R0.5 CC(CNO)=CC(O)=O Amb25702672 [0,2,0,0,0,0|0,0,2]=4 5843 B8R0.5 CC(COC)=CC(O)=O Amb25311787 [0,2,0,0,0,0|0,0,2]=4 5844 B8R0.5 CC(CSC)=CC(O)=O Amb25364860 [0,2,0,0,0,0|0,0,2]=4 5845 B8R0.5 CC(Cl)CC(=O)CCBr Amb24377883 [0,2,0,0,0,0|2,0,0]=4 5846 B8R0.5 CC(Cl)CC(=O)CCCl Amb25852093 [0,2,0,0,0,0|2,0,0]=4 5847 B8R0.5 CC(Cl)CC(=O)OC=C Amb25684807 [0,2,0,0,0,0|1,0,0]=3 5848 B8R0.5 CC(NC(=O)C)CON Amb17138376 [0,2,0,0,0,0|2,0,0]=4 5849 B8R0.5 CC(NCC)CC(=O)N Amb17231866 [0,2,0,0,0,0|1,0,0]=3 5850 B8R0.5 CC(NCC)CC(=O)O Amb13952759 [0,2,0,0,0,0|0,0,0]=2 5851 B8R0.5 CC(O)CC(Cl)=CCO Amb25271516 [0,2,0,0,0,0|2,0,0]=4 5852 B8R0.5 CC(O)CC(O)CC=O Amb25032311 [0,2,0,0,0,0|1,0,1]=4 5853 B8R0.5 CCCC(=C)CC(O)=O Amb18642622 [0,2,0,0,0,0|0,0,2]=4 5854 B8R0.5 CCCC(=O)CC(C)Br Amb25232584 [0,2,0,0,0,0|2,0,0]=4 5855 B8R0.5 CCCC(=O)CC(C)O Amb24676902 [0,2,0,0,0,0|2,0,0]=4 5856 B8R0.5 CCCC(=O)C[C@@H](C)O Amb24645371 [0,2,0,0,0,0|2,0,0]=4 5857 B8R0.5 CCCC(=O)C[C@H](C)O Amb25767694 [0,2,0,0,0,0|2,0,0]=4 5858 B8R0.5 CCCC(=O)NC(C)C Amb2222481 [0,2,0,0,0,0|2,0,0]=4 5859 B8R0.5 CCCC(Br)CC(O)=O Amb18127175 [0,2,0,0,0,0|1,0,0]=3 5860 B8R0.5 CCCC(C)CC(C)=C Amb22730409 [0,2,0,0,0,0|2,0,0]=4 5861 B8R0.5 CCCC(C)CC(C)=O Amb22229841 [0,2,0,0,0,0|1,0,0]=3 5862 B8R0.5 CCCC(C)CC(C)O Amb22229840 [0,2,0,0,0,0|1,0,1]=4 5863 B8R0.5 CCCC(C)CC(N)=N Amb25771598 [0,2,0,0,0,0|2,0,0]=4 5864 B8R0.5 CCCC(C)CC(N)=O Amb25146057 [0,2,0,0,0,0|1,0,0]=3 5865 B8R0.5 CCCC(C)OC(C)=O Amb22732559 [0,2,0,0,0,0|2,0,0]=4 5866 B8R0.5 CCCC(CC(=O)C)O Amb17593376 [0,2,0,0,0,0|2,0,0]=4 5867 B8R0.5 CCCC(CC(=O)O)N Amb1993864 [0,2,0,0,0,0|1,0,0]=3 5868 B8R0.5 CCCC(N)CC(N)=O Amb25128031 [0,2,0,0,0,0|2,0,0]=4 5869 B8R0.5 CCCC(N)CC(O)=O Amb21961469 [0,2,0,0,0,0|1,0,0]=3 5870 B8R0.5 CCCC(O)CC(N)=O Amb25072270 [0,2,0,0,0,0|2,0,0]=4 5871 B8R0.5 CCCN(C)CC(N)=O Amb24700757 [0,2,0,0,0,0|2,0,0]=4 5872 B8R0.5 CCCN(C)CC(O)=O Amb19373314 [0,2,0,0,0,0|1,0,0]=3 5873 B8R0.5 CCCS(=O)CC(=O)O Amb10608037 [0,2,0,0,0,0|2,0,0]=4 5874 B8R0.5 CCC[C@@H](C)CC(N)=O Amb24761385 [0,2,0,0,0,0|1,0,0]=3 5875 B8R0.5 CCC[C@@H](C)CC(O)=O Amb24622486 [0,2,0,0,0,0|0,0,0]=2 5876 B8R0.5 CCC[C@@H](C)NC(C)=O Amb25844046 [0,2,0,0,0,0|2,0,0]=4 5877 B8R0.5 CCC[C@@H](CC(=O)O)C Amb10844381 [0,2,0,0,0,0|0,0,0]=2 5878 B8R0.5 CCC[C@@H](N)CC(O)=O Amb22225223 [0,2,0,0,0,0|1,0,0]=3 5879 B8R0.5 CCC[C@@H](N)CC(O)=O Amb24739278 [0,2,0,0,0,0|1,0,0]=3 5880 B8R0.5 CCC[C@@H](O)CC(C)=O Amb25190233 [0,2,0,0,0,0|2,0,0]=4 5881 B8R0.5 CCC[C@@H](O)CC(O)=O Amb25188904 [0,2,0,0,0,0|1,0,0]=3 5882 B8R0.5 CCC[C@H](C)CC(N)=O Amb25340178 [0,2,0,0,0,0|1,0,0]=3 5883 B8R0.5 CCC[C@H](N)CC(O)=O Amb22226359 [0,2,0,0,0,0|1,0,0]=3 5884 B8R0.5 CCC[C@H](O)CC(O)=O Amb25367955 [0,2,0,0,0,0|1,0,0]=3 5885 B8R0.5 CCNC(=O)CC(=O)O Amb17399821 [0,2,0,0,0,0|1,0,1]=4 5886 B8R0.5 CCNC(=O)CC(C)N Amb18968316 [0,2,0,0,0,0|2,0,0]=4 5887 B8R0.5 CCNC(=O)CN(C)C Amb19978827 [0,2,0,0,0,0|2,0,0]=4 5888 B8R0.5 CCNC(=O)C[C@H](C)O Amb24540634 [0,2,0,0,0,0|2,0,0]=4 5889 B8R0.5 CCNC(C)CC(C)=O Amb25131542 [0,2,0,0,0,0|1,0,0]=3 5890 B8R0.5 CCNC(C)CC(C)O Amb25836121 [0,2,0,0,0,0|1,0,1]=4 5891 B8R0.5 CCOC(=N)CC(C)Br Amb25842962 [0,2,0,0,0,0|2,0,0]=4 5892 B8R0.5 CCOC(=N)CC(C)C Amb20622342 [0,2,0,0,0,0|1,0,0]=3 5893 B8R0.5 CCOC(=N)CC(C)C Amb22058854 [0,2,0,0,0,0|1,0,0]=3 5894 B8R0.5 CCOC(=N)CN(C)C Amb24477873 [0,2,0,0,0,0|2,0,0]=4 5895 B8R0.5 CCOC(=O)CC(C)=C Amb17940814 [0,2,0,0,0,0|0,0,2]=4 5896 B8R0.5 CCOC(=O)CC(C)Br Amb17940889 [0,2,0,0,0,0|1,0,0]=3 5897 B8R0.5 CCOC(=O)CC(C)S Amb19515282 [0,2,0,0,0,0|1,0,0]=3 5898 B8R0.5 CCOC(=O)CC(Cl)Cl Amb24480040 [0,2,0,0,0,0|2,0,0]=4 5899 B8R0.5 CCOC(=O)CC(F)F Amb19373235 [0,2,0,0,0,0|2,0,0]=4 5900 B8R0.5 CCOC(=O)CC(O)=O Amb22360654 [0,2,0,0,0,0|1,0,1]=4 5901 B8R0.5 CCOC(=O)CC([13CH3])=O Amb22366911 [0,2,0,0,0,0|1,0,1]=4 5902 B8R0.5 CCOC(=O)CS(C)=O Amb18177141 [0,2,0,0,0,0|2,0,0]=4 5903 B8R0.5 CCOC(=O)CS(C)C Amb22351352 [0,2,0,0,0,0|1,0,0]=3 5904 B8R0.5 CCOC(=O)C[13C](C)=O Amb22336363 [0,2,0,0,0,0|1,0,1]=4 5905 B8R0.5 CCOC(=O)C[13C]([13CH3])=O Amb22351420 [0,2,0,0,0,0|1,0,1]=4 5906 B8R0.5 CCOC(=O)C[C@H](C)Cl Amb24479960 [0,2,0,0,0,0|1,0,0]=3 5907 B8R0.5 CCOC(=O)OC(C)C Amb24596469 [0,2,0,0,0,0|1,0,0]=3 5908 B8R0.5 CCOC(=O)OC(C)F Amb25173938 [0,2,0,0,0,0|2,0,0]=4 5909 B8R0.5 CCOC(=O)[13CH2]C([13CH3])=O Amb22362626 [0,2,0,0,0,0|1,0,1]=4 5910 B8R0.5 CCOC(C)CC(C)=O Amb25291783 [0,2,0,0,0,0|1,0,0]=3 5911 B8R0.5 CCOC(C)NC(N)=O Amb24655701 [0,2,0,0,0,0|2,0,0]=4 5912 B8R0.5 CCOC(C)OC(C)=O Amb17689197 [0,2,0,0,0,0|2,0,0]=4 5913 B8R0.5 CCOP(=O)CC(C)C Amb25283613 [0,2,0,0,0,0|1,0,0]=3 5914 B8R0.5 CCO[13C](=O)[13CH2]C(C)=O Amb22353575 [0,2,0,0,0,0|1,0,1]=4 5915 B8R0.5 CCO[13C](=O)[13CH2][13C](=O)O Amb17618079 [0,2,0,0,0,0|1,0,1]=4 5916 B8R0.5 CCO[13C](=O)[13CH2][13C]([13CH3])=O Amb22351473 [0,2,0,0,0,0|1,0,1]=4 5917 B8R0.5 CCO[C@@H](O)CC(C)=O Amb25051240 [0,2,0,0,0,0|2,0,0]=4 5918 B8R0.5 CCO[C@H](C)CC(O)=O Amb24395833 [0,2,0,0,0,0|0,0,0]=2 5919 B8R0.5 CCO[C@H](C)C[C@@H](C)O Amb24466310 [0,2,0,0,0,0|1,0,1]=4 5920 B8R0.5 CCSC(=O)CC(C)Cl Amb24480020 [0,2,0,0,0,0|1,1,0]=4 5921 B8R0.5 CCSC(=O)CC(C)O Amb25120018 [0,2,0,0,0,0|1,1,0]=4 5922 B8R0.5 CCSC(C)CC(N)=N Amb24333275 [0,2,0,0,0,0|2,0,0]=4 5923 B8R0.5 CC\C=C(/C)\CC(C)=O Amb24751417 [0,2,0,0,0,0|1,0,1]=4 5924 B8R0.5 CC\C=C(\C)/CC(C)=O Amb25314826 [0,2,0,0,0,0|1,0,1]=4 5925 B8R0.5 CC\N=C(\C)/CC(C)=O Amb25838829 [0,2,0,0,0,0|1,0,1]=4 5926 B8R0.5 CN(C)CC(=O)CC#C Amb24394832 [0,2,0,0,0,0|2,0,0]=4 5927 B8R0.5 CN(C)CC(=O)CC=C Amb25081953 [0,2,0,0,0,0|2,0,0]=4 5928 B8R0.5 CN(C)CC(=O)NC#N Amb24719969 [0,2,0,0,0,0|2,0,0]=4 5929 B8R0.5 CN(C)CC(=O)NCO Amb24072681 [0,2,0,0,0,0|1,0,0]=3 5930 B8R0.5 CN(C)CC(=O)\C=C/[O-] Amb25767095 [0,2,0,0,0,0|1,0,1]=4 5931 B8R0.5 CN(C)CC(=O)\C=C\[O-] Amb24512619 [0,2,0,0,0,0|1,0,1]=4 5932 B8R0.5 CN(CCCl)CC(N)=O Amb24626078 [0,2,0,0,0,0|2,0,0]=4 5933 B8R0.5 CN(CCCl)CC(O)=O Amb25829318 [0,2,0,0,0,0|1,0,0]=3 5934 B8R0.5 CN(CCF)CC(O)=O Amb25760005 [0,2,0,0,0,0|1,0,0]=3 5935 B8R0.5 CN(CCI)CC(N)=O Amb25042038 [0,2,0,0,0,0|2,0,0]=4 5936 B8R0.5 CN(CCN)CC(O)=O Amb18313585 [0,2,0,0,0,0|1,0,0]=3 5937 B8R0.5 CNCC(=O)NC(C)C Amb10610267 [0,2,0,0,0,0|2,0,0]=4 5938 B8R0.5 CNCC(C)CC(O)=O Amb25284797 [0,2,0,0,0,0|0,0,0]=2 5939 B8R0.5 CNCC(C)NC(C)=O Amb25834936 [0,2,0,0,0,0|2,0,0]=4 5940 B8R0.5 CNN=C(C)CC(C)C Amb25369290 [0,2,0,0,0,0|2,0,0]=4 5941 B8R0.5 CNNC(=N)CC(O)=O Amb25226519 [0,2,0,0,0,0|1,0,1]=4 5942 B8R0.5 COCC(=N)NC(C)C Amb24574579 [0,2,0,0,0,0|2,0,0]=4 5943 B8R0.5 COCC(=O)CC(=O)C Amb15701314 [0,2,0,0,0,0|1,0,1]=4 5944 B8R0.5 COCC(=O)CC(C)C Amb19301970 [0,2,0,0,0,0|0,0,0]=2 5945 B8R0.5 COCC(=O)CC(O)=O Amb24093174 [0,2,0,0,0,0|1,0,1]=4 5946 B8R0.5 COCC(=O)CN(C)C Amb25096062 [0,2,0,0,0,0|1,0,0]=3 5947 B8R0.5 COCC(=O)CS(C)=O Amb25736407 [0,2,0,0,0,0|2,0,0]=4 5948 B8R0.5 COCC(=O)NC(C)C Amb23247496 [0,2,0,0,0,0|1,0,0]=3 5949 B8R0.5 COCC(=O)OC(C)C Amb20621999 [0,2,0,0,0,0|1,0,0]=3 5950 B8R0.5 COCC(C)CC(O)=O Amb19024342 [0,2,0,0,0,0|0,0,0]=2 5951 B8R0.5 COCC(C)OC(N)=O Amb24645730 [0,2,0,0,0,0|2,0,0]=4 5952 B8R0.5 COCC(Cl)CC(=O)Cl Amb25059197 [0,2,0,0,0,0|2,0,0]=4 5953 B8R0.5 COCC(Cl)CC(O)=O Amb24627002 [0,2,0,0,0,0|1,0,0]=3 5954 B8R0.5 COCC(O)CC(O)=O Amb18832518 [0,2,0,0,0,0|1,0,0]=3 5955 B8R0.5 COC[C@@H](C)CC(O)=O Amb25064328 [0,2,0,0,0,0|0,0,0]=2 5956 B8R0.5 COC[C@@H](C)NC(C)=O Amb24477698 [0,2,0,0,0,0|2,0,0]=4 5957 B8R0.5 COC[C@@H](C)NC(N)=O Amb24718117 [0,2,0,0,0,0|2,0,0]=4 5958 B8R0.5 COC[C@H](C)NC(C)=O Amb24477723 [0,2,0,0,0,0|2,0,0]=4 5959 B8R0.5 COC[C@H](CC(C)C)N Amb17061639 [0,2,0,0,0,0|1,0,1]=4 5960 B8R0.5 CONC(=O)CC(C)C Amb24478582 [0,2,0,0,0,0|0,0,0]=2 5961 B8R0.5 CONC(=O)CN(C)C Amb24096699 [0,2,0,0,0,0|1,0,0]=3 5962 B8R0.5 CONC(=O)OC(C)C Amb25829775 [0,2,0,0,0,0|1,0,0]=3 5963 B8R0.5 CSCC(=O)CC(C)C Amb24452875 [0,2,0,0,0,0|0,1,0]=3 5964 B8R0.5 CSCC(=O)OC(C)C Amb25689929 [0,2,0,0,0,0|1,1,0]=4 5965 B8R0.5 CSCC(C)NC(C)=O Amb24481592 [0,2,0,0,0,0|2,0,0]=4 5966 B8R0.5 CSCC(C)OC(C)=O Amb24450062 [0,2,0,0,0,0|2,0,0]=4 5967 B8R0.5 CSCC(Cl)CC(O)=O Amb18126320 [0,2,0,0,0,0|1,0,0]=3 5968 B8R0.5 CSCC(N)CC(N)=O Amb25784570 [0,2,0,0,0,0|2,0,0]=4 5969 B8R0.5 CSCC(O)CC(O)=O Amb24621046 [0,2,0,0,0,0|1,0,0]=3 5970 B8R0.5 CSSC(C)CC(O)=O Amb25241180 [0,2,0,0,0,0|0,0,0]=2 5971 B8R0.5 C[13C](=O)C[13C](=O)OCC Amb22336726 [0,2,0,0,0,0|1,0,1]=4 5972 B8R0.5 C[C@@H](CCN)CC(O)=O Amb25318051 [0,2,0,0,0,0|0,0,0]=2 5973 B8R0.5 C[C@@H](CCO)CC(C)=C Amb25187356 [0,2,0,0,0,0|2,0,0]=4 5974 B8R0.5 C[C@@H](CCO)CC(O)=O Amb24699186 [0,2,0,0,0,0|0,0,0]=2 5975 B8R0.5 C[C@@H](CCO)NC(C)=O Amb25140356 [0,2,0,0,0,0|2,0,0]=4 5976 B8R0.5 C[C@@H](CCO)NC(N)=O Amb24676501 [0,2,0,0,0,0|2,0,0]=4 5977 B8R0.5 C[C@@H](O)C[C@@H](O)CC=O Amb24631653 [0,2,0,0,0,0|1,0,1]=4 5978 B8R0.5 C[C@H](CC#N)NC(C)=O Amb24381940 [0,2,0,0,0,0|2,0,0]=4 5979 B8R0.5 C[C@H](CC=O)CC(C)=C Amb25680323 [0,2,0,0,0,0|2,0,0]=4 5980 B8R0.5 C[C@H](CCO)CC(C)=C Amb24362138 [0,2,0,0,0,0|2,0,0]=4 5981 B8R0.5 C[C@H](CCO)NC(N)=O Amb24690086 [0,2,0,0,0,0|2,0,0]=4 5982 B8R0.5 C[C@H](O)CC(=O)\C=C/N Amb24585122 [0,2,0,0,0,0|2,0,0]=4 5983 B8R0.5 C[S+](C)CC(=O)\C=N\[O-] Amb25748940 [0,2,0,0,0,0|1,0,1]=4 5984 B8R0.5 C\C(=C/C(=O)O)\CCC Amb10610367 [0,2,0,0,0,0|0,0,2]=4 5985 B8R0.5 C\C(=C/C(O)=O)\C#CC Amb24644658 [0,2,0,0,0,0|0,0,2]=4 5986 B8R0.5 C\C(=C\C(O)=O)\OCC Amb18642786 [0,2,0,0,0,0|0,0,2]=4 5987 B8R0.5 C\C(\CC(C)=O)=C/OC Amb24334053 [0,2,0,0,0,0|1,0,1]=4 5988 B8R0.5 C\C(\CC(C)=O)=C\OC Amb24580390 [0,2,0,0,0,0|1,0,1]=4 5989 B8R0.5 C\C(\CC(O)=O)=C/CC Amb25087318 [0,2,0,0,0,0|0,0,1]=3 5990 B8R0.5 C\C(\CC(O)=O)=C\CC Amb24562251 [0,2,0,0,0,0|0,0,1]=3 5991 B8R0.5 C\C(\CC(O)=O)=C\CS Amb18124785 [0,2,0,0,0,0|0,0,1]=3 5992 B8R0.5 C\C(\CC=C)=C\C(O)=O Amb25810544 [0,2,0,0,0,0|0,0,2]=4 5993 B8R0.5 C\C(\CCC)=C\C(O)=O Amb24055711 [0,2,0,0,0,0|0,0,2]=4 5994 B8R0.5 C\C(\CNC)=C/C(O)=O Amb24384927 [0,2,0,0,0,0|0,0,2]=4 5995 B8R0.5 C\C=C\C(=O)NC(C)C Amb24414334 [0,2,0,0,0,0|2,0,0]=4 5996 B8R0.5 C\C=C\C(=O)OC(C)C Amb24325242 [0,2,0,0,0,0|2,0,0]=4 5997 B8R0.5 C\C=C\C(C)CC(C)=O Amb25211017 [0,2,0,0,0,0|1,0,0]=3 5998 B8R0.5 C\C=C\C(C)CC(C)O Amb25136258 [0,2,0,0,0,0|1,0,1]=4 5999 B8R0.5 C\C=C\C(C)CC(O)=O Amb24731262 [0,2,0,0,0,0|0,0,0]=2 6000 B8R0.5 C\C=C\C(C)OC(C)=O Amb24678106 [0,2,0,0,0,0|2,0,0]=4 6001 B8R0.5 C\C=C\C(N)CC(N)=O Amb24599388 [0,2,0,0,0,0|2,0,0]=4 6002 B8R0.5 C\C=C\C(O)CC(C)=O Amb24676886 [0,2,0,0,0,0|2,0,0]=4 6003 B8R0.5 C\C=C\C(O)CC(N)=O Amb24567413 [0,2,0,0,0,0|2,0,0]=4 6004 B8R0.5 C\C=C\[C@@H](C)CC(O)=O Amb25343237 [0,2,0,0,0,0|0,0,0]=2 6005 B8R0.5 C\C=C\[C@@H](O)CC(C)=O Amb25143519 [0,2,0,0,0,0|2,0,0]=4 6006 B8R0.5 C\C=C\[C@H](O)CC(O)=O Amb25312045 [0,2,0,0,0,0|1,0,0]=3 6007 B8R0.5 ClCCC(=O)NC(C)C Amb1131370 [0,2,0,0,0,0|2,0,0]=4 6008 B8R0.5 N#CCC(Br)CC(O)=O Amb25211652 [0,2,0,0,0,0|1,0,0]=3 6009 B8R0.5 N#CCC(CC(C)C)O Amb17231847 [0,2,0,0,0,0|1,0,1]=4 6010 B8R0.5 N#CCS(=O)CC(O)=O Amb18984975 [0,2,0,0,0,0|2,0,0]=4 6011 B8R0.5 N#CC[C@H](O)CC(O)=O Amb25294743 [0,2,0,0,0,0|1,0,0]=3 6012 B8R0.5 NC(=O)C[C@@H](O)CC#N Amb22226710 [0,2,0,0,0,0|2,0,0]=4 6013 B8R0.5 NC(=O)C[C@H](O)CC#N Amb22225367 [0,2,0,0,0,0|2,0,0]=4 6014 B8R0.5 NCCC(=O)NC(C)C Amb10202143 [0,2,0,0,0,0|2,0,0]=4 6015 B8R0.5 NCCC(=O)NC(C)C Amb1130131 [0,2,0,0,0,0|2,0,0]=4 6016 B8R0.5 NCCC(=O)OC(C)C Amb2371480 [0,2,0,0,0,0|2,0,0]=4 6017 B8R0.5 NCCC(CC(C)C)O Amb17231876 [0,2,0,0,0,0|1,0,1]=4 6018 B8R0.5 NCCC(O)CP(O)=O Amb25708296 [0,2,0,0,0,0|2,0,0]=4 6019 B8R0.5 NCCS(=O)CC(O)=O Amb25124054 [0,2,0,0,0,0|2,0,0]=4 6020 B8R0.5 NCC[C@@H](CC(=O)O)N Amb10067021 [0,2,0,0,0,0|1,0,0]=3 6021 B8R0.5 NCC[C@H](CC(=O)O)N Amb10067019 [0,2,0,0,0,0|1,0,0]=3 6022 B8R0.5 N[C@@H](CCO)CC(O)=O Amb25851007 [0,2,0,0,0,0|1,0,0]=3 6023 B8R0.5 OC(=O)CS(=O)CCF Amb25094766 [0,2,0,0,0,0|2,0,0]=4 6024 B8R0.5 OCCC(=O)NC(C)C Amb17334124 [0,2,0,0,0,0|1,0,0]=3 6025 B8R0.5 OCCN(CC(=O)C)C Amb10608107 [0,2,0,0,0,0|2,0,0]=4 6026 B8R0.5 OCCN(CC(=O)Cl)C Amb17142874 [0,2,0,0,0,0|2,0,0]=4 6027 B8R0.5 OCCN(CC(=O)N)C Amb17142858 [0,2,0,0,0,0|2,0,0]=4 6028 B8R0.5 [N-]=[N+]=NC(=O)CC(O)C Amb17593355 [0,2,0,0,0,0|2,0,0]=4 6029 B8R0.16 C=CC(CC(O)=O)C=C Amb18642422 [0,2,0,0,0,0|0,0,2]=4 6030 B8R0.16 C=CC(CC(O)=O)CO Amb25690344 [0,2,0,0,0,0|0,0,1]=3 6031 B8R0.16 C=C[C@H](CC(O)=O)CO Amb24534457 [0,2,0,0,0,0|0,0,1]=3 6032 B8R0.16 CC(=C)CC(CO)CO Amb24464721 [0,2,0,0,0,0|2,0,0]=4 6033 B8R0.16 CC(=O)CC(CC)=CC Amb24551554 [0,2,0,0,0,0|1,0,1]=4 6034 B8R0.16 CC(=O)CC(CC)CC Amb25791160 [0,2,0,0,0,0|1,0,0]=3 6035 B8R0.16 CC(=O)CC(SC)SC Amb24689832 [0,2,0,0,0,0|1,0,0]=3 6036 B8R0.16 CC(=O)NC(CO)CO Amb25127062 [0,2,0,0,0,0|2,0,0]=4 6037 B8R0.16 CC(=O)NC(CO)CS Amb25685905 [0,2,0,0,0,0|2,0,0]=4 6038 B8R0.16 CC(=O)OC(CC)CC Amb24617396 [0,2,0,0,0,0|2,0,0]=4 6039 B8R0.16 CC(=O)OC(CN)CO Amb25663259 [0,2,0,0,0,0|2,0,0]=4 6040 B8R0.16 CC(=O)OC(CO)CO Amb24479923 [0,2,0,0,0,0|2,0,0]=4 6041 B8R0.16 CC(=O)OC(CS)CBr Amb24446024 [0,2,0,0,0,0|2,0,0]=4 6042 B8R0.16 CC(=O)OC(CS)CCl Amb24584930 [0,2,0,0,0,0|2,0,0]=4 6043 B8R0.16 CC(=O)OC(OC)OC Amb25229616 [0,2,0,0,0,0|2,0,0]=4 6044 B8R0.16 CC(=O)O[C@@H](CCl)CBr Amb25053056 [0,2,0,0,0,0|2,0,0]=4 6045 B8R0.16 CC(=O)SC(CCl)CCl Amb24479930 [0,2,0,0,0,0|2,0,0]=4 6046 B8R0.16 CC(=O)SC(CN)CN Amb24117511 [0,2,0,0,0,0|2,0,0]=4 6047 B8R0.16 CC(C)CC(CC)C=O Amb25291041 [0,2,0,0,0,0|1,0,1]=4 6048 B8R0.16 CC(C)CC(CCl)=C=C Amb24763761 [0,2,0,0,0,0|2,0,0]=4 6049 B8R0.16 CC(C)CC(CN)=C=C Amb25679279 [0,2,0,0,0,0|2,0,0]=4 6050 B8R0.16 CC(C)CC(CN)OC Amb24644820 [0,2,0,0,0,0|1,0,1]=4 6051 B8R0.16 CC(C)CC(CO)=CF Amb25788176 [0,2,0,0,0,0|1,0,0]=3 6052 B8R0.16 CC(C)CC(CO)C#N Amb18642524 [0,2,0,0,0,0|1,0,1]=4 6053 B8R0.16 CC(C)CC(CO)C=C Amb25788889 [0,2,0,0,0,0|1,0,1]=4 6054 B8R0.16 CC(C)CC(CO)CC Amb22641858 [0,2,0,0,0,0|1,0,1]=4 6055 B8R0.16 CC(C)CC(CO)NC Amb18307102 [0,2,0,0,0,0|1,0,1]=4 6056 B8R0.16 CC(C)CC(OC)OC Amb25147212 [0,2,0,0,0,0|0,0,2]=4 6057 B8R0.16 CC(C)C[C@@H](CO)NC Amb24382584 [0,2,0,0,0,0|1,0,1]=4 6058 B8R0.16 CC(C)C[C@H](CO)CC Amb24657452 [0,2,0,0,0,0|1,0,1]=4 6059 B8R0.16 CC(C)C[C@H](CO)NC Amb25146155 [0,2,0,0,0,0|1,0,1]=4 6060 B8R0.16 CC(C)NC(=CO)C=O Amb25032226 [0,2,0,0,0,0|1,0,0]=3 6061 B8R0.16 CC(C)OC(=CO)C=O Amb25249447 [0,2,0,0,0,0|1,0,0]=3 6062 B8R0.16 CC(O)CC(CO)OC Amb25306517 [0,2,0,0,0,0|1,0,1]=4 6063 B8R0.16 CC(O)CC(OC)OC Amb22728270 [0,2,0,0,0,0|1,0,1]=4 6064 B8R0.16 CCC(CB(O)O)CC Amb24360547 [0,2,0,0,0,0|1,0,1]=4 6065 B8R0.16 CCC(CBr)NC(C)=O Amb25725356 [0,2,0,0,0,0|2,0,0]=4 6066 B8R0.16 CCC(CC(=O)Cl)CCl Amb25189070 [0,2,0,0,0,0|1,0,0]=3 6067 B8R0.16 CCC(CC(C)=O)C#N Amb18642298 [0,2,0,0,0,0|1,0,1]=4 6068 B8R0.16 CCC(CC(C)=O)C=O Amb18642641 [0,2,0,0,0,0|1,0,1]=4 6069 B8R0.16 CCC(CC(C)=O)OC Amb25053006 [0,2,0,0,0,0|1,0,0]=3 6070 B8R0.16 CCC(CC(C)=O)SC Amb24467065 [0,2,0,0,0,0|1,0,0]=3 6071 B8R0.16 CCC(CC(N)=N)CC Amb25213951 [0,2,0,0,0,0|2,0,0]=4 6072 B8R0.16 CCC(CC(N)=O)=CC Amb24610057 [0,2,0,0,0,0|1,0,1]=4 6073 B8R0.16 CCC(CC(N)=O)C#N Amb25366882 [0,2,0,0,0,0|1,0,1]=4 6074 B8R0.16 CCC(CC(N)=O)C=C Amb25691393 [0,2,0,0,0,0|1,0,1]=4 6075 B8R0.16 CCC(CC(N)=S)CC Amb24642789 [0,2,0,0,0,0|1,1,0]=4 6076 B8R0.16 CCC(CC(O)=O)C=C Amb18642661 [0,2,0,0,0,0|0,0,1]=3 6077 B8R0.16 CCC(CC(O)=O)C=O Amb25372312 [0,2,0,0,0,0|0,0,1]=3 6078 B8R0.16 CCC(CC(O)=O)CO Amb25188910 [0,2,0,0,0,0|0,0,0]=2 6079 B8R0.16 CCC(CC(O)=O)NC Amb25190337 [0,2,0,0,0,0|0,0,0]=2 6080 B8R0.16 CCC(CC(O)=O)OC Amb19037306 [0,2,0,0,0,0|0,0,0]=2 6081 B8R0.16 CCC(CC(O)=O)SC Amb18316304 [0,2,0,0,0,0|0,0,0]=2 6082 B8R0.16 CCC(CC)OC(N)=O Amb24614586 [0,2,0,0,0,0|2,0,0]=4 6083 B8R0.16 CCC(CN)CC(C)=C Amb24359882 [0,2,0,0,0,0|2,0,0]=4 6084 B8R0.16 CCC(CN)CC(O)=O Amb20669457 [0,2,0,0,0,0|0,0,0]=2 6085 B8R0.16 CCC(CN)CC(O)=O Amb22059482 [0,2,0,0,0,0|0,0,0]=2 6086 B8R0.16 CCC(CN)NC(C)=O Amb18112590 [0,2,0,0,0,0|2,0,0]=4 6087 B8R0.16 CCC(CN)NC(N)=O Amb18908302 [0,2,0,0,0,0|2,0,0]=4 6088 B8R0.16 CCC(CO)CC(C)=C Amb25219191 [0,2,0,0,0,0|2,0,0]=4 6089 B8R0.16 CCC(C[N+]([O-])=O)CC Amb25174023 [0,2,0,0,0,0|1,0,1]=4 6090 B8R0.16 CCC(NC(=O)N)CC Amb1138537 [0,2,0,0,0,0|2,0,0]=4 6091 B8R0.16 CCN(CC(O)=O)C=O Amb18972736 [0,2,0,0,0,0|1,0,1]=4 6092 B8R0.16 CCN(CC(O)=O)CC Amb19258254 [0,2,0,0,0,0|1,0,0]=3 6093 B8R0.16 CCN(CC([O-])=O)CC Amb22732183 [0,2,0,0,0,0|1,0,1]=4 6094 B8R0.16 CCP(CC(N)=O)CC Amb24383719 [0,2,0,0,0,0|2,0,0]=4 6095 B8R0.16 CCP(CC(O)=O)CC Amb24687205 [0,2,0,0,0,0|1,0,0]=3 6096 B8R0.16 CC[C@@H](CC(N)=O)C=C Amb24476683 [0,2,0,0,0,0|1,0,1]=4 6097 B8R0.16 CC[C@@H](CN)CC(C)=C Amb24393061 [0,2,0,0,0,0|2,0,0]=4 6098 B8R0.16 CC[C@H](CC(C)=O)C=O Amb25687293 [0,2,0,0,0,0|1,0,1]=4 6099 B8R0.16 CC[C@H](CO)NC(C)=O Amb24444629 [0,2,0,0,0,0|2,0,0]=4 6100 B8R0.16 CC\C(\CC(O)=O)=C/C Amb18642626 [0,2,0,0,0,0|0,0,1]=3 6101 B8R0.16 CC\[N+](\CC(O)=O)=N\[O-] Amb25365958 [0,2,0,0,0,0|2,0,0]=4 6102 B8R0.16 CNC(CN(=O)=O)SC Amb20621640 [0,2,0,0,0,0|1,0,1]=4 6103 B8R0.16 COC(C=O)=CN(C)C Amb24566888 [0,2,0,0,0,0|1,0,1]=4 6104 B8R0.16 COC(CBr)OC(C)=O Amb25797965 [0,2,0,0,0,0|2,0,0]=4 6105 B8R0.16 COC(CC(=O)N)OC Amb2417314 [0,2,0,0,0,0|1,0,0]=3 6106 B8R0.16 COC(CC(C)=O)C=O Amb25798334 [0,2,0,0,0,0|1,0,1]=4 6107 B8R0.16 COC(CC(O)=O)C=C Amb18642791 [0,2,0,0,0,0|0,0,1]=3 6108 B8R0.16 COC(CC(O)=O)CO Amb25738299 [0,2,0,0,0,0|0,0,0]=2 6109 B8R0.16 COC(CC(O)=O)OC Amb22231899 [0,2,0,0,0,0|0,0,0]=2 6110 B8R0.16 COC(CC)OC(N)=O Amb25055387 [0,2,0,0,0,0|2,0,0]=4 6111 B8R0.16 COC(CCl)=CC(O)=O Amb25690575 [0,2,0,0,0,0|0,0,2]=4 6112 B8R0.16 COC(CO)CC(C)=C Amb25680510 [0,2,0,0,0,0|2,0,0]=4 6113 B8R0.16 COC(C[C@H](C)O)=C=C Amb25847885 [0,2,0,0,0,0|2,0,0]=4 6114 B8R0.16 COC(C[N+]([O-])=O)OC Amb22168374 [0,2,0,0,0,0|1,0,1]=4 6115 B8R0.16 CON(CC(C)C)C=O Amb25129553 [0,2,0,0,0,0|1,0,0]=3 6116 B8R0.16 CON(CC(C)O)N=O Amb24448121 [0,2,0,0,0,0|2,0,0]=4 6117 B8R0.16 CO[C@H](CC(O)=O)C#C Amb25773997 [0,2,0,0,0,0|0,0,1]=3 6118 B8R0.16 CO[C@H](CO)CC(C)=C Amb24592175 [0,2,0,0,0,0|2,0,0]=4 6119 B8R0.16 CO\C(\C=O)=C/N(C)C Amb24528205 [0,2,0,0,0,0|1,0,1]=4 6120 B8R0.16 CO\C(\C=O)=C\N(C)C Amb19957622 [0,2,0,0,0,0|1,0,1]=4 6121 B8R0.16 CSC(CC(=O)Cl)CCl Amb25321994 [0,2,0,0,0,0|1,0,0]=3 6122 B8R0.16 CSC(C[N+]([O-])=O)SC Amb24559304 [0,2,0,0,0,0|1,0,1]=4 6123 B8R0.16 C[C@H](O)CC(OC)OC Amb24404610 [0,2,0,0,0,0|1,0,1]=4 6124 B8R0.16 C\C=C(/CC(C)O)\CO Amb25256755 [0,2,0,0,0,0|2,0,0]=4 6125 B8R0.16 ClCC(OC(=O)Cl)CCl Amb13952835 [0,2,0,0,0,0|2,0,0]=4 6126 B8R0.16 N#CC(CC(O)=O)C#N Amb25228388 [0,2,0,0,0,0|0,0,2]=4 6127 B8R0.16 NC(=O)OC(CCl)CCl Amb24367089 [0,2,0,0,0,0|2,0,0]=4 6128 B8R0.16 NC(=O)OC(CO)CO Amb25789555 [0,2,0,0,0,0|2,0,0]=4 6129 B8R0.16 NCC(CC(O)=O)CO Amb22546422 [0,2,0,0,0,0|0,0,0]=2 6130 B8R0.16 NC[C@@H](CS)CC(O)=O Amb24562843 [0,2,0,0,0,0|0,0,0]=2 6131 B8R0.16 NC[C@H](CS)CC(O)=O Amb24598331 [0,2,0,0,0,0|0,0,0]=2 6132 B8R0.16 OC(=O)C=C(CBr)CBr Amb24481720 [0,2,0,0,0,0|0,0,2]=4 6133 B8R0.16 OC(=O)C=C(CO)CO Amb25112732 [0,2,0,0,0,0|0,0,2]=4 6134 B8R0.16 OC(=O)CC(C=O)C=O Amb24577569 [0,2,0,0,0,0|0,0,2]=4 6135 B8R0.16 OCC(CCl)OP(O)=O Amb24480240 [0,2,0,0,0,0|2,0,0]=4 6136 B8R0.19 CC(=CC(=O)OC)NC Amb24401759 [0,2,0,0,0,0|0,0,2]=4 6137 B8R0.19 CC(=CC(=O)OC)OC Amb24534136 [0,2,0,0,0,0|0,0,2]=4 6138 B8R0.19 CC(C#N)CC(=O)NC Amb17334086 [0,2,0,0,0,0|1,0,1]=4 6139 B8R0.19 CC(C#N)CC(=O)OC Amb17334095 [0,2,0,0,0,0|0,0,1]=3 6140 B8R0.19 CC(CBr)OC(=O)CF Amb25697149 [0,2,0,0,0,0|2,0,0]=4 6141 B8R0.19 CC(CC(=C)C=O)C=O Amb24334526 [0,2,0,0,0,0|1,0,1]=4 6142 B8R0.19 CC(CC(=C)CC)CC Amb24478628 [0,2,0,0,0,0|2,0,0]=4 6143 B8R0.19 CC(CC(=O)C=C)C=C Amb25730035 [0,2,0,0,0,0|1,0,1]=4 6144 B8R0.19 CC(CC(=O)NC)NC Amb22587223 [0,2,0,0,0,0|1,0,0]=3 6145 B8R0.19 CC(CC(=O)NN)CN Amb25676980 [0,2,0,0,0,0|1,0,0]=3 6146 B8R0.19 CC(CC(=O)OC)=CBr Amb24635219 [0,2,0,0,0,0|0,0,2]=4 6147 B8R0.19 CC(CC(=O)OC)=CC Amb25215730 [0,2,0,0,0,0|0,0,1]=3 6148 B8R0.19 CC(CC(=O)OC)=CCl Amb24511859 [0,2,0,0,0,0|0,0,2]=4 6149 B8R0.19 CC(CC(=O)OC)=NC Amb25349555 [0,2,0,0,0,0|0,0,1]=3 6150 B8R0.19 CC(CC(Br)C=O)CC Amb25249112 [0,2,0,0,0,0|1,0,1]=4 6151 B8R0.19 CC(CC(N)CO)CC Amb24721873 [0,2,0,0,0,0|1,0,1]=4 6152 B8R0.19 CC(CC(O)CBr)CC Amb24480278 [0,2,0,0,0,0|1,0,1]=4 6153 B8R0.19 CC(CC(O)CC)CO Amb25706078 [0,2,0,0,0,0|1,0,1]=4 6154 B8R0.19 CC(CC(O)CC)OC Amb25314649 [0,2,0,0,0,0|1,0,1]=4 6155 B8R0.19 CC(CC(O)CCl)CC Amb24540064 [0,2,0,0,0,0|1,0,1]=4 6156 B8R0.19 CC(CC(O)CN)CC Amb25044040 [0,2,0,0,0,0|1,0,1]=4 6157 B8R0.19 CC(CC(O)CO)CC Amb24456930 [0,2,0,0,0,0|0,0,2]=4 6158 B8R0.19 CC(CC(O)CO)CO Amb25285571 [0,2,0,0,0,0|0,0,2]=4 6159 B8R0.19 CC(CC(O)OC)CC Amb25788091 [0,2,0,0,0,0|0,0,2]=4 6160 B8R0.19 CC(CC)=CC(=O)OC Amb25334129 [0,2,0,0,0,0|0,0,2]=4 6161 B8R0.19 CC(CC)\C=C(/C)\C=O Amb18642478 [0,2,0,0,0,0|1,0,1]=4 6162 B8R0.19 CC(CCl)OC(=O)CS Amb24551053 [0,2,0,0,0,0|1,1,0]=4 6163 B8R0.19 CC(CF)NC(=O)CO Amb24481944 [0,2,0,0,0,0|1,0,0]=3 6164 B8R0.19 CC(CN)CC(=O)C=C Amb24698166 [0,2,0,0,0,0|1,0,0]=3 6165 B8R0.19 CC(CN)NC(=O)C#C Amb18251099 [0,2,0,0,0,0|2,0,0]=4 6166 B8R0.19 CC(CN)NC(=O)C=C Amb18908294 [0,2,0,0,0,0|2,0,0]=4 6167 B8R0.19 CC(CO)CC(=O)NN Amb25692312 [0,2,0,0,0,0|1,0,0]=3 6168 B8R0.19 CC(CO)CC(C)C=O Amb24340208 [0,2,0,0,0,0|1,0,1]=4 6169 B8R0.19 CC(CO)NC(=O)CBr Amb25765598 [0,2,0,0,0,0|2,0,0]=4 6170 B8R0.19 CC(CO)NC(=O)CCl Amb18791488 [0,2,0,0,0,0|2,0,0]=4 6171 B8R0.19 CC(CO)\C=C(/C)\C=O Amb25758939 [0,2,0,0,0,0|1,0,1]=4 6172 B8R0.19 CC(CO)\C=C(\C)/CO Amb24719589 [0,2,0,0,0,0|1,0,1]=4 6173 B8R0.19 CC(CS(=O)CC)CC Amb24333813 [0,2,0,0,0,0|2,0,0]=4 6174 B8R0.19 CCC(=C)C[C@H](C)CO Amb25239868 [0,2,0,0,0,0|2,0,0]=4 6175 B8R0.19 CCC(=O)CC(=O)NO Amb24690699 [0,2,0,0,0,0|1,0,1]=4 6176 B8R0.19 CCC(=O)CC(C)C#N Amb18642307 [0,2,0,0,0,0|1,0,1]=4 6177 B8R0.19 CCC(=O)CC(C)C=O Amb18642639 [0,2,0,0,0,0|1,0,1]=4 6178 B8R0.19 CCC(=O)CC(C)CN Amb24690163 [0,2,0,0,0,0|1,0,0]=3 6179 B8R0.19 CCC(=O)CC(C)CO Amb25050722 [0,2,0,0,0,0|1,0,0]=3 6180 B8R0.19 CCC(=O)CC(Cl)CBr Amb25062486 [0,2,0,0,0,0|2,0,0]=4 6181 B8R0.19 CCC(=O)CC(N)CC Amb24481802 [0,2,0,0,0,0|2,0,0]=4 6182 B8R0.19 CCC(=O)CC(O)OC Amb25065360 [0,2,0,0,0,0|2,0,0]=4 6183 B8R0.19 CCC(=O)C[C@@H](O)CCl Amb24340137 [0,2,0,0,0,0|2,0,0]=4 6184 B8R0.19 CCC(=O)C[C@H](C)C#C Amb24725316 [0,2,0,0,0,0|1,0,1]=4 6185 B8R0.19 CCC(=O)C[C@H](O)CC Amb25298397 [0,2,0,0,0,0|2,0,0]=4 6186 B8R0.19 CCC(=O)C[C@H](O)CCl Amb25359848 [0,2,0,0,0,0|2,0,0]=4 6187 B8R0.19 CCC(=O)NC(C)CCl Amb24699423 [0,2,0,0,0,0|2,0,0]=4 6188 B8R0.19 CCC(=O)NC(C)CN Amb18251126 [0,2,0,0,0,0|2,0,0]=4 6189 B8R0.19 CCC(=O)OC(C)CCl Amb25292214 [0,2,0,0,0,0|2,0,0]=4 6190 B8R0.19 CCC(=O)OC(C)CO Amb25077934 [0,2,0,0,0,0|2,0,0]=4 6191 B8R0.19 CCC(C)CC(=C)C=O Amb25131177 [0,2,0,0,0,0|1,0,0]=3 6192 B8R0.19 CCC(C)CC(=O)C#C Amb25356354 [0,2,0,0,0,0|1,0,0]=3 6193 B8R0.19 CCC(C)CC(=O)C=C Amb25134056 [0,2,0,0,0,0|1,0,0]=3 6194 B8R0.19 CCC(C)CC(=O)CBr Amb25251707 [0,2,0,0,0,0|1,0,0]=3 6195 B8R0.19 CCC(C)CC(=O)CCl Amb22395327 [0,2,0,0,0,0|1,0,0]=3 6196 B8R0.19 CCC(C)CC(=O)NN Amb24758303 [0,2,0,0,0,0|1,0,0]=3 6197 B8R0.19 CCC(C)CC(=O)OC Amb22352867 [0,2,0,0,0,0|0,0,0]=2 6198 B8R0.19 CCC(C)CC(C)C=O Amb18642673 [0,2,0,0,0,0|1,0,1]=4 6199 B8R0.19 CCC(C)CC(C)CO Amb24574609 [0,2,0,0,0,0|1,0,1]=4 6200 B8R0.19 CCC(C)CC(Cl)=NO Amb25310366 [0,2,0,0,0,0|1,0,0]=3 6201 B8R0.19 CCC(C)CC(N)=NO Amb24415677 [0,2,0,0,0,0|1,0,0]=3 6202 B8R0.19 CCC(C)CN(C)C=O Amb24438589 [0,2,0,0,0,0|2,0,0]=4 6203 B8R0.19 CCC(C)CN(C)OC Amb25852714 [0,2,0,0,0,0|2,0,0]=4 6204 B8R0.19 CCC(C)NC(=O)CN Amb21958749 [0,2,0,0,0,0|2,0,0]=4 6205 B8R0.19 CCC(C)NC(=O)CS Amb25052738 [0,2,0,0,0,0|1,1,0]=4 6206 B8R0.19 CCC(C)NC(=O)SC Amb25145616 [0,2,0,0,0,0|1,1,0]=4 6207 B8R0.19 CCC(C)OC(=O)C=C Amb22733882 [0,2,0,0,0,0|2,0,0]=4 6208 B8R0.19 CCC(C)OC(=O)C=O Amb25311231 [0,2,0,0,0,0|1,0,1]=4 6209 B8R0.19 CCC(C)OC(=O)CN Amb18307959 [0,2,0,0,0,0|2,0,0]=4 6210 B8R0.19 CCC(N)CC(=O)C#C Amb24388579 [0,2,0,0,0,0|2,0,0]=4 6211 B8R0.19 CCC(N)CC(=O)C=C Amb25108966 [0,2,0,0,0,0|2,0,0]=4 6212 B8R0.19 CCC(N)CC(=O)OC Amb18203185 [0,2,0,0,0,0|1,0,0]=3 6213 B8R0.19 CCC(N)CC(=O)OC Amb22264719 [0,2,0,0,0,0|1,0,0]=3 6214 B8R0.19 CCC(N)CC(N)=NO Amb24379538 [0,2,0,0,0,0|2,0,0]=4 6215 B8R0.19 CCC(NC(=O)CBr)C Amb17331628 [0,2,0,0,0,0|2,0,0]=4 6216 B8R0.19 CCC(NC(=O)CCl)C Amb1149867 [0,2,0,0,0,0|2,0,0]=4 6217 B8R0.19 CCC(NC(=O)OC)C Amb10568221 [0,2,0,0,0,0|1,0,0]=3 6218 B8R0.19 CCC(O)CC(=O)OC Amb24425172 [0,2,0,0,0,0|1,0,0]=3 6219 B8R0.19 CCC(O)CC(O)C=O Amb25770125 [0,2,0,0,0,0|1,0,1]=4 6220 B8R0.19 CCN(C)CC(=O)CN Amb25364572 [0,2,0,0,0,0|2,0,0]=4 6221 B8R0.19 CCN(C)CC(=O)NC Amb25304735 [0,2,0,0,0,0|2,0,0]=4 6222 B8R0.19 CCN(C)CC(=O)NN Amb19890161 [0,2,0,0,0,0|2,0,0]=4 6223 B8R0.19 CCN(C)CC(=O)NN Amb21959605 [0,2,0,0,0,0|2,0,0]=4 6224 B8R0.19 CCN(O)CC(=O)OC Amb25259900 [0,2,0,0,0,0|2,0,0]=4 6225 B8R0.19 CCS(=O)CC(=O)OC Amb18787291 [0,2,0,0,0,0|2,0,0]=4 6226 B8R0.19 CC[C@@H](C)CC(C)C=O Amb24378509 [0,2,0,0,0,0|1,0,1]=4 6227 B8R0.19 CC[C@@H](C)C[C@H](C)C=O Amb24558292 [0,2,0,0,0,0|1,0,1]=4 6228 B8R0.19 CC[C@@H](C)NC(=O)OC Amb25368349 [0,2,0,0,0,0|1,0,0]=3 6229 B8R0.19 CC[C@@H](C)\C=C(\C)/CO Amb25185199 [0,2,0,0,0,0|1,0,1]=4 6230 B8R0.19 CC[C@@H](N)CC(=O)OC Amb20241226 [0,2,0,0,0,0|1,0,0]=3 6231 B8R0.19 CC[C@@H](O)CC(=O)OC Amb22224793 [0,2,0,0,0,0|1,0,0]=3 6232 B8R0.19 CC[C@H](C)CC(=C)C=O Amb25309429 [0,2,0,0,0,0|1,0,0]=3 6233 B8R0.19 CC[C@H](C)C[C@@H](C)C=O Amb25195051 [0,2,0,0,0,0|1,0,1]=4 6234 B8R0.19 CC[C@H](C)C[C@@H](C)CO Amb24593564 [0,2,0,0,0,0|1,0,1]=4 6235 B8R0.19 CC[C@H](C)C[C@H](C)CO Amb24726094 [0,2,0,0,0,0|1,0,1]=4 6236 B8R0.19 CC[C@H](C)NC(=O)C=C Amb24398563 [0,2,0,0,0,0|2,0,0]=4 6237 B8R0.19 CC[C@H](Cl)CC(=O)OC Amb25074562 [0,2,0,0,0,0|1,0,0]=3 6238 B8R0.19 CC[C@H](O)CC(=O)OC Amb20240681 [0,2,0,0,0,0|1,0,0]=3 6239 B8R0.19 CN(CC(=O)OC)OC Amb25072271 [0,2,0,0,0,0|1,0,0]=3 6240 B8R0.19 CN(CC)CC(=O)NN Amb10608256 [0,2,0,0,0,0|2,0,0]=4 6241 B8R0.19 CN(N=O)CC(=O)OC Amb17618624 [0,2,0,0,0,0|2,0,0]=4 6242 B8R0.19 CNC(=N)CC(C)OC Amb24452935 [0,2,0,0,0,0|2,0,0]=4 6243 B8R0.19 CNC(=O)CC(=O)OC Amb17399823 [0,2,0,0,0,0|1,0,1]=4 6244 B8R0.19 CNC(=O)CC(C)OC Amb24673256 [0,2,0,0,0,0|1,0,0]=3 6245 B8R0.19 CNC(=O)CC(C)SC Amb24642838 [0,2,0,0,0,0|1,0,0]=3 6246 B8R0.19 CNC(=O)CC(O)CN Amb24442697 [0,2,0,0,0,0|2,0,0]=4 6247 B8R0.19 CNC(=O)CN(C)OC Amb24619120 [0,2,0,0,0,0|2,0,0]=4 6248 B8R0.19 CNC(=O)NC(C)CF Amb24476735 [0,2,0,0,0,0|2,0,0]=4 6249 B8R0.19 CNC(=O)NC(C)CN Amb18251132 [0,2,0,0,0,0|2,0,0]=4 6250 B8R0.19 CNC(=O)NC(C)CO Amb24423704 [0,2,0,0,0,0|2,0,0]=4 6251 B8R0.19 CNC(=O)N[C@@H](C)CF Amb25829867 [0,2,0,0,0,0|2,0,0]=4 6252 B8R0.19 CNC(=O)N[C@@H](C)CO Amb24523142 [0,2,0,0,0,0|2,0,0]=4 6253 B8R0.19 CNC(=O)OC(C)CBr Amb25304309 [0,2,0,0,0,0|2,0,0]=4 6254 B8R0.19 CNC(=O)OC(C)CCl Amb24675681 [0,2,0,0,0,0|2,0,0]=4 6255 B8R0.19 CNC(=O)OC(C)CO Amb24477700 [0,2,0,0,0,0|2,0,0]=4 6256 B8R0.19 CNC(C)CC(N)=NO Amb25147148 [0,2,0,0,0,0|1,0,0]=3 6257 B8R0.19 CNC(CC(=O)NC)C Amb10608347 [0,2,0,0,0,0|1,0,0]=3 6258 B8R0.19 CN\C(=C/C(=O)OC)\C Amb2386651 [0,2,0,0,0,0|0,0,2]=4 6259 B8R0.19 COC(=N)CC(=O)OC Amb24476600 [0,2,0,0,0,0|1,0,1]=4 6260 B8R0.19 COC(=O)CC(=C)CCl Amb24053257 [0,2,0,0,0,0|0,0,2]=4 6261 B8R0.19 COC(=O)CC(=O)CBr Amb24081949 [0,2,0,0,0,0|1,0,1]=4 6262 B8R0.19 COC(=O)CC(=O)CN Amb18115867 [0,2,0,0,0,0|1,0,1]=4 6263 B8R0.19 COC(=O)CC(Br)C=O Amb18647814 [0,2,0,0,0,0|1,0,1]=4 6264 B8R0.19 COC(=O)CC(Br)CF Amb24627105 [0,2,0,0,0,0|1,0,0]=3 6265 B8R0.19 COC(=O)CC(C)C=C Amb24712566 [0,2,0,0,0,0|0,0,1]=3 6266 B8R0.19 COC(=O)CC(C)C=O Amb18642765 [0,2,0,0,0,0|0,0,1]=3 6267 B8R0.19 COC(=O)CC(C)CBr Amb24692917 [0,2,0,0,0,0|0,0,0]=2 6268 B8R0.19 COC(=O)CC(C)CN Amb18642843 [0,2,0,0,0,0|0,0,0]=2 6269 B8R0.19 COC(=O)CC(C)CO Amb24729571 [0,2,0,0,0,0|0,0,0]=2 6270 B8R0.19 COC(=O)CC(C)NO Amb25032324 [0,2,0,0,0,0|1,0,0]=3 6271 B8R0.19 COC(=O)CC(C)SC Amb19374125 [0,2,0,0,0,0|0,0,0]=2 6272 B8R0.19 COC(=O)CC(Cl)SCl Amb24710162 [0,2,0,0,0,0|2,0,0]=4 6273 B8R0.19 COC(=O)CC(N)C=C Amb25380673 [0,2,0,0,0,0|1,0,1]=4 6274 B8R0.19 COC(=O)CC(N)CN Amb22264781 [0,2,0,0,0,0|1,0,0]=3 6275 B8R0.19 COC(=O)CC(N)CN Amb25766036 [0,2,0,0,0,0|1,0,0]=3 6276 B8R0.19 COC(=O)CC(N)CO Amb24366077 [0,2,0,0,0,0|1,0,0]=3 6277 B8R0.19 COC(=O)CC(O)C=C Amb25746682 [0,2,0,0,0,0|1,0,1]=4 6278 B8R0.19 COC(=O)CC(O)CBr Amb25201054 [0,2,0,0,0,0|1,0,0]=3 6279 B8R0.19 COC(=O)CC(O)CCl Amb20241285 [0,2,0,0,0,0|1,0,0]=3 6280 B8R0.19 COC(=O)CC(O)CN Amb25146166 [0,2,0,0,0,0|1,0,0]=3 6281 B8R0.19 COC(=O)CC([NH3+])C[NH3+] Amb24112943 [0,2,0,0,0,0|1,0,0]=3 6282 B8R0.19 COC(=O)CN(C)C#N Amb24481702 [0,2,0,0,0,0|1,0,1]=4 6283 B8R0.19 COC(=O)CN(C)C=O Amb21856175 [0,2,0,0,0,0|1,0,1]=4 6284 B8R0.19 COC(=O)CN(C)C=O Amb22349764 [0,2,0,0,0,0|1,0,1]=4 6285 B8R0.19 COC(=O)CS(=O)CCl Amb24582180 [0,2,0,0,0,0|2,0,0]=4 6286 B8R0.19 COC(=O)C[C@@H](C)CO Amb22747755 [0,2,0,0,0,0|0,0,0]=2 6287 B8R0.19 COC(=O)C[C@@H](CO)O Amb13883661 [0,2,0,0,0,0|1,0,0]=3 6288 B8R0.19 COC(=O)C[C@@H](N)C=C Amb25704281 [0,2,0,0,0,0|1,0,1]=4 6289 B8R0.19 COC(=O)C[C@@H](O)C=C Amb24705874 [0,2,0,0,0,0|1,0,1]=4 6290 B8R0.19 COC(=O)C[C@@H](O)CBr Amb23437907 [0,2,0,0,0,0|1,0,0]=3 6291 B8R0.19 COC(=O)C[C@@H](O)CN Amb24113025 [0,2,0,0,0,0|1,0,0]=3 6292 B8R0.19 COC(=O)C[C@H](C)CBr Amb25249104 [0,2,0,0,0,0|0,0,0]=2 6293 B8R0.19 COC(=O)C[C@H](N)CN Amb24360537 [0,2,0,0,0,0|1,0,0]=3 6294 B8R0.19 COC(=O)C[C@H](N)CO Amb24561636 [0,2,0,0,0,0|1,0,0]=3 6295 B8R0.19 COC(=O)C[C@H](O)C#C Amb24748370 [0,2,0,0,0,0|1,0,1]=4 6296 B8R0.19 COC(=O)C[C@H](O)C=C Amb25788939 [0,2,0,0,0,0|1,0,1]=4 6297 B8R0.19 COC(=O)NC(C)C#N Amb24604926 [0,2,0,0,0,0|1,0,1]=4 6298 B8R0.19 COC(=O)NC(C)C=C Amb25294663 [0,2,0,0,0,0|1,0,1]=4 6299 B8R0.19 COC(=O)NC(C)C=O Amb24359055 [0,2,0,0,0,0|1,0,1]=4 6300 B8R0.19 COC(=O)NC(C)CN Amb18251139 [0,2,0,0,0,0|1,0,0]=3 6301 B8R0.19 COC(=O)NC(N)OC Amb24562342 [0,2,0,0,0,0|2,0,0]=4 6302 B8R0.19 COC(=O)NC(N)SC Amb24340152 [0,2,0,0,0,0|2,0,0]=4 6303 B8R0.19 COC(=O)N[C@@H](C)C#N Amb25688761 [0,2,0,0,0,0|1,0,1]=4 6304 B8R0.19 COC(=O)N[C@@H](C)CN Amb22747138 [0,2,0,0,0,0|1,0,0]=3 6305 B8R0.19 COC(=O)N[C@H](C)C#N Amb24476727 [0,2,0,0,0,0|1,0,1]=4 6306 B8R0.19 COC(=O)N[C@H](C)CO Amb24478791 [0,2,0,0,0,0|1,0,0]=3 6307 B8R0.19 COC(C)CC(=O)C#C Amb25188993 [0,2,0,0,0,0|1,0,0]=3 6308 B8R0.19 COC(C)CC(=O)C=C Amb25836096 [0,2,0,0,0,0|1,0,0]=3 6309 B8R0.19 COC(C)CC(=O)NO Amb24476739 [0,2,0,0,0,0|0,0,0]=2 6310 B8R0.19 COC(C)CC(C)CO Amb25215348 [0,2,0,0,0,0|1,0,1]=4 6311 B8R0.19 COC(C)CC(N)=NO Amb25116224 [0,2,0,0,0,0|1,0,0]=3 6312 B8R0.19 CON(C)CC(N)=NO Amb25295782 [0,2,0,0,0,0|2,0,0]=4 6313 B8R0.19 COS(=O)OC(C)CCl Amb24339412 [0,2,0,0,0,0|2,0,0]=4 6314 B8R0.19 C[C@@H](CC(=O)C=C)C=C Amb24378496 [0,2,0,0,0,0|1,0,1]=4 6315 B8R0.19 C[C@@H](CC(=O)CC)CC Amb24448957 [0,2,0,0,0,0|1,0,0]=3 6316 B8R0.19 C[C@@H](CN)NC(=O)CN Amb25144196 [0,2,0,0,0,0|2,0,0]=4 6317 B8R0.19 C[C@@H](CO)NC(=O)CBr Amb25794836 [0,2,0,0,0,0|2,0,0]=4 6318 B8R0.19 C[C@@H](CO)NC(=O)CCl Amb22831873 [0,2,0,0,0,0|2,0,0]=4 6319 B8R0.19 C[C@@H](CO)NC(=O)CN Amb25071829 [0,2,0,0,0,0|2,0,0]=4 6320 B8R0.19 C[C@@H](CO)\C=C(\C)/CO Amb24644328 [0,2,0,0,0,0|1,0,1]=4 6321 B8R0.19 C[C@@H](C[C@@H](O)CO)CO Amb24618764 [0,2,0,0,0,0|0,0,2]=4 6322 B8R0.19 C[C@@H](C[C@H](N)CO)CC Amb25231217 [0,2,0,0,0,0|1,0,1]=4 6323 B8R0.19 C[C@H](CC(=O)CC)CC Amb24689490 [0,2,0,0,0,0|1,0,0]=3 6324 B8R0.19 C[C@H](CC(O)C#N)CO Amb24431105 [0,2,0,0,0,0|1,0,1]=4 6325 B8R0.19 C[C@H](CC(O)C=C)CC Amb25296223 [0,2,0,0,0,0|1,0,1]=4 6326 B8R0.19 C[C@H](CN)NC(=O)C#C Amb24446307 [0,2,0,0,0,0|2,0,0]=4 6327 B8R0.19 C[C@H](CO)NC(=O)C=C Amb24478792 [0,2,0,0,0,0|2,0,0]=4 6328 B8R0.19 C[C@H](CO)NC(=O)CCl Amb25823305 [0,2,0,0,0,0|2,0,0]=4 6329 B8R0.19 C[C@H](CO)\C=C(\C)/CO Amb24645855 [0,2,0,0,0,0|1,0,1]=4 6330 B8R0.19 C[C@H](C[C@H](C)CO)CO Amb25266477 [0,2,0,0,0,0|1,0,1]=4 6331 B8R0.19 C\C(=C/C(=O)OC)\OC Amb21927982 [0,2,0,0,0,0|0,0,2]=4 6332 B8R0.19 C\C(\CC(=O)C=C)=C\C Amb25093521 [0,2,0,0,0,0|1,0,1]=4 6333 B8R0.19 C\C(\CC(=O)CC)=C/C Amb25298433 [0,2,0,0,0,0|1,0,1]=4 6334 B8R0.19 C\C(\CC(=O)OC)=C\C Amb24453303 [0,2,0,0,0,0|0,0,1]=3 6335 B8R0.19 C\C(\CC(=O)OC)=C\Cl Amb25210836 [0,2,0,0,0,0|0,0,2]=4 6336 B8R0.19 C\C(\CCl)=C\C(=O)OC Amb25230685 [0,2,0,0,0,0|0,0,2]=4 6337 B8R0.19 C\C=C(\C)/CC(C)CO Amb25842247 [0,2,0,0,0,0|2,0,0]=4 6338 B8R0.19 C\C=C(\C)/C[C@H](C)CO Amb25722949 [0,2,0,0,0,0|2,0,0]=4 6339 B8R0.19 NCC(O)CC(=O)NO Amb25203640 [0,2,0,0,0,0|1,0,0]=3 6340 B8R0.19 NNC(=O)CC(O)CCl Amb19942496 [0,2,0,0,0,0|2,0,0]=4 6341 B8R0.19 NNC(=O)C[C@@H](O)CCl Amb24476045 [0,2,0,0,0,0|2,0,0]=4 6342 B8R0.19 OCC(=O)CC(=O)CO Amb24608175 [0,2,0,0,0,0|1,0,1]=4 6343 B8R0.19 OCC(O)CC(O)C=O Amb22731319 [0,2,0,0,0,0|1,0,1]=4 6344 B8R0.19 OC[C@@H](O)CC(=O)C=O Amb24468249 [0,2,0,0,0,0|1,0,1]=4 6345 B8R0.19 OC[C@@H](O)C[C@@H](O)C=O Amb25340462 [0,2,0,0,0,0|1,0,1]=4 6346 B8R0.19 OC[C@H](O)C[C@@H](O)C=O Amb24441617 [0,2,0,0,0,0|1,0,1]=4 6347 B8R0.19 O[C@@H](CC(=O)CO)CO Amb24387900 [0,2,0,0,0,0|1,0,0]=3 6348 B8R0.24 BrCC(=O)CC(C)(C)C Amb10558497 [0,2,0,0,0,0|1,0,0]=3 6349 B8R0.24 BrCC(=O)NC(C)(C)C Amb17325441 [0,2,0,0,0,0|2,0,0]=4 6350 B8R0.24 CC(C)(C)CC(=C)CCl Amb24588875 [0,2,0,0,0,0|2,0,0]=4 6351 B8R0.24 CC(C)(C)CC(=O)C#C Amb24479925 [0,2,0,0,0,0|1,0,0]=3 6352 B8R0.24 CC(C)(C)CC(=O)C#N Amb24467082 [0,2,0,0,0,0|1,0,0]=3 6353 B8R0.24 CC(C)(C)CC(=O)C=C Amb24729971 [0,2,0,0,0,0|1,0,0]=3 6354 B8R0.24 CC(C)(C)CC(=O)CCl Amb22395026 [0,2,0,0,0,0|1,0,0]=3 6355 B8R0.24 CC(C)(C)CC(=O)CN Amb18832561 [0,2,0,0,0,0|1,0,0]=3 6356 B8R0.24 CC(C)(C)CC(=O)CS Amb24737466 [0,2,0,0,0,0|0,1,0]=3 6357 B8R0.24 CC(C)(C)CC(N)=NN Amb24332874 [0,2,0,0,0,0|2,0,0]=4 6358 B8R0.24 CC(C)(C)CC(N)CO Amb18302221 [0,2,0,0,0,0|1,0,1]=4 6359 B8R0.24 CC(C)(C)CC(O)C=C Amb24524557 [0,2,0,0,0,0|1,0,1]=4 6360 B8R0.24 CC(C)(C)CC(O)CN Amb19000297 [0,2,0,0,0,0|1,0,1]=4 6361 B8R0.24 CC(C)(C)CC(O)CO Amb25778748 [0,2,0,0,0,0|0,0,2]=4 6362 B8R0.24 CC(C)(C)C[C@@H](O)C#C Amb24520725 [0,2,0,0,0,0|1,0,1]=4 6363 B8R0.24 CC(C)(C)C[C@@H](O)CO Amb25676587 [0,2,0,0,0,0|0,0,2]=4 6364 B8R0.24 CC(C)(C)C[C@H](O)C#C Amb25806721 [0,2,0,0,0,0|1,0,1]=4 6365 B8R0.24 CC(C)(C)C[C@H](O)CO Amb25801701 [0,2,0,0,0,0|0,0,2]=4 6366 B8R0.24 CC(C)(C)NC(=O)C#C Amb25325109 [0,2,0,0,0,0|2,0,0]=4 6367 B8R0.24 CC(C)(C)NC(=O)C=O Amb24417991 [0,2,0,0,0,0|1,0,1]=4 6368 B8R0.24 CC(C)(C)NC(=O)CI Amb25255119 [0,2,0,0,0,0|2,0,0]=4 6369 B8R0.24 CC(C)(C)NC(=S)NO Amb25766472 [0,2,0,0,0,0|1,1,0]=4 6370 B8R0.24 CC(C)(C)OC(=O)C#N Amb25345354 [0,2,0,0,0,0|2,0,0]=4 6371 B8R0.24 CC(C)(C)OC(=O)C=C Amb22353204 [0,2,0,0,0,0|2,0,0]=4 6372 B8R0.24 CC(C)(C)OC(=O)C=O Amb18642753 [0,2,0,0,0,0|1,0,1]=4 6373 B8R0.24 CC(C)(C)OC(=O)CN Amb23438973 [0,2,0,0,0,0|2,0,0]=4 6374 B8R0.24 CC(C)(C)OC(=O)C[NH3+] Amb24113882 [0,2,0,0,0,0|2,0,0]=4 6375 B8R0.24 CC(C)(C)OC(=O)C[Zn+] Amb22274821 [0,2,0,0,0,0|2,0,0]=4 6376 B8R0.24 CC(C)(C)OC(=O)NCl Amb24480365 [0,2,0,0,0,0|2,0,0]=4 6377 B8R0.24 CC(C)(C)OC(=O)NN Amb22482169 [0,2,0,0,0,0|2,0,0]=4 6378 B8R0.24 CC(C)(C)OC(=O)ON Amb25217255 [0,2,0,0,0,0|1,0,0]=3 6379 B8R0.24 CC(C)(C)OC(N)=S=O Amb25259824 [0,2,0,0,0,0|2,0,0]=4 6380 B8R0.24 CC(C)(C)SC(=C)CO Amb24333568 [0,2,0,0,0,0|2,0,0]=4 6381 B8R0.24 CC(C)(C)SC(=O)CBr Amb25767735 [0,2,0,0,0,0|2,0,0]=4 6382 B8R0.24 CC(C)(C)SC(=O)CCl Amb24524159 [0,2,0,0,0,0|2,0,0]=4 6383 B8R0.24 CC(C)(C)SC(N)=S=O Amb25056315 [0,2,0,0,0,0|2,0,0]=4 6384 B8R0.24 CC(C)(F)CC(N)CO Amb25275560 [0,2,0,0,0,0|1,0,1]=4 6385 B8R0.24 CC(C)(F)C[C@@H](N)CO Amb25785715 [0,2,0,0,0,0|1,0,1]=4 6386 B8R0.24 CC(C)(F)C[C@H](N)CO Amb25185211 [0,2,0,0,0,0|1,0,1]=4 6387 B8R0.24 CC(C)(N)CC(=O)C=C Amb25831271 [0,2,0,0,0,0|1,0,0]=3 6388 B8R0.24 CC(C)(N)CC(O)C=C Amb25032191 [0,2,0,0,0,0|1,0,1]=4 6389 B8R0.24 CC(C)(O)CC(=O)CBr Amb25088426 [0,2,0,0,0,0|1,0,0]=3 6390 B8R0.24 CC(C)(O)CC(=O)NO Amb24502214 [0,2,0,0,0,0|0,0,0]=2 6391 B8R0.24 CC(C)(O)CC(N)CO Amb24392215 [0,2,0,0,0,0|1,0,1]=4 6392 B8R0.24 CC(C)(O)CC(O)C=C Amb25204680 [0,2,0,0,0,0|1,0,1]=4 6393 B8R0.24 CC(C)(O)CC(O)CN Amb24700172 [0,2,0,0,0,0|1,0,1]=4 6394 B8R0.24 CC(C)(O)CC(O)CO Amb24687761 [0,2,0,0,0,0|0,0,2]=4 6395 B8R0.24 CC(C)(O)C[C@@H](O)CCl Amb25790037 [0,2,0,0,0,0|1,0,1]=4 6396 B8R0.24 CC(C)(O)C[C@H](O)CO Amb24502367 [0,2,0,0,0,0|0,0,2]=4 6397 B8R0.24 CC(C)(O)OC(=O)C=C Amb25174007 [0,2,0,0,0,0|2,0,0]=4 6398 B8R0.24 CC(C)(O)SC(=O)CCl Amb25704714 [0,2,0,0,0,0|2,0,0]=4 6399 B8R0.24 CC(C)(S)CC(=O)C=C Amb25319740 [0,2,0,0,0,0|1,0,0]=3 6400 B8R0.24 CC(C)(S)CC(=O)NN Amb25057907 [0,2,0,0,0,0|1,0,0]=3 6401 B8R0.24 CC(C=O)=CC(C)(C)O Amb24656020 [0,2,0,0,0,0|1,0,1]=4 6402 B8R0.24 CC(CBr)CS(C)(=O)=O Amb25142899 [0,2,0,0,0,0|1,0,1]=4 6403 B8R0.24 CC(CC(C)(C)C)=NN Amb24501386 [0,2,0,0,0,0|2,0,0]=4 6404 B8R0.24 CC(CC(C)(C)O)=NO Amb24725660 [0,2,0,0,0,0|1,0,0]=3 6405 B8R0.24 CC(CC(C)(C)O)C=O Amb25254196 [0,2,0,0,0,0|1,0,1]=4 6406 B8R0.24 CC(CC(C)(C)O)CO Amb24588340 [0,2,0,0,0,0|1,0,1]=4 6407 B8R0.24 CC(CCl)CS(C)(=O)=O Amb20668805 [0,2,0,0,0,0|1,0,1]=4 6408 B8R0.24 CC(CN)CS(C)(=O)=O Amb18908423 [0,2,0,0,0,0|1,0,1]=4 6409 B8R0.24 CC(CN)OP(O)(O)=O Amb24407674 [0,2,0,0,0,0|2,0,0]=4 6410 B8R0.24 CC(CN)SS(O)(=O)=O Amb25147091 [0,2,0,0,0,0|2,0,0]=4 6411 B8R0.24 CC(CO)CC(C)(C)N Amb19149268 [0,2,0,0,0,0|1,0,1]=4 6412 B8R0.24 CC(CO)CS(N)(=O)=O Amb25284475 [0,2,0,0,0,0|1,0,1]=4 6413 B8R0.24 CC(CO)CS([O-])(=O)=O Amb24733227 [0,2,0,0,0,0|1,0,1]=4 6414 B8R0.24 CC(CO)OP(O)(O)=O Amb25121032 [0,2,0,0,0,0|2,0,0]=4 6415 B8R0.24 CC(CP(O)(O)=O)C=O Amb25134096 [0,2,0,0,0,0|1,0,1]=4 6416 B8R0.24 CC(CS(=O)(=O)Cl)CCl Amb20623341 [0,2,0,0,0,0|1,0,1]=4 6417 B8R0.24 CC(F)(F)CC(=O)CCl Amb25141462 [0,2,0,0,0,0|2,0,0]=4 6418 B8R0.24 CC(NC(C)(C)C)=NO Amb24337303 [0,2,0,0,0,0|2,0,0]=4 6419 B8R0.24 CCC(=O)CC(C)(C)C Amb24093748 [0,2,0,0,0,0|1,0,0]=3 6420 B8R0.24 CCC(=O)CC(C)(C)F Amb25308919 [0,2,0,0,0,0|1,0,0]=3 6421 B8R0.24 CCC(=O)CC(C)(F)F Amb25767881 [0,2,0,0,0,0|2,0,0]=4 6422 B8R0.24 CCC(=O)C[Si](C)(C)C Amb25359525 [0,2,0,0,0,0|1,1,0]=4 6423 B8R0.24 CCC(=O)OC(C)(C)C Amb17939404 [0,2,0,0,0,0|2,0,0]=4 6424 B8R0.24 CCC(C)CC(C)(C)O Amb25045207 [0,2,0,0,0,0|1,0,1]=4 6425 B8R0.24 CCC(C)CS(=O)(=O)Cl Amb18295538 [0,2,0,0,0,0|1,0,1]=4 6426 B8R0.24 CCC(C)CS(=O)(=O)F Amb19373796 [0,2,0,0,0,0|1,0,1]=4 6427 B8R0.24 CCC(C)CS(N)(=O)=O Amb18180195 [0,2,0,0,0,0|1,0,1]=4 6428 B8R0.24 CCC(Cl)CP(O)(O)=O Amb25724957 [0,2,0,0,0,0|2,0,0]=4 6429 B8R0.24 CCC(O)CC(C)(C)O Amb24420727 [0,2,0,0,0,0|1,0,1]=4 6430 B8R0.24 CC[C@@H](N)CS(O)(=O)=O Amb24495132 [0,2,0,0,0,0|2,0,0]=4 6431 B8R0.24 CC[C@H](N)CS(O)(=O)=O Amb25146380 [0,2,0,0,0,0|2,0,0]=4 6432 B8R0.24 CN(CC(C)(C)O)C=O Amb25342966 [0,2,0,0,0,0|2,0,0]=4 6433 B8R0.24 CNC(=N)CC(C)(C)C Amb25687026 [0,2,0,0,0,0|2,0,0]=4 6434 B8R0.24 CNC(=O)CC(C)(C)O Amb24759756 [0,2,0,0,0,0|1,0,0]=3 6435 B8R0.24 CNC(=O)C[N+](C)(C)C Amb25122645 [0,2,0,0,0,0|2,0,0]=4 6436 B8R0.24 CNC(=O)C[Si](C)(C)C Amb25146046 [0,2,0,0,0,0|1,1,0]=4 6437 B8R0.24 CNC(C)CP(O)(O)=O Amb24381561 [0,2,0,0,0,0|1,0,0]=3 6438 B8R0.24 CNC(C)CS(C)(=O)=O Amb18300683 [0,2,0,0,0,0|1,0,1]=4 6439 B8R0.24 COC(=N)CC(C)(C)C Amb24471069 [0,2,0,0,0,0|1,0,0]=3 6440 B8R0.24 COC(=O)CC(C)(C)Br Amb24098356 [0,2,0,0,0,0|0,0,0]=2 6441 B8R0.24 COC(=O)CC(C)(C)N Amb19335287 [0,2,0,0,0,0|0,0,0]=2 6442 B8R0.24 COC(=O)CC(C)(C)N Amb23402030 [0,2,0,0,0,0|0,0,0]=2 6443 B8R0.24 COC(=O)CS(=O)(=O)C Amb2422866 [0,2,0,0,0,0|2,0,0]=4 6444 B8R0.24 COC(=O)C[N+](C)(C)C Amb25248444 [0,2,0,0,0,0|1,0,0]=3 6445 B8R0.24 COC(=O)NC(C)(C)C Amb10568845 [0,2,0,0,0,0|1,0,0]=3 6446 B8R0.24 COC(=O)N[Si](C)(C)C Amb19893957 [0,2,0,0,0,0|1,1,0]=4 6447 B8R0.24 COC(=O)OC(C)(C)C Amb17940050 [0,2,0,0,0,0|1,0,0]=3 6448 B8R0.24 COC(C)CC(C)(C)N Amb24635044 [0,2,0,0,0,0|1,0,1]=4 6449 B8R0.24 COC(C)CS(=O)(=O)F Amb24532153 [0,2,0,0,0,0|1,0,1]=4 6450 B8R0.24 COC(C)CS(N)(=O)=O Amb24481677 [0,2,0,0,0,0|1,0,1]=4 6451 B8R0.24 CON(C)CC(C)(C)N Amb25681653 [0,2,0,0,0,0|2,0,0]=4 6452 B8R0.24 CON(C)CC(C)(C)O Amb24557048 [0,2,0,0,0,0|2,0,0]=4 6453 B8R0.24 CP(O)(=O)CC(F)CN Amb24480226 [0,2,0,0,0,0|2,0,0]=4 6454 B8R0.24 CP(O)(=O)C[C@@H](O)CN Amb25273989 [0,2,0,0,0,0|2,0,0]=4 6455 B8R0.24 CP(O)(=O)C[C@H](F)CN Amb24543828 [0,2,0,0,0,0|2,0,0]=4 6456 B8R0.24 CS(=O)(=O)CC(=O)NO Amb24684239 [0,2,0,0,0,0|2,0,0]=4 6457 B8R0.24 CSC(=O)OC(C)(C)C Amb17940692 [0,2,0,0,0,0|1,1,0]=4 6458 B8R0.24 C[C@@H](CC(C)(C)O)CO Amb25332384 [0,2,0,0,0,0|1,0,1]=4 6459 B8R0.24 C[C@@H](CS(=O)(=O)Cl)CCl Amb25125543 [0,2,0,0,0,0|1,0,1]=4 6460 B8R0.24 C[C@H](CC(C)(C)O)CO Amb24352415 [0,2,0,0,0,0|1,0,1]=4 6461 B8R0.24 C[N+](C)(C)CC(=O)CCl Amb24365385 [0,2,0,0,0,0|2,0,0]=4 6462 B8R0.24 C[N+](C)(C)CC(=O)NN Amb24113666 [0,2,0,0,0,0|2,0,0]=4 6463 B8R0.24 C[Si](C)(C)CC(=C)CO Amb22011807 [0,2,0,0,0,0|1,1,0]=4 6464 B8R0.24 C[Si](C)(C)CC(=O)C=C Amb24633315 [0,2,0,0,0,0|1,1,0]=4 6465 B8R0.24 C[Si](C)(C)CC(=O)CCl Amb24393163 [0,2,0,0,0,0|1,1,0]=4 6466 B8R0.24 C[Si](C)(C)CC(N)=NO Amb25032075 [0,2,0,0,0,0|1,1,0]=4 6467 B8R0.24 C[Si](C)(C)OC(=O)CO Amb25219229 [0,2,0,0,0,0|1,1,0]=4 6468 B8R0.24 C\C(\C=O)=C/C(C)(C)O Amb25216184 [0,2,0,0,0,0|1,0,1]=4 6469 B8R0.24 ClCC(=O)NC(C)(C)C Amb1149868 [0,2,0,0,0,0|2,0,0]=4 6470 B8R0.24 ClCC(=O)OC(C)(C)C Amb1161695 [0,2,0,0,0,0|2,0,0]=4 6471 B8R0.24 NCC(=O)NC(C)(C)C Amb2371198 [0,2,0,0,0,0|2,0,0]=4 6472 B8R0.24 NCC(O)CP(O)(O)=O Amb24376767 [0,2,0,0,0,0|2,0,0]=4 6473 B8R0.24 NCC(O)CS(O)(=O)=O Amb24373242 [0,2,0,0,0,0|2,0,0]=4 6474 B8R0.24 NC[C@@H](F)CS(O)(=O)=O Amb25375836 [0,2,0,0,0,0|2,0,0]=4 6475 B8R0.24 NC[C@@H](O)CP(O)(O)=O Amb24443084 [0,2,0,0,0,0|2,0,0]=4 6476 B8R0.24 NNC(=O)CC(C)(C)C Amb1130902 [0,2,0,0,0,0|1,0,0]=3 6477 B8R0.24 NNC(=O)OC(C)(C)C Amb1806827 [0,2,0,0,0,0|2,0,0]=4 6478 B8R0.24 N[C@@H](CS(O)(=O)=O)CO Amb25083500 [0,2,0,0,0,0|2,0,0]=4 6479 B8R0.24 O=CC(CC(C)(C)C)C Amb17593351 [0,2,0,0,0,0|1,0,1]=4 6480 B8R0.24 OC(CBr)CS(O)(=O)=O Amb25383408 [0,2,0,0,0,0|2,0,0]=4 6481 B8R0.24 OC(CCl)CS(O)(=O)=O Amb22338699 [0,2,0,0,0,0|2,0,0]=4 6482 B8R0.24 OC(CCl)CS(O)(=O)=O Amb24061946 [0,2,0,0,0,0|2,0,0]=4 6483 B8R0.24 OCC(=O)CC(F)(F)F Amb25347114 [0,2,0,0,0,0|2,0,0]=4 6484 B8R0.24 OCC(O)CS(O)(=O)=O Amb25802047 [0,2,0,0,0,0|2,0,0]=4 6485 B8R0.24 O[C@H](CCl)CS(O)(=O)=O Amb25322010 [0,2,0,0,0,0|2,0,0]=4 6486 B8R0.24 SCC(CS(=O)(=O)O)O Amb17594311 [0,2,0,0,0,0|2,0,0]=4 6487 B8R0.34 C#CC(NC(=O)C)(C)C Amb1058733 [0,2,0,0,0,0|2,0,0]=4 6488 B8R0.34 CC(=C)CC(C)(C)C#N Amb24417308 [0,2,0,0,0,0|2,0,0]=4 6489 B8R0.34 CC(=C)CC(C)(C)CCl Amb25727696 [0,2,0,0,0,0|2,0,0]=4 6490 B8R0.34 CC(=C)CC(C)(C)CN Amb25146071 [0,2,0,0,0,0|2,0,0]=4 6491 B8R0.34 CC(=C)CC(C)(O)CCl Amb25709597 [0,2,0,0,0,0|2,0,0]=4 6492 B8R0.34 CC(=O)CC(C)(C)C#N Amb18642299 [0,2,0,0,0,0|1,0,0]=3 6493 B8R0.34 CC(=O)CC(C)(C)C=O Amb18642640 [0,2,0,0,0,0|1,0,0]=3 6494 B8R0.34 CC(=O)CC(C)(C)CO Amb24689736 [0,2,0,0,0,0|1,0,0]=3 6495 B8R0.34 CC(=O)CC(C)(C)NO Amb24736823 [0,2,0,0,0,0|1,0,0]=3 6496 B8R0.34 CC(=O)CC(C)(C)ON Amb24707795 [0,2,0,0,0,0|1,0,0]=3 6497 B8R0.34 CC(=O)CC(C)(C)OO Amb24079585 [0,2,0,0,0,0|1,0,0]=3 6498 B8R0.34 CC(=O)CC(C)(O)C#N Amb24349635 [0,2,0,0,0,0|1,0,1]=4 6499 B8R0.34 CC(=O)NC(C)(C)C=C Amb24401550 [0,2,0,0,0,0|2,0,0]=4 6500 B8R0.34 CC(=O)NC(C)(C)CF Amb25711849 [0,2,0,0,0,0|2,0,0]=4 6501 B8R0.34 CC(=O)OC(C)(C)C=O Amb18642744 [0,2,0,0,0,0|2,0,0]=4 6502 B8R0.34 CC(=O)OC(C)(C)CBr Amb24710435 [0,2,0,0,0,0|2,0,0]=4 6503 B8R0.34 CC(C)(C#N)NC(N)=O Amb25785794 [0,2,0,0,0,0|2,0,0]=4 6504 B8R0.34 CC(C)(CBr)CC(O)=O Amb24480039 [0,2,0,0,0,0|0,0,0]=2 6505 B8R0.34 CC(C)(CBr)NC(N)=O Amb24340306 [0,2,0,0,0,0|2,0,0]=4 6506 B8R0.34 CC(C)(CBr)OC(=O)Cl Amb24480342 [0,2,0,0,0,0|2,0,0]=4 6507 B8R0.34 CC(C)(CBr)OC(N)=O Amb24479975 [0,2,0,0,0,0|2,0,0]=4 6508 B8R0.34 CC(C)(CC(=C)Cl)C=O Amb25668263 [0,2,0,0,0,0|2,0,0]=4 6509 B8R0.34 CC(C)(CC(=O)Cl)C#N Amb24340082 [0,2,0,0,0,0|1,0,0]=3 6510 B8R0.34 CC(C)(CC(N)=O)C#N Amb18642438 [0,2,0,0,0,0|1,0,0]=3 6511 B8R0.34 CC(C)(CC(N)=O)C=C Amb25680144 [0,2,0,0,0,0|1,0,0]=3 6512 B8R0.34 CC(C)(CC(O)=O)C#C Amb24554543 [0,2,0,0,0,0|0,0,0]=2 6513 B8R0.34 CC(C)(CC(O)=O)CO Amb24116870 [0,2,0,0,0,0|0,0,0]=2 6514 B8R0.34 CC(C)(CC(O)=O)NN Amb24670787 [0,2,0,0,0,0|0,0,0]=2 6515 B8R0.34 CC(C)(CCl)NC(N)=O Amb24376096 [0,2,0,0,0,0|2,0,0]=4 6516 B8R0.34 CC(C)(CF)NC(N)=O Amb25099252 [0,2,0,0,0,0|2,0,0]=4 6517 B8R0.34 CC(C)(CN)CC(=C)Cl Amb25705163 [0,2,0,0,0,0|2,0,0]=4 6518 B8R0.34 CC(C)(CN)NC(N)=O Amb18203177 [0,2,0,0,0,0|2,0,0]=4 6519 B8R0.34 CC(C)(CO)CC(N)=O Amb25063938 [0,2,0,0,0,0|1,0,0]=3 6520 B8R0.34 CC(C)(CO)CC([O-])=O Amb24178915 [0,2,0,0,0,0|0,0,1]=3 6521 B8R0.34 CC(C)(C[N+]([O-])=O)C#N Amb24055701 [0,2,0,0,0,0|1,0,1]=4 6522 B8R0.34 CC(C)CC(C)(Br)C=O Amb24443844 [0,2,0,0,0,0|1,0,1]=4 6523 B8R0.34 CC(C)CC(C)(C)C=O Amb18642681 [0,2,0,0,0,0|1,0,1]=4 6524 B8R0.34 CC(C)CC(C)(N)CO Amb18971963 [0,2,0,0,0,0|1,0,1]=4 6525 B8R0.34 CC(C)CC(C)(O)C=O Amb25237274 [0,2,0,0,0,0|0,0,1]=3 6526 B8R0.34 CC(C)CC(C)(O)CCl Amb24545411 [0,2,0,0,0,0|1,0,1]=4 6527 B8R0.34 CC(C)CC(C)(O)CO Amb25064388 [0,2,0,0,0,0|0,0,2]=4 6528 B8R0.34 CC(C)CS(=O)(=O)CCl Amb24340028 [0,2,0,0,0,0|1,0,1]=4 6529 B8R0.34 CC(C)CS(=O)(=O)NO Amb24718372 [0,2,0,0,0,0|1,0,0]=3 6530 B8R0.34 CC(C)C[C@](C)(O)C#N Amb24477836 [0,2,0,0,0,0|1,0,1]=4 6531 B8R0.34 CC(C)OP(C)(=O)CO Amb25792339 [0,2,0,0,0,0|2,0,0]=4 6532 B8R0.34 CC(C)OP(O)(=O)CCl Amb25032278 [0,2,0,0,0,0|2,0,0]=4 6533 B8R0.34 CC(CC(C#C)(O)C)C Amb1058764 [0,2,0,0,0,0|1,0,1]=4 6534 B8R0.34 CC(F)(CN)CC(O)=O Amb24481603 [0,2,0,0,0,0|0,0,0]=2 6535 B8R0.34 CC(N)(CC(O)=O)C=C Amb22641965 [0,2,0,0,0,0|0,0,1]=3 6536 B8R0.34 CC(N)(CCl)CC(O)=O Amb22641961 [0,2,0,0,0,0|0,0,0]=2 6537 B8R0.34 CC(O)(CC(O)=O)C=C Amb18642755 [0,2,0,0,0,0|0,0,1]=3 6538 B8R0.34 CC(O)(CN)CC(O)=O Amb25188898 [0,2,0,0,0,0|0,0,0]=2 6539 B8R0.34 CC(O)CC(C)(C)C#N Amb18642539 [0,2,0,0,0,0|1,0,1]=4 6540 B8R0.34 CC(O)CC(C)(C)CN Amb19148071 [0,2,0,0,0,0|1,0,1]=4 6541 B8R0.34 CC(O)CC(C)(C)CN Amb22059606 [0,2,0,0,0,0|1,0,1]=4 6542 B8R0.34 CC(O)CC(C)(C)CO Amb25145315 [0,2,0,0,0,0|1,0,1]=4 6543 B8R0.34 CC(O)CC(C)(O)CO Amb25306407 [0,2,0,0,0,0|1,0,1]=4 6544 B8R0.34 CCC(C)(C)CC(=O)Cl Amb25032181 [0,2,0,0,0,0|1,0,0]=3 6545 B8R0.34 CCC(C)(C)CC(C)=C Amb22228307 [0,2,0,0,0,0|2,0,0]=4 6546 B8R0.34 CCC(C)(C)CC(C)=O Amb22388941 [0,2,0,0,0,0|1,0,0]=3 6547 B8R0.34 CCC(C)(C)C[N+]([O-])=O Amb24469650 [0,2,0,0,0,0|1,0,1]=4 6548 B8R0.34 CCC(C)(Cl)CC(O)=O Amb18644450 [0,2,0,0,0,0|0,0,0]=2 6549 B8R0.34 CCC(C)(N)CC(O)=O Amb25853863 [0,2,0,0,0,0|0,0,0]=2 6550 B8R0.34 CCC(C)(O)CC(N)=S Amb25189007 [0,2,0,0,0,0|1,1,0]=4 6551 B8R0.34 CCC(C)(O)CC(O)=O Amb18298122 [0,2,0,0,0,0|0,0,0]=2 6552 B8R0.34 CCC(C)(O)C[N+]([O-])=O Amb25270235 [0,2,0,0,0,0|1,0,1]=4 6553 B8R0.34 CCC(CC(=O)O)(C)C Amb10573669 [0,2,0,0,0,0|0,0,0]=2 6554 B8R0.34 CCC(NC(=O)N)(C)C Amb1139044 [0,2,0,0,0,0|2,0,0]=4 6555 B8R0.34 CCP(O)(=O)CC(O)=O Amb24480209 [0,2,0,0,0,0|2,0,0]=4 6556 B8R0.34 CC[C@@](C)(N)CC(O)=O Amb25738026 [0,2,0,0,0,0|0,0,0]=2 6557 B8R0.34 CC[C@@](C)(O)CC(O)=O Amb25697894 [0,2,0,0,0,0|0,0,0]=2 6558 B8R0.34 CC[C@](C)(O)CC(O)=O Amb24746144 [0,2,0,0,0,0|0,0,0]=2 6559 B8R0.34 CC[N+](C)(C)CC(O)=O Amb24390383 [0,2,0,0,0,0|1,0,0]=3 6560 B8R0.34 CN(C)CP(O)(=O)CO Amb25769359 [0,2,0,0,0,0|2,0,0]=4 6561 B8R0.34 CNC(C)(C)CC(O)=O Amb25710043 [0,2,0,0,0,0|0,0,0]=2 6562 B8R0.34 COC(C)(C)CC(N)=O Amb24473153 [0,2,0,0,0,0|1,0,0]=3 6563 B8R0.34 COP(O)(=O)CC(O)=O Amb24732061 [0,2,0,0,0,0|2,0,0]=4 6564 B8R0.34 CSC(C)(C)CC(O)=O Amb25304571 [0,2,0,0,0,0|0,0,0]=2 6565 B8R0.34 CSC(CC(=O)C)(C)C Amb16236855 [0,2,0,0,0,0|1,0,0]=3 6566 B8R0.34 C[C@@H](O)C[C@](C)(O)CO Amb25356228 [0,2,0,0,0,0|1,0,1]=4 6567 B8R0.34 C[C@@](N)(CC(O)=O)CO Amb25715205 [0,2,0,0,0,0|0,0,0]=2 6568 B8R0.34 C[C@@](O)(CN)CC(O)=O Amb24745092 [0,2,0,0,0,0|0,0,0]=2 6569 B8R0.34 C[Si](C)(CCl)CC(O)=O Amb25107199 [0,2,0,0,0,0|0,1,0]=3 6570 B8R0.34 NCC(F)(F)CC(O)=O Amb19148532 [0,2,0,0,0,0|1,0,0]=3 6571 B8R0.34 O=CC(CC(=C)C)(C)C Amb17593324 [0,2,0,0,0,0|2,0,0]=4 6572 B8R0.34 O=NC(CC(=O)C)(C)C Amb17593358 [0,2,0,0,0,0|1,0,0]=3 6573 B8R0.34 OC(=O)CS(=O)(=O)CF Amb24707946 [0,2,0,0,0,0|2,0,0]=4 6574 B8R0.34 OCC(OC(=O)C)(C)C Amb17607378 [0,2,0,0,0,0|2,0,0]=4 6575 B8R0.27 BrC(C(Br)(C)C)C(=O)O Amb16192461 [0,2,0,0,0,0|0,0,0]=2 6576 B8R0.27 BrC(C(F)(C)C)C(=O)O Amb10605635 [0,2,0,0,0,0|0,0,0]=2 6577 B8R0.27 C([2H])(C(=O)C(=O)[O-])(C)C Amb17616354 [0,2,0,0,0,0|0,0,2]=4 6578 B8R0.27 C([2H])(C(=O)C(=O)[O-])(C)[13CH3] Amb17616355 [0,2,0,0,0,0|0,0,2]=4 6579 B8R0.27 CC(=C)C(Br)C(C)(C)C Amb24571686 [0,2,0,0,0,0|2,0,0]=4 6580 B8R0.27 CC(=C)C(Cl)C(C)(C)O Amb25279514 [0,2,0,0,0,0|2,0,0]=4 6581 B8R0.27 CC(=C)C(F)C(C)(C)N Amb24643512 [0,2,0,0,0,0|2,0,0]=4 6582 B8R0.27 CC(=C)C(N)C(C)(C)C Amb24426765 [0,2,0,0,0,0|2,0,0]=4 6583 B8R0.27 CC(=C)C(O)C(C)(C)C Amb25709899 [0,2,0,0,0,0|2,0,0]=4 6584 B8R0.27 CC(=C)C(O)C(C)(C)O Amb24626174 [0,2,0,0,0,0|2,0,0]=4 6585 B8R0.27 CC(=O)C(=O)C(C)(C)C Amb24350511 [0,2,0,0,0,0|1,0,1]=4 6586 B8R0.27 CC(=O)C(=O)C(C)(C)Cl Amb24408526 [0,2,0,0,0,0|1,0,1]=4 6587 B8R0.27 CC(=O)C(=O)C(C)(C)N Amb25061645 [0,2,0,0,0,0|1,0,1]=4 6588 B8R0.27 CC(=O)C(Br)C(C)(C)C Amb25761464 [0,2,0,0,0,0|1,0,0]=3 6589 B8R0.27 CC(=O)C(Br)C(C)(C)N Amb25111132 [0,2,0,0,0,0|1,0,0]=3 6590 B8R0.27 CC(=O)C(C(O)(C)C)O Amb17593385 [0,2,0,0,0,0|1,0,0]=3 6591 B8R0.27 CC(=O)C(Cl)C(C)(C)Br Amb25055869 [0,2,0,0,0,0|1,0,0]=3 6592 B8R0.27 CC(=O)C(Cl)C(C)(C)C Amb24480250 [0,2,0,0,0,0|1,0,0]=3 6593 B8R0.27 CC(=O)C(F)C(C)(C)C Amb25143423 [0,2,0,0,0,0|1,0,0]=3 6594 B8R0.27 CC(=O)C(O)C(C)(C)Br Amb25045781 [0,2,0,0,0,0|1,0,0]=3 6595 B8R0.27 CC(=O)C(O)C(C)(C)Cl Amb24332989 [0,2,0,0,0,0|1,0,0]=3 6596 B8R0.27 CC(=O)C(O)[Si](C)(C)C Amb25129024 [0,2,0,0,0,0|1,1,0]=4 6597 B8R0.27 CC(=O)C(S)C(C)(C)O Amb24747561 [0,2,0,0,0,0|1,0,0]=3 6598 B8R0.27 CC(=O)[C@@H](N)C(C)(C)C Amb24477755 [0,2,0,0,0,0|1,0,0]=3 6599 B8R0.27 CC(=O)[C@H](O)C(C)(C)C Amb25759285 [0,2,0,0,0,0|1,0,0]=3 6600 B8R0.27 CC(C(C(C)(C)C)Br)O Amb17595129 [0,2,0,0,0,0|1,0,1]=4 6601 B8R0.27 CC(C(C)=O)C(C)(C)C Amb24756707 [0,2,0,0,0,0|1,0,0]=3 6602 B8R0.27 CC(C(C)=O)C(C)(C)F Amb25064500 [0,2,0,0,0,0|1,0,0]=3 6603 B8R0.27 CC(C(C)=O)C(C)(Cl)Cl Amb25086317 [0,2,0,0,0,0|2,0,0]=4 6604 B8R0.27 CC(C(C)Cl)S(O)(=O)=O Amb25241342 [0,2,0,0,0,0|2,0,0]=4 6605 B8R0.27 CC(C(C)N)S(O)(=O)=O Amb24355309 [0,2,0,0,0,0|2,0,0]=4 6606 B8R0.27 CC(C(F)(C)C)C(=O)O Amb10843986 [0,2,0,0,0,0|0,0,0]=2 6607 B8R0.27 CC(C(N)=N)C(C)(C)C Amb24470775 [0,2,0,0,0,0|2,0,0]=4 6608 B8R0.27 CC(C(N)=O)C(C)(F)F Amb25084678 [0,2,0,0,0,0|2,0,0]=4 6609 B8R0.27 CC(C(O)=O)C(C)(C)N Amb24459511 [0,2,0,0,0,0|0,0,0]=2 6610 B8R0.27 CC(C(O)=O)C(F)(F)F Amb19148979 [0,2,0,0,0,0|2,0,0]=4 6611 B8R0.27 CC(C(O)=O)[N+](C)(C)C Amb24759071 [0,2,0,0,0,0|1,0,0]=3 6612 B8R0.27 CC(C(O)=O)[N+](C)(C)N Amb25306005 [0,2,0,0,0,0|1,0,0]=3 6613 B8R0.27 CC(C)(Br)C(=O)C(O)=O Amb24433030 [0,2,0,0,0,0|0,0,1]=3 6614 B8R0.27 CC(C)(C)C(=C)C(N)=O Amb25738349 [0,2,0,0,0,0|1,0,1]=4 6615 B8R0.27 CC(C)(C)C(=C)C(O)=O Amb18642653 [0,2,0,0,0,0|0,0,1]=3 6616 B8R0.27 CC(C)(C)C(Br)C(O)=O Amb18127181 [0,2,0,0,0,0|0,0,0]=2 6617 B8R0.27 CC(C)(C)C(Cl)C(O)=O Amb18125093 [0,2,0,0,0,0|0,0,0]=2 6618 B8R0.27 CC(C)(C)C(F)C(=O)Cl Amb24425221 [0,2,0,0,0,0|1,0,0]=3 6619 B8R0.27 CC(C)(C)C(N)C(=O)Cl Amb24548277 [0,2,0,0,0,0|1,0,0]=3 6620 B8R0.27 CC(C)(C)C(N)C(N)=O Amb18281879 [0,2,0,0,0,0|1,0,0]=3 6621 B8R0.27 CC(C)(C)C(N)C(N)=O Amb19373321 [0,2,0,0,0,0|1,0,0]=3 6622 B8R0.27 CC(C)(C)C(O)C(O)=O Amb19299856 [0,2,0,0,0,0|0,0,0]=2 6623 B8R0.27 CC(C)(C)N(Cl)C(N)=O Amb25108563 [0,2,0,0,0,0|2,0,0]=4 6624 B8R0.27 CC(C)(C)[C@@H](Br)C(=O)Cl Amb24444825 [0,2,0,0,0,0|1,0,0]=3 6625 B8R0.27 CC(C)(C)[C@@H](Br)C(O)=O Amb22746895 [0,2,0,0,0,0|0,0,0]=2 6626 B8R0.27 CC(C)(C)[C@@H](N)C(=O)Cl Amb24611035 [0,2,0,0,0,0|1,0,0]=3 6627 B8R0.27 CC(C)(C)[C@@H](N)C(N)=O Amb22754654 [0,2,0,0,0,0|1,0,0]=3 6628 B8R0.27 CC(C)(C)[C@@H](N)C(N)=O Amb22899171 [0,2,0,0,0,0|1,0,0]=3 6629 B8R0.27 CC(C)(C)[C@@H](N)C(O)=O Amb22744938 [0,2,0,0,0,0|0,0,0]=2 6630 B8R0.27 CC(C)(C)[C@@H](O)C(O)=O Amb22225174 [0,2,0,0,0,0|0,0,0]=2 6631 B8R0.27 CC(C)(C)[C@H](Br)C(O)=O Amb22226488 [0,2,0,0,0,0|0,0,0]=2 6632 B8R0.27 CC(C)(C)[C@H](Cl)C(=O)Cl Amb25109864 [0,2,0,0,0,0|1,0,0]=3 6633 B8R0.27 CC(C)(C)[C@H](N)C(=O)Cl Amb24630153 [0,2,0,0,0,0|1,0,0]=3 6634 B8R0.27 CC(C)(C)[C@H](N)C(N)=O Amb24271101 [0,2,0,0,0,0|1,0,0]=3 6635 B8R0.27 CC(C)(C)[C@H](N)C(N)=O Amb25215486 [0,2,0,0,0,0|1,0,0]=3 6636 B8R0.27 CC(C)(Cl)C(Cl)C(O)=O Amb18126746 [0,2,0,0,0,0|0,0,0]=2 6637 B8R0.27 CC(C)(Cl)C(N)C(O)=O Amb25032131 [0,2,0,0,0,0|0,0,0]=2 6638 B8R0.27 CC(C)(Cl)[C@H](N)C(N)=O Amb25777000 [0,2,0,0,0,0|1,0,0]=3 6639 B8R0.27 CC(C)(F)C(=O)C(O)=O Amb25079631 [0,2,0,0,0,0|0,0,1]=3 6640 B8R0.27 CC(C)(F)[C@H](N)C(O)=O Amb24369670 [0,2,0,0,0,0|0,0,0]=2 6641 B8R0.27 CC(C)(N)C(N)C(O)=O Amb18642889 [0,2,0,0,0,0|0,0,0]=2 6642 B8R0.27 CC(C)(N)C(O)C(N)=O Amb25180844 [0,2,0,0,0,0|1,0,0]=3 6643 B8R0.27 CC(C)(N)C(O)C(O)=O Amb25075483 [0,2,0,0,0,0|0,0,0]=2 6644 B8R0.27 CC(C)(N)C(S)C(O)=O Amb24436486 [0,2,0,0,0,0|0,0,0]=2 6645 B8R0.27 CC(C)(O)C(=C)C(N)=O Amb24477733 [0,2,0,0,0,0|1,0,1]=4 6646 B8R0.27 CC(C)(O)C(=O)C(O)=O Amb25064348 [0,2,0,0,0,0|0,0,1]=3 6647 B8R0.27 CC(C)(O)C(Cl)C(O)=O Amb25101058 [0,2,0,0,0,0|0,0,0]=2 6648 B8R0.27 CC(C)(O)C(N)C(O)=O Amb18642914 [0,2,0,0,0,0|0,0,0]=2 6649 B8R0.27 CC(C)(O)C(O)C(N)=O Amb25732960 [0,2,0,0,0,0|1,0,0]=3 6650 B8R0.27 CC(C)(O)C(O)C(O)=O Amb25118477 [0,2,0,0,0,0|0,0,0]=2 6651 B8R0.27 CC(C)(O)[C@@H](O)C(=C)Br Amb25115452 [0,2,0,0,0,0|2,0,0]=4 6652 B8R0.27 CC(C)(S)C(=O)C(O)=O Amb24640907 [0,2,0,0,0,0|0,0,1]=3 6653 B8R0.27 CC(C)(S)C(N)C(N)=S Amb25690178 [0,2,0,0,0,0|1,1,0]=4 6654 B8R0.27 CC(C)C(C)S(=O)(=O)Cl Amb18185671 [0,2,0,0,0,0|1,0,1]=4 6655 B8R0.27 CC(C)C(C)S(C)(=O)=O Amb25333215 [0,2,0,0,0,0|1,0,1]=4 6656 B8R0.27 CC(C)C(C)S(N)(=O)=O Amb18180205 [0,2,0,0,0,0|1,0,1]=4 6657 B8R0.27 CC(C)C(F)S(=O)(=O)Cl Amb24663382 [0,2,0,0,0,0|1,0,1]=4 6658 B8R0.27 CC(C)C(N)C(C)(C)O Amb18642849 [0,2,0,0,0,0|1,0,1]=4 6659 B8R0.27 CC(C)C(N)P(C)(O)=O Amb25784649 [0,2,0,0,0,0|1,0,0]=3 6660 B8R0.27 CC(C)C(N)P(O)(O)=S Amb24443105 [0,2,0,0,0,0|1,0,1]=4 6661 B8R0.27 CC(C)C(O)S([O-])(=O)=O Amb25230616 [0,2,0,0,0,0|1,0,1]=4 6662 B8R0.27 CC(C)[C@@H](N)C(C)(C)O Amb24579778 [0,2,0,0,0,0|1,0,1]=4 6663 B8R0.27 CC(C)[C@H](O)P(O)(O)=O Amb25681151 [0,2,0,0,0,0|1,0,0]=3 6664 B8R0.27 CC(Cl)(Cl)C(Cl)C(O)=O Amb25032276 [0,2,0,0,0,0|1,0,0]=3 6665 B8R0.27 CC(Cl)C(O)P(O)(O)=O Amb25227137 [0,2,0,0,0,0|2,0,0]=4 6666 B8R0.27 CC(F)(F)C(Cl)C(O)=O Amb24373113 [0,2,0,0,0,0|1,0,0]=3 6667 B8R0.27 CC(F)(F)[C@@H](N)C(O)=O Amb24618136 [0,2,0,0,0,0|1,0,0]=3 6668 B8R0.27 CC(F)(F)[C@H](N)C(O)=O Amb24641014 [0,2,0,0,0,0|1,0,0]=3 6669 B8R0.27 CC(N)C(O)S(O)(=O)=O Amb24717762 [0,2,0,0,0,0|2,0,0]=4 6670 B8R0.27 CC(O)C(C)C(C)(C)O Amb24340511 [0,2,0,0,0,0|1,0,1]=4 6671 B8R0.27 CC(O)C(Cl)C(C)(C)O Amb24355303 [0,2,0,0,0,0|1,0,1]=4 6672 B8R0.27 CC(O)C(N)C(C)(C)C Amb25142025 [0,2,0,0,0,0|1,0,1]=4 6673 B8R0.27 CC(O)C(N)P(O)(O)=O Amb24524174 [0,2,0,0,0,0|2,0,0]=4 6674 B8R0.27 CC(O)C(O)C(C)(C)N Amb24436425 [0,2,0,0,0,0|1,0,1]=4 6675 B8R0.27 CC(O)C(O)C(C)(C)O Amb24448053 [0,2,0,0,0,0|1,0,1]=4 6676 B8R0.27 CC(O)C(O)P(O)(O)=O Amb25235589 [0,2,0,0,0,0|2,0,0]=4 6677 B8R0.27 CC(O)[C@@H](N)C(C)(C)C Amb24524203 [0,2,0,0,0,0|1,0,1]=4 6678 B8R0.27 CC(O)[C@H](N)C(C)(C)C Amb24384099 [0,2,0,0,0,0|1,0,1]=4 6679 B8R0.27 CN(C(=O)Cl)C(C)(C)C Amb24625528 [0,2,0,0,0,0|2,0,0]=4 6680 B8R0.27 CN(C([O-])=O)C(C)(C)C Amb21927802 [0,2,0,0,0,0|1,0,1]=4 6681 B8R0.27 CP(C)(=O)C(O)C(N)=O Amb25351608 [0,2,0,0,0,0|2,0,0]=4 6682 B8R0.27 CP(C)(=O)C(O)C(O)=O Amb22231894 [0,2,0,0,0,0|1,0,0]=3 6683 B8R0.27 CS(=O)(=O)C(F)C(O)=O Amb25242777 [0,2,0,0,0,0|2,0,0]=4 6684 B8R0.27 C[C@@H](C(C)(C)C)C(=O)O Amb10844034 [0,2,0,0,0,0|0,0,0]=2 6685 B8R0.27 C[C@@H](C(N)=O)C(C)(C)C Amb24553257 [0,2,0,0,0,0|1,0,0]=3 6686 B8R0.27 C[C@@H](C(O)=O)C(F)(F)F Amb24120617 [0,2,0,0,0,0|2,0,0]=4 6687 B8R0.27 C[C@@H](N)[C@H](O)P(O)(O)=O Amb24390259 [0,2,0,0,0,0|2,0,0]=4 6688 B8R0.27 C[C@@H](O)[C@@H](Br)C(C)(C)C Amb25858093 [0,2,0,0,0,0|1,0,1]=4 6689 B8R0.27 C[C@@H](O)[C@@H](N)C(C)(C)C Amb25698375 [0,2,0,0,0,0|1,0,1]=4 6690 B8R0.27 C[C@@H](O)[C@@H](O)P(O)(O)=O Amb25226258 [0,2,0,0,0,0|2,0,0]=4 6691 B8R0.27 C[C@@H](O)[C@H](N)P(O)(O)=O Amb24391488 [0,2,0,0,0,0|2,0,0]=4 6692 B8R0.27 C[C@@H](O)[C@H](O)P(O)(O)=O Amb25219228 [0,2,0,0,0,0|2,0,0]=4 6693 B8R0.27 C[C@H](C(C)(C)C)C(=O)O Amb10844023 [0,2,0,0,0,0|0,0,0]=2 6694 B8R0.27 C[C@H](C(C)=O)C(C)(C)C Amb25060195 [0,2,0,0,0,0|1,0,0]=3 6695 B8R0.27 C[C@H](C(O)=O)C(C)(C)Cl Amb24522973 [0,2,0,0,0,0|0,0,0]=2 6696 B8R0.27 C[C@H](C(O)=O)S(C)(=O)=O Amb24480187 [0,2,0,0,0,0|2,0,0]=4 6697 B8R0.27 C[C@H](Cl)[C@@H](O)P(O)(O)=O Amb24480009 [0,2,0,0,0,0|2,0,0]=4 6698 B8R0.27 C[C@H](N)[C@@H](O)P(O)(O)=O Amb24427545 [0,2,0,0,0,0|2,0,0]=4 6699 B8R0.27 C[C@H](O)[C@@H](Cl)C(C)(C)C Amb25363177 [0,2,0,0,0,0|1,0,1]=4 6700 B8R0.27 C[C@H](O)[C@@H](Cl)P(O)(O)=O Amb25858138 [0,2,0,0,0,0|2,0,0]=4 6701 B8R0.27 C[C@H](O)[C@@H](O)C(C)(C)O Amb25845426 [0,2,0,0,0,0|1,0,1]=4 6702 B8R0.27 C[C@H](O)[C@H](N)C(C)(C)C Amb24644721 [0,2,0,0,0,0|1,0,1]=4 6703 B8R0.27 C[C@H](O)[C@H](O)P(O)(O)=O Amb25136255 [0,2,0,0,0,0|2,0,0]=4 6704 B8R0.27 C[N+](C)(N)C(=C)C(O)=O Amb25835264 [0,2,0,0,0,0|1,0,1]=4 6705 B8R0.27 C[Si](C)(C)C(O)C(O)=O Amb25063843 [0,2,0,0,0,0|0,1,0]=3 6706 B8R0.27 Cl[C@H](C(C)(C)C)C(=O)O Amb10069805 [0,2,0,0,0,0|0,0,0]=2 6707 B8R0.27 NC(C(C)(C)C)C(=O)O Amb2371663 [0,2,0,0,0,0|0,0,0]=2 6708 B8R0.27 NC(C(F)(F)F)C(=O)O Amb10607071 [0,2,0,0,0,0|2,0,0]=4 6709 B8R0.27 NC(C(O)=O)C(Cl)(Cl)Cl Amb24480186 [0,2,0,0,0,0|2,0,0]=4 6710 B8R0.27 NC(C(S)(C)C)C(=O)O Amb1907179 [0,2,0,0,0,0|0,0,0]=2 6711 B8R0.27 N[C@@H](C(C)(C)C)C(=O)O Amb16232019 [0,2,0,0,0,0|0,0,0]=2 6712 B8R0.27 N[C@@H](C(O)=O)C(F)(F)F Amb25378031 [0,2,0,0,0,0|2,0,0]=4 6713 B8R0.27 N[C@H](C(O)=O)C(Cl)(Cl)Cl Amb24480006 [0,2,0,0,0,0|2,0,0]=4 6714 B8R0.27 N[C@H](C(O)=O)C(F)(F)F Amb24650499 [0,2,0,0,0,0|2,0,0]=4 6715 B8R0.27 OC(=O)C(Br)C(F)(F)F Amb22274799 [0,2,0,0,0,0|2,0,0]=4 6716 B8R0.27 OC(=O)C(C(O)(C)C)Br Amb17595209 [0,2,0,0,0,0|0,0,0]=2 6717 B8R0.27 OC(=O)C(C(O)(C)C)C Amb10844263 [0,2,0,0,0,0|0,0,0]=2 6718 B8R0.27 OC(=O)[C@@H](C(O)(C)C)C Amb10844262 [0,2,0,0,0,0|0,0,0]=2 6719 B8R0.27 OC(=O)[C@H](C(O)(C)C)C Amb10844272 [0,2,0,0,0,0|0,0,0]=2 6720 B8R0.27 OC(C(O)=O)C(Cl)(Cl)Cl Amb24467776 [0,2,0,0,0,0|2,0,0]=4 6721 B8R0.27 O[C@@H](C(C)(C)C)C(=O)O Amb10603129 [0,2,0,0,0,0|0,0,0]=2 6722 B8R0.27 O[C@@H](C(F)(F)F)C(=O)O Amb10838306 [0,2,0,0,0,0|2,0,0]=4 6723 B8R0.27 O[C@H](C(F)(F)F)C(=O)O Amb10841493 [0,2,0,0,0,0|2,0,0]=4 6724 B8R0.27 [13C]([2H])([13C](=O)[13C](=O)[O-])([13CH3])[13CH3] Amb17616356 [0,2,0,0,0,0|0,0,2]=4 6725 B8R0.27 [2H]C([13CH3])([13CH3])C(=O)C([O-])=O Amb22353620 [0,2,0,0,0,0|0,0,2]=4 6726 B8R0.27 [2H]C([2H])([2H])C(N)C(O)=O Amb22338765 [0,2,0,0,0,0|2,0,0]=4 6727 B8R0.27 [2H]C([2H])([2H])[C@@H](N)C(O)=O Amb22338907 [0,2,0,0,0,0|2,0,0]=4 6728 B8R0.27 [2H][13C]([2H])([2H])C(N)C(O)=O Amb22367222 [0,2,0,0,0,0|2,0,0]=4 6729 B8R0.33 CC(C)(C)CC(C)(C)O Amb22228308 [0,2,0,0,0,0|1,0,1]=4 6730 B8R0.33 CC(C)(C)CS(N)(=O)=O Amb18793283 [0,2,0,0,0,0|1,0,1]=4 6731 B8R0.33 CC(C)(C)NS(O)(=O)=O Amb25725549 [0,2,0,0,0,0|2,0,0]=4 6732 B8R0.33 CC(C)(F)CS(N)(=O)=O Amb25779039 [0,2,0,0,0,0|1,0,1]=4 6733 B8R0.33 CC(C)(N)CP(O)(O)=O Amb24527536 [0,2,0,0,0,0|1,0,0]=3 6734 B8R0.33 CC(C)(N)CS(O)(=O)=O Amb24738029 [0,2,0,0,0,0|1,0,0]=3 6735 B8R0.33 CC(C)(O)CC(C)(C)O Amb22228334 [0,2,0,0,0,0|1,0,1]=4 6736 B8R0.33 CC(C)(O)CS(=O)(=O)Cl Amb25057906 [0,2,0,0,0,0|1,0,1]=4 6737 B8R0.33 CC(C)(O)CS(C)(=O)=O Amb24735166 [0,2,0,0,0,0|1,0,1]=4 6738 B8R0.33 CC(CS(=O)(=O)C)(N)C Amb17485990 [0,2,0,0,0,0|1,0,1]=4 6739 B8R0.33 CC(CS(=O)(=O)Cl)(C)C Amb17505557 [0,2,0,0,0,0|1,0,1]=4 6740 B8R0.33 C[Si](C)(C)CS(O)(=O)=O Amb22411547 [0,2,0,0,0,0|1,1,0]=4 6741 B8R0.18 CC(=C)C(CC)C(O)=O Amb18642606 [0,2,0,0,0,0|0,0,2]=4 6742 B8R0.18 CC(Br)C(CC)C(O)=O Amb25351353 [0,2,0,0,0,0|1,0,0]=3 6743 B8R0.18 CC(C(C(=O)O)C#N)C Amb10066977 [0,2,0,0,0,0|0,0,0]=2 6744 B8R0.18 CC(C)=C(C=O)C(O)=O Amb25328515 [0,2,0,0,0,0|0,0,2]=4 6745 B8R0.18 CC(C)=C(CC)C(O)=O Amb18642607 [0,2,0,0,0,0|0,0,2]=4 6746 B8R0.18 CC(C)=C(OC)C(O)=O Amb18642778 [0,2,0,0,0,0|0,0,2]=4 6747 B8R0.18 CC(C)=C(ON)C(O)=O Amb24432339 [0,2,0,0,0,0|0,0,2]=4 6748 B8R0.18 CC(C)=C(SC)C(O)=O Amb24656294 [0,2,0,0,0,0|0,0,2]=4 6749 B8R0.18 CC(C)C(=C=C)C(O)=O Amb24446532 [0,2,0,0,0,0|0,0,1]=3 6750 B8R0.18 CC(C)C(=NO)C(O)=O Amb24597663 [0,2,0,0,0,0|0,0,1]=3 6751 B8R0.18 CC(C)C(C#N)C(C)=O Amb25810486 [0,2,0,0,0,0|1,0,0]=3 6752 B8R0.18 CC(C)C(C#N)C(C)O Amb25333605 [0,2,0,0,0,0|1,0,1]=4 6753 B8R0.18 CC(C)C(C=C)C(O)=O Amb18642658 [0,2,0,0,0,0|0,0,0]=2 6754 B8R0.18 CC(C)C(C=O)C(O)=O Amb25122103 [0,2,0,0,0,0|0,0,0]=2 6755 B8R0.18 CC(C)C(CBr)C(O)=O Amb24429178 [0,2,0,0,0,0|0,0,0]=2 6756 B8R0.18 CC(C)C(CC)C(N)=N Amb25190280 [0,2,0,0,0,0|2,0,0]=4 6757 B8R0.18 CC(C)C(CC)C(N)=O Amb25694336 [0,2,0,0,0,0|1,0,0]=3 6758 B8R0.18 CC(C)C(CC)C(O)=O Amb18972345 [0,2,0,0,0,0|0,0,0]=2 6759 B8R0.18 CC(C)C(CN)B(O)O Amb22831545 [0,2,0,0,0,0|1,0,1]=4 6760 B8R0.18 CC(C)C(CN)C(N)=O Amb18294193 [0,2,0,0,0,0|1,0,0]=3 6761 B8R0.18 CC(C)C(CN)C(O)=O Amb18987935 [0,2,0,0,0,0|0,0,0]=2 6762 B8R0.18 CC(C)C(CN)C(O)=O Amb19375052 [0,2,0,0,0,0|0,0,0]=2 6763 B8R0.18 CC(C)C(CO)C(C)=O Amb24370150 [0,2,0,0,0,0|1,0,0]=3 6764 B8R0.18 CC(C)C(CO)C(O)=O Amb24116921 [0,2,0,0,0,0|0,0,0]=2 6765 B8R0.18 CC(C)C(N=O)C(O)=O Amb25292210 [0,2,0,0,0,0|0,0,0]=2 6766 B8R0.18 CC(C)C(NBr)C(O)=O Amb24648440 [0,2,0,0,0,0|0,0,0]=2 6767 B8R0.18 CC(C)C(NC)C(=O)Cl Amb25139558 [0,2,0,0,0,0|1,0,0]=3 6768 B8R0.18 CC(C)C(NC)C(C)O Amb24763226 [0,2,0,0,0,0|1,0,1]=4 6769 B8R0.18 CC(C)C(NC)C(N)=O Amb18975189 [0,2,0,0,0,0|1,0,0]=3 6770 B8R0.18 CC(C)C(NC)C(O)=O Amb21961623 [0,2,0,0,0,0|0,0,0]=2 6771 B8R0.18 CC(C)C(NCl)C(O)=O Amb24480122 [0,2,0,0,0,0|0,0,0]=2 6772 B8R0.18 CC(C)C(NN)C(C)=C Amb25353119 [0,2,0,0,0,0|2,0,0]=4 6773 B8R0.18 CC(C)C(NN)C(O)=O Amb18642886 [0,2,0,0,0,0|0,0,0]=2 6774 B8R0.18 CC(C)C(OC)C(C)=O Amb24371549 [0,2,0,0,0,0|1,0,0]=3 6775 B8R0.18 CC(C)C(ON)C(O)=O Amb24477865 [0,2,0,0,0,0|0,0,0]=2 6776 B8R0.18 CC(C)C(SC)C(C)=O Amb24422371 [0,2,0,0,0,0|1,0,0]=3 6777 B8R0.18 CC(C)C(SC)C(N)=O Amb24476747 [0,2,0,0,0,0|1,0,0]=3 6778 B8R0.18 CC(C)N(CCl)C(C)=O Amb24597375 [0,2,0,0,0,0|2,0,0]=4 6779 B8R0.18 CC(C)N(CO)C(C)=O Amb24412961 [0,2,0,0,0,0|2,0,0]=4 6780 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756745 [0,2,0,0,0,0|0,0,0]=2 6781 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756747 [0,2,0,0,0,0|0,0,0]=2 6782 B8R0.18 CC(C)[C@@H](CO)C(O)=O Amb24588987 [0,2,0,0,0,0|0,0,0]=2 6783 B8R0.18 CC(C)[C@@H](CO)[C@@H](C)O Amb25070653 [0,2,0,0,0,0|1,0,1]=4 6784 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22231334 [0,2,0,0,0,0|0,0,0]=2 6785 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22749002 [0,2,0,0,0,0|0,0,0]=2 6786 B8R0.18 CC(C)[C@@H](ON)C(O)=O Amb24117143 [0,2,0,0,0,0|0,0,0]=2 6787 B8R0.18 CC(C)[C@H](CC)C(C)=O Amb25064658 [0,2,0,0,0,0|1,0,0]=3 6788 B8R0.18 CC(C)[C@H](CN)C(O)=O Amb25283442 [0,2,0,0,0,0|0,0,0]=2 6789 B8R0.18 CC(C)[C@H](NC)C(N)=O Amb24376236 [0,2,0,0,0,0|1,0,0]=3 6790 B8R0.18 CC(C)[C@H](NO)C(N)=O Amb24540370 [0,2,0,0,0,0|1,0,0]=3 6791 B8R0.18 CC(C)[C@H](ON)C(O)=O Amb25785764 [0,2,0,0,0,0|0,0,0]=2 6792 B8R0.18 CC(Cl)C(OC)C(C)=O Amb24340310 [0,2,0,0,0,0|2,0,0]=4 6793 B8R0.18 CC(Cl)C(SC)C(N)=O Amb24634079 [0,2,0,0,0,0|2,0,0]=4 6794 B8R0.18 CC(Cl)C(SC)C(O)=O Amb18126488 [0,2,0,0,0,0|1,0,0]=3 6795 B8R0.18 CC(O)C(C=C)C(O)=O Amb18642779 [0,2,0,0,0,0|1,0,0]=3 6796 B8R0.18 CC(O)C(CC)C(N)=O Amb24539570 [0,2,0,0,0,0|2,0,0]=4 6797 B8R0.18 CC(O)C(CC)C(O)=O Amb18990651 [0,2,0,0,0,0|1,0,0]=3 6798 B8R0.18 CC(O)C(CO)C(O)=O Amb24759475 [0,2,0,0,0,0|1,0,0]=3 6799 B8R0.18 CC(O)C(NC)C(O)=O Amb24680323 [0,2,0,0,0,0|1,0,0]=3 6800 B8R0.18 CC(O)C(NCl)C(O)=O Amb24408588 [0,2,0,0,0,0|1,0,0]=3 6801 B8R0.18 CC(O)C(NN)C(O)=O Amb18642940 [0,2,0,0,0,0|1,0,0]=3 6802 B8R0.18 CC(O)[C@@H](NC)C(O)=O Amb22800385 [0,2,0,0,0,0|1,0,0]=3 6803 B8R0.18 CC(O)[C@H](NCl)C(O)=O Amb25684733 [0,2,0,0,0,0|1,0,0]=3 6804 B8R0.18 CCC(C(N)=O)N(C)C Amb23560712 [0,2,0,0,0,0|2,0,0]=4 6805 B8R0.18 CCC(C(O)=O)N(C)C Amb20627822 [0,2,0,0,0,0|1,0,0]=3 6806 B8R0.18 CCC(C(O)=O)N(C)N Amb25145584 [0,2,0,0,0,0|2,0,0]=4 6807 B8R0.18 CCC(C(O)=O)N(C)O Amb24609518 [0,2,0,0,0,0|2,0,0]=4 6808 B8R0.18 CCC(C(O)=O)S(C)=O Amb18290930 [0,2,0,0,0,0|2,0,0]=4 6809 B8R0.18 CCN(C(C)C)C(=O)Cl Amb20622995 [0,2,0,0,0,0|2,0,0]=4 6810 B8R0.18 CC[C@@H](C(O)=O)N(C)C Amb25823446 [0,2,0,0,0,0|1,0,0]=3 6811 B8R0.18 CN(C)C(CF)C(O)=O Amb25216064 [0,2,0,0,0,0|1,0,0]=3 6812 B8R0.18 CN(C)C(CO)C(N)=O Amb24495258 [0,2,0,0,0,0|2,0,0]=4 6813 B8R0.18 CN(C)C(CO)C(O)=O Amb24407402 [0,2,0,0,0,0|1,0,0]=3 6814 B8R0.18 CN(C)[C@@H](CF)C(O)=O Amb24407184 [0,2,0,0,0,0|1,0,0]=3 6815 B8R0.18 CN(C)[C@@H](CO)C(N)=O Amb25114181 [0,2,0,0,0,0|2,0,0]=4 6816 B8R0.18 CN(C)[C@@H](CS)C(O)=O Amb24120376 [0,2,0,0,0,0|1,0,0]=3 6817 B8R0.18 CN(C)[C@H](CS)C(O)=O Amb24405547 [0,2,0,0,0,0|1,0,0]=3 6818 B8R0.18 CN(O)C(C=C)C(O)=O Amb25302099 [0,2,0,0,0,0|2,0,0]=4 6819 B8R0.18 CNC(C(=O)C)C(C)C Amb2369975 [0,2,0,0,0,0|1,0,0]=3 6820 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb16183861 [0,2,0,0,0,0|0,0,0]=2 6821 B8R0.18 CSC(C(=O)O)C(C)C Amb17503902 [0,2,0,0,0,0|0,0,0]=2 6822 B8R0.18 C[C@@H](N)[C@@H](CC)C(O)=O Amb24709757 [0,2,0,0,0,0|1,0,0]=3 6823 B8R0.18 C[C@@H](O)[C@@H](NC)C(O)=O Amb24375967 [0,2,0,0,0,0|1,0,0]=3 6824 B8R0.18 C[C@@H](O)[C@H](CN)C(O)=O Amb24715545 [0,2,0,0,0,0|1,0,0]=3 6825 B8R0.18 C[C@@H](O)[C@H](NCl)C(O)=O Amb25124152 [0,2,0,0,0,0|1,0,0]=3 6826 B8R0.18 C[C@H](Cl)[C@H](SC)C(=O)Cl Amb25146223 [0,2,0,0,0,0|2,0,0]=4 6827 B8R0.18 C[C@H](O)[C@H](NC)C(O)=O Amb24529115 [0,2,0,0,0,0|1,0,0]=3 6828 B8R0.18 C[C@H](O)[C@H](NN)C(O)=O Amb25032229 [0,2,0,0,0,0|1,0,0]=3 6829 B8R0.18 C\C=C(/C(C)C)\C(O)=O Amb18642659 [0,2,0,0,0,0|0,0,1]=3 6830 B8R0.18 C\C=C(/[C@@H](C)O)\C(O)=O Amb25843942 [0,2,0,0,0,0|1,0,1]=4 6831 B8R0.18 C\C=C(\C(C)C)/C(N)=O Amb24666666 [0,2,0,0,0,0|1,0,1]=4 6832 B8R0.18 OC(=O)C(CF)C(F)F Amb24743896 [0,2,0,0,0,0|2,0,0]=4 6833 B8R0.18 OC(=O)C(CO)C(F)F Amb24559548 [0,2,0,0,0,0|2,0,0]=4 6834 B8R0.18 SCC(C(=O)O)C(C)C Amb17593703 [0,2,0,0,0,0|0,0,0]=2 6835 B8R0.37 CC(=C)C(C(=O)O)(C)C Amb15701602 [0,2,0,0,0,0|0,0,2]=4 6836 B8R0.37 CC(=C)C(C)(O)C(O)=O Amb18642760 [0,2,0,0,0,0|0,0,2]=4 6837 B8R0.37 CC(=O)C(C)(C)C(O)=O Amb18642784 [0,2,0,0,0,0|1,0,1]=4 6838 B8R0.37 CC(=O)C(C)(C)N(C)C Amb25295176 [0,2,0,0,0,0|2,0,0]=4 6839 B8R0.37 CC(=O)C(C)(O)C(O)=O Amb18642870 [0,2,0,0,0,0|1,0,1]=4 6840 B8R0.37 CC(=O)C(O)(O)C(O)=O Amb24101440 [0,2,0,0,0,0|1,0,1]=4 6841 B8R0.37 CC(Br)C(C)(C)C(O)=O Amb25088460 [0,2,0,0,0,0|1,0,0]=3 6842 B8R0.37 CC(C(C(=O)C)(C)C)C Amb17593353 [0,2,0,0,0,0|1,0,0]=3 6843 B8R0.37 CC(C(C(=O)O)(C)C)C Amb17593377 [0,2,0,0,0,0|0,0,0]=2 6844 B8R0.37 CC(C(C(=S)N)(C)C)C Amb17466473 [0,2,0,0,0,0|1,1,0]=4 6845 B8R0.37 CC(C)C(C)(Br)C(O)=O Amb24652574 [0,2,0,0,0,0|0,0,0]=2 6846 B8R0.37 CC(C)C(C)(C)B(O)O Amb24477869 [0,2,0,0,0,0|1,0,1]=4 6847 B8R0.37 CC(C)C(C)(C)C(N)=O Amb24548236 [0,2,0,0,0,0|1,0,0]=3 6848 B8R0.37 CC(C)C(C)(C)S(C)=O Amb24502212 [0,2,0,0,0,0|2,0,0]=4 6849 B8R0.37 CC(C)C(C)(C)[N+]([O-])=O Amb25207438 [0,2,0,0,0,0|1,0,1]=4 6850 B8R0.37 CC(C)C(C)(F)C(O)=O Amb24518491 [0,2,0,0,0,0|0,0,0]=2 6851 B8R0.37 CC(C)C(C)(N)P(O)=O Amb24567571 [0,2,0,0,0,0|1,0,0]=3 6852 B8R0.37 CC(C)C(C)(N)P(O)O Amb25361983 [0,2,0,0,0,0|1,0,1]=4 6853 B8R0.37 CC(C)C(C)(O)C(O)=O Amb18286212 [0,2,0,0,0,0|0,0,0]=2 6854 B8R0.37 CC(C)C(C)(S)C(N)=O Amb25316845 [0,2,0,0,0,0|1,0,0]=3 6855 B8R0.37 CC(C)C(C)(S)C(O)=O Amb25064233 [0,2,0,0,0,0|0,0,0]=2 6856 B8R0.37 CC(C)C(Cl)(Cl)C(O)=O Amb25188935 [0,2,0,0,0,0|0,0,0]=2 6857 B8R0.37 CC(C)[C@@](C)(O)[C@@H](C)O Amb25206459 [0,2,0,0,0,0|1,0,1]=4 6858 B8R0.37 CC(C)[C@@](C)(S)C(N)=O Amb24460771 [0,2,0,0,0,0|1,0,0]=3 6859 B8R0.37 CC(C)[C@](C)(N)C(N)=O Amb25132092 [0,2,0,0,0,0|1,0,0]=3 6860 B8R0.37 CC(C)[C@](C)(S)C(N)=O Amb24411515 [0,2,0,0,0,0|1,0,0]=3 6861 B8R0.37 CC(Cl)C(C)(O)C(N)=O Amb25257976 [0,2,0,0,0,0|2,0,0]=4 6862 B8R0.37 CC(Cl)C(Cl)(Cl)C(=O)Cl Amb24418032 [0,2,0,0,0,0|2,0,0]=4 6863 B8R0.37 CC(Cl)C(Cl)(Cl)C(O)=O Amb22168920 [0,2,0,0,0,0|1,0,0]=3 6864 B8R0.37 CC(F)C(C)(C)C(O)=O Amb24695887 [0,2,0,0,0,0|1,0,0]=3 6865 B8R0.37 CC(F)C(C)(N)C(N)=O Amb25791580 [0,2,0,0,0,0|2,0,0]=4 6866 B8R0.37 CC(F)C(C)(N)C(O)=O Amb25844045 [0,2,0,0,0,0|1,0,0]=3 6867 B8R0.37 CC(N)C(C)(C)C(N)=O Amb24547757 [0,2,0,0,0,0|2,0,0]=4 6868 B8R0.37 CC(N)C(C)(C)C(O)=O Amb24681858 [0,2,0,0,0,0|1,0,0]=3 6869 B8R0.37 CC(N)C(F)(F)C(O)=O Amb25188946 [0,2,0,0,0,0|1,0,0]=3 6870 B8R0.37 CC(O)(C(F)F)C(O)=O Amb25842016 [0,2,0,0,0,0|2,0,0]=4 6871 B8R0.37 CC(O)C(C)(C)C(C)=O Amb25282830 [0,2,0,0,0,0|2,0,0]=4 6872 B8R0.37 CC(O)C(C)(C)C(O)=O Amb18961474 [0,2,0,0,0,0|1,0,0]=3 6873 B8R0.37 CC(O)C(C)(O)C(O)=O Amb18124401 [0,2,0,0,0,0|1,0,0]=3 6874 B8R0.37 CC([C@@](C(=O)O)(N)C)C Amb10603127 [0,2,0,0,0,0|0,0,0]=2 6875 B8R0.37 CC([C@@](C(=O)O)(O)C)C Amb16231522 [0,2,0,0,0,0|0,0,0]=2 6876 B8R0.37 CC([C@](C(=O)O)(N)C)C Amb16183901 [0,2,0,0,0,0|0,0,0]=2 6877 B8R0.37 CN(C)C(C)(C)C(N)=O Amb24122980 [0,2,0,0,0,0|2,0,0]=4 6878 B8R0.37 CN(C)C(C)(C)C(O)=O Amb20627821 [0,2,0,0,0,0|1,0,0]=3 6879 B8R0.37 CS(=O)C(C)(C)C(O)=O Amb18644428 [0,2,0,0,0,0|2,0,0]=4 6880 B8R0.37 CS(=O)C(F)(F)C(O)=O Amb23586464 [0,2,0,0,0,0|2,0,0]=4 6881 B8R0.37 C[C@@H](Cl)[C@](C)(O)C(C)=O Amb24601035 [0,2,0,0,0,0|2,0,0]=4 6882 B8R0.37 C[C@@H](Cl)[C@](C)(O)C(O)=O Amb25360920 [0,2,0,0,0,0|1,0,0]=3 6883 B8R0.37 C[C@@H](N)C(C)(C)C(N)=O Amb25239049 [0,2,0,0,0,0|2,0,0]=4 6884 B8R0.37 C[C@@H](O)C(C)(C)C(O)=O Amb24465184 [0,2,0,0,0,0|1,0,0]=3 6885 B8R0.37 C[C@@H](O)[C@@](C)(O)C(C)=O Amb25662408 [0,2,0,0,0,0|2,0,0]=4 6886 B8R0.37 C[C@@H](O)[C@@](C)(O)C(O)=O Amb25842427 [0,2,0,0,0,0|1,0,0]=3 6887 B8R0.37 C[C@@H](O)[C@](C)(O)C(C)=O Amb25767044 [0,2,0,0,0,0|2,0,0]=4 6888 B8R0.37 C[C@@](N)(C(F)F)C(O)=O Amb25329065 [0,2,0,0,0,0|2,0,0]=4 6889 B8R0.37 C[C@H](O)C(C)(C)C(C)=O Amb24725317 [0,2,0,0,0,0|2,0,0]=4 6890 B8R0.37 C[C@H](O)C(C)(C)C(O)=O Amb25114676 [0,2,0,0,0,0|1,0,0]=3 6891 B8R0.37 C[C@H](O)[C@@](C)(N)C(O)=O Amb22232016 [0,2,0,0,0,0|1,0,0]=3 6892 B8R0.37 C[C@H](O)[C@](C)(Cl)C(O)=O Amb25772784 [0,2,0,0,0,0|1,0,0]=3 6893 B8R0.37 C[C@](N)(C(F)F)C(O)=O Amb25107781 [0,2,0,0,0,0|2,0,0]=4 6894 B8R0.37 FC(C(C(=O)O)(F)F)Br Amb10839241 [0,2,0,0,0,0|2,0,0]=4 6895 B8R0.37 FC(C(C(=O)O)(F)F)Cl Amb17594051 [0,2,0,0,0,0|2,0,0]=4 6896 B8R0.37 OC(=O)C(Cl)(Cl)C(Cl)Cl Amb25377180 [0,2,0,0,0,0|2,0,0]=4 6897 B8R0.37 OC(=O)C(F)(Cl)C(Cl)Cl Amb25190584 [0,2,0,0,0,0|2,0,0]=4 6898 B8R0.37 OC(=O)C(F)(Cl)C(F)Cl Amb24444909 [0,2,0,0,0,0|2,0,0]=4 6899 B8R0.37 [2H]C(N)(C(C)C)C(O)=O Amb22367355 [0,2,0,0,0,0|0,0,0]=2 6900 B6R1.2 BrC1=CCCC1 Amb10067271 [1,0,0,1,0,0|2,0,0]=4 6901 B6R1.2 BrC1=CCCO1 Amb24322605 [1,0,0,1,0,0|1,0,1]=4 6902 B6R1.2 BrC1CC=CC1 Amb25811243 [1,0,0,1,0,0|2,0,0]=4 6903 B6R1.2 BrC1CCCO1 Amb24322808 [1,0,0,1,0,0|1,0,1]=4 6904 B6R1.2 BrC1COCC1 Amb19957943 [1,0,0,1,0,0|1,0,1]=4 6905 B6R1.2 C1C[NH2+]NC1=O Amb2408363 [1,0,0,1,0,0|2,0,0]=4 6906 B6R1.2 C=C1CCCC1 Amb22337671 [1,0,0,1,0,0|2,0,0]=4 6907 B6R1.2 C=C1OCCO1 Amb24477046 [1,0,0,1,0,0|2,0,0]=4 6908 B6R1.2 CC1=CCCO1 Amb20621083 [1,0,0,1,0,0|1,0,1]=4 6909 B6R1.2 CC1CC=CS1 Amb24383307 [1,0,0,1,0,0|2,0,0]=4 6910 B6R1.2 CC1CC=NN1 Amb1930441 [1,0,0,1,0,0|2,0,0]=4 6911 B6R1.2 CC1CC=NN1 Amb22235452 [1,0,0,1,0,0|2,0,0]=4 6912 B6R1.2 CC1CCC=C1 Amb17674168 [1,0,0,1,0,0|1,0,1]=4 6913 B6R1.2 CC1CNCC1 Amb15690616 [1,0,0,1,0,0|1,0,1]=4 6914 B6R1.2 CC1COC=C1 Amb22001724 [1,0,0,1,0,0|0,0,1]=3 6915 B6R1.2 CC1COCN1 Amb17506155 [1,0,0,1,0,0|1,0,1]=4 6916 B6R1.2 CC1CSCC1 Amb20621725 [1,0,0,1,0,0|0,1,1]=4 6917 B6R1.2 CN1COCC1 Amb25146749 [1,0,0,1,0,0|1,0,1]=4 6918 B6R1.2 C[C@@H]1CNCC1 Amb19887708 [1,0,0,1,0,0|1,0,1]=4 6919 B6R1.2 C[C@@H]1CNCC1 Amb22748675 [1,0,0,1,0,0|1,0,1]=4 6920 B6R1.2 C[C@H]1CNC=N1 Amb25063269 [1,0,0,1,0,0|2,0,0]=4 6921 B6R1.2 C[C@H]1CNCC1 Amb19888329 [1,0,0,1,0,0|1,0,1]=4 6922 B6R1.2 ClC1CCCO1 Amb24093635 [1,0,0,1,0,0|1,0,1]=4 6923 B6R1.2 ClC1COCC1 Amb20623054 [1,0,0,1,0,0|1,0,1]=4 6924 B6R1.2 ClC=1CCCC1 Amb22351980 [1,0,0,1,0,0|2,0,0]=4 6925 B6R1.2 FC1=CCCO1 Amb24322815 [1,0,0,1,0,0|1,0,1]=4 6926 B6R1.2 IC1=CCCO1 Amb24322816 [1,0,0,1,0,0|1,0,1]=4 6927 B6R1.2 IC1CCCO1 Amb24692765 [1,0,0,1,0,0|1,0,1]=4 6928 B6R1.2 IC=1CCCC1 Amb24332192 [1,0,0,1,0,0|2,0,0]=4 6929 B6R1.2 I[C@@H]1COCC1 Amb22405918 [1,0,0,1,0,0|1,0,1]=4 6930 B6R1.2 I[C@H]1COCC1 Amb25337461 [1,0,0,1,0,0|1,0,1]=4 6931 B6R1.2 N=C1CCCC1 Amb22274869 [1,0,0,1,0,0|2,0,0]=4 6932 B6R1.2 N=C1CCCN1 Amb2371632 [1,0,0,1,0,0|2,0,0]=4 6933 B6R1.2 N=C1CCCS1 Amb10072429 [1,0,0,1,0,0|1,1,0]=4 6934 B6R1.2 N=C1NCCO1 Amb20623979 [1,0,0,1,0,0|2,0,0]=4 6935 B6R1.2 NC1=NCCC1 Amb10976565 [1,0,0,1,0,0|2,0,0]=4 6936 B6R1.2 NC1=NCCO1 Amb24325166 [1,0,0,1,0,0|2,0,0]=4 6937 B6R1.2 NC1CC=CC1 Amb18203201 [1,0,0,1,0,0|2,0,0]=4 6938 B6R1.2 NC1CCCO1 Amb16233703 [1,0,0,1,0,0|1,0,1]=4 6939 B6R1.2 NC1COCC1 Amb16233718 [1,0,0,1,0,0|1,0,1]=4 6940 B6R1.2 NC=1CCCC1 Amb25699912 [1,0,0,1,0,0|2,0,0]=4 6941 B6R1.2 N[C@@H]1CCCO1 Amb25146442 [1,0,0,1,0,0|1,0,1]=4 6942 B6R1.2 N[C@@H]1COC=C1 Amb24733636 [1,0,0,1,0,0|1,0,1]=4 6943 B6R1.2 N[C@@H]1COCC1 Amb10603285 [1,0,0,1,0,0|1,0,1]=4 6944 B6R1.2 N[C@@H]1COCC1 Amb22748137 [1,0,0,1,0,0|1,0,1]=4 6945 B6R1.2 N[C@H]1COCC1 Amb19515768 [1,0,0,1,0,0|1,0,1]=4 6946 B6R1.2 O=C1BCCN1 Amb25267191 [1,0,0,1,0,0|2,0,0]=4 6947 B6R1.2 O=C1C=NCO1 Amb25786221 [1,0,0,1,0,0|1,0,1]=4 6948 B6R1.2 O=C1CCCN1 Amb20240633 [1,0,0,1,0,0|1,0,0]=3 6949 B6R1.2 O=C1CCCN1 Amb22338202 [1,0,0,1,0,0|1,0,0]=3 6950 B6R1.2 O=C1CCCN1 Amb22432663 [1,0,0,1,0,0|1,0,0]=3 6951 B6R1.2 O=C1CCCS1 Amb22338102 [1,0,0,1,0,0|0,1,0]=3 6952 B6R1.2 O=C1CCNN1 Amb22730624 [1,0,0,1,0,0|2,0,0]=4 6953 B6R1.2 O=C1CCON1 Amb22235009 [1,0,0,1,0,0|2,0,0]=4 6954 B6R1.2 O=C1CN=CO1 Amb24333834 [1,0,0,1,0,0|1,0,1]=4 6955 B6R1.2 O=C1CNCN1 Amb19957368 [1,0,0,1,0,0|2,0,0]=4 6956 B6R1.2 O=C1CNCO1 Amb24661408 [1,0,0,1,0,0|1,0,0]=3 6957 B6R1.2 O=C1CS[Ca]O1 Amb22369695 [1,0,0,1,0,0|2,0,0]=4 6958 B6R1.2 O=C1N=CCO1 Amb25024901 [1,0,0,1,0,0|1,0,1]=4 6959 B6R1.2 O=C1SCCS1 Amb24630172 [1,0,0,1,0,0|1,1,0]=4 6960 B6R1.2 O=P1OCCO1 Amb22346149 [1,0,0,1,0,0|2,0,0]=4 6961 B6R1.2 O=[13C]1CCCC1 Amb22353487 [1,0,0,1,0,0|1,0,0]=3 6962 B6R1.2 O=[13C]1OCCO1 Amb22338878 [1,0,0,1,0,0|1,0,0]=3 6963 B6R1.2 O=[13C]1O[13CH2][13CH2]O1 Amb22351705 [1,0,0,1,0,0|1,0,0]=3 6964 B6R1.2 OC1=NNCC1 Amb2111955 [1,0,0,1,0,0|2,0,0]=4 6965 B6R1.2 OC1CCCO1 Amb17615892 [1,0,0,1,0,0|0,0,2]=4 6966 B6R1.2 OC1CNOC1 Amb19516646 [1,0,0,1,0,0|2,0,0]=4 6967 B6R1.2 OC1CNOC1 Amb19889794 [1,0,0,1,0,0|2,0,0]=4 6968 B6R1.2 OC1COC=C1 Amb25194606 [1,0,0,1,0,0|1,0,1]=4 6969 B6R1.2 O[13CH]1CCCC1 Amb22367208 [1,0,0,1,0,0|1,0,1]=4 6970 B6R1.2 O[C@@H]1CCCN1 Amb25662794 [1,0,0,1,0,0|1,0,1]=4 6971 B6R1.2 O[C@@H]1CCCO1 Amb25146365 [1,0,0,1,0,0|0,0,2]=4 6972 B6R1.2 O[C@@H]1CNOC1 Amb22748671 [1,0,0,1,0,0|2,0,0]=4 6973 B6R1.2 O[C@@H]1CNOC1 Amb23596853 [1,0,0,1,0,0|2,0,0]=4 6974 B6R1.2 O[C@H]1CCCN1 Amb25662512 [1,0,0,1,0,0|1,0,1]=4 6975 B6R1.2 O[C@H]1CNOC1 Amb25333008 [1,0,0,1,0,0|2,0,0]=4 6976 B6R1.2 O[C@H]1COC=C1 Amb25855065 [1,0,0,1,0,0|1,0,1]=4 6977 B6R1.2 S=C1NCCO1 Amb2371644 [1,0,0,1,0,0|1,1,0]=4 6978 B6R1.2 SC1COCC1 Amb22298444 [1,0,0,1,0,0|1,0,1]=4 6979 B6R1.3 BrCCC1CC1 Amb19149009 [1,0,0,1,0,0|1,0,1]=4 6980 B6R1.3 Br\C=C\C1CC1 Amb25245897 [1,0,0,1,0,0|1,0,1]=4 6981 B6R1.3 C=CCC1CC1 Amb25146408 [1,0,0,1,0,0|1,0,0]=3 6982 B6R1.3 C=CCC1CO1 Amb24704129 [1,0,0,1,0,0|2,0,0]=4 6983 B6R1.3 CCCC1CC1 Amb25348836 [1,0,0,1,0,0|1,0,1]=4 6984 B6R1.3 CCCC1CO1 Amb17771535 [1,0,0,1,0,0|1,0,1]=4 6985 B6R1.3 CCC[C@@H]1CO1 Amb25348803 [1,0,0,1,0,0|1,0,1]=4 6986 B6R1.3 CCC[C@H]1CO1 Amb10982593 [1,0,0,1,0,0|1,0,1]=4 6987 B6R1.3 CNCC1CC1 Amb10609255 [1,0,0,1,0,0|2,0,0]=4 6988 B6R1.3 CSCC1CC1 Amb25684902 [1,0,0,1,0,0|2,0,0]=4 6989 B6R1.3 ICCC1CC1 Amb22757415 [1,0,0,1,0,0|1,0,1]=4 6990 B6R1.3 NCCC1CC1 Amb19149013 [1,0,0,1,0,0|1,0,1]=4 6991 B6R1.3 NCCC1CC1 Amb22756011 [1,0,0,1,0,0|1,0,1]=4 6992 B6R1.3 O=CCC1CC1 Amb21856083 [1,0,0,1,0,0|0,0,0]=2 6993 B6R1.3 OCCC1CO1 Amb24334074 [1,0,0,1,0,0|1,0,1]=4 6994 B6R1.3 OCC[C@@H]1CO1 Amb24120634 [1,0,0,1,0,0|1,0,1]=4 6995 B6R1.3 OCC[C@H]1CO1 Amb25052254 [1,0,0,1,0,0|1,0,1]=4 6996 B6R1.3 SCCC1CC1 Amb24642475 [1,0,0,1,0,0|0,1,1]=4 6997 B6R1.5 C=C1CC(N)C1 Amb19929922 [1,0,0,1,0,0|2,0,0]=4 6998 B6R1.5 CC1CC(=O)C1 Amb22284831 [1,0,0,1,0,0|0,0,0]=2 6999 B6R1.5 CC1CC(=O)O1 Amb13777279 [1,0,0,1,0,0|0,0,0]=2 7000 B6R1.5 CC1CC(C)O1 Amb22737240 [1,0,0,1,0,0|1,0,1]=4 7001 B6R1.5 CC1CC(N)C1 Amb20623633 [1,0,0,1,0,0|1,0,1]=4 7002 B6R1.5 CC1CC(N)C1 Amb22058941 [1,0,0,1,0,0|1,0,1]=4 7003 B6R1.5 CC1CC(O)C1 Amb22235436 [1,0,0,1,0,0|0,0,1]=3 7004 B6R1.5 CC1CN(C)C1 Amb24382741 [1,0,0,1,0,0|2,0,0]=4 7005 B6R1.5 CC1CN(N)C1 Amb25184946 [1,0,0,1,0,0|2,0,0]=4 7006 B6R1.5 CN1CC(=O)C1 Amb22292462 [1,0,0,1,0,0|1,0,0]=3 7007 B6R1.5 CN1CC(O)C1 Amb21960698 [1,0,0,1,0,0|1,0,1]=4 7008 B6R1.5 CN1CC(O)C1 Amb22034404 [1,0,0,1,0,0|1,0,1]=4 7009 B6R1.5 C[C@@H]1CC(=O)O1 Amb10603200 [1,0,0,1,0,0|0,0,0]=2 7010 B6R1.5 C[C@@H]1C[C@@H](C)O1 Amb24332806 [1,0,0,1,0,0|1,0,1]=4 7011 B6R1.5 C[C@@H]1C[C@@H](N)C1 Amb24665814 [1,0,0,1,0,0|1,0,1]=4 7012 B6R1.5 C[C@@H]1C[C@H](C)O1 Amb24333814 [1,0,0,1,0,0|1,0,1]=4 7013 B6R1.5 C[C@@H]1C[C@H](N)C1 Amb22746992 [1,0,0,1,0,0|1,0,1]=4 7014 B6R1.5 C[C@H]1CC(=O)N1 Amb25755939 [1,0,0,1,0,0|1,0,0]=3 7015 B6R1.5 C[C@H]1CC(=O)O1 Amb16234264 [1,0,0,1,0,0|0,0,0]=2 7016 B6R1.5 NC1CC(=O)C1 Amb20241928 [1,0,0,1,0,0|1,0,0]=3 7017 B6R1.5 NC1CC(=O)C1 Amb23439093 [1,0,0,1,0,0|1,0,0]=3 7018 B6R1.5 NC1CC(O)C1 Amb20670971 [1,0,0,1,0,0|1,0,1]=4 7019 B6R1.5 NC1CS(=O)C1 Amb25757983 [1,0,0,1,0,0|2,0,0]=4 7020 B6R1.5 N[C@@H]1C[C@@H](C1)O Amb10603190 [1,0,0,1,0,0|1,0,1]=4 7021 B6R1.5 N[C@@H]1C[C@@H](O)C1 Amb22231671 [1,0,0,1,0,0|1,0,1]=4 7022 B6R1.5 N[C@@H]1C[C@H](C1)O Amb10604103 [1,0,0,1,0,0|1,0,1]=4 7023 B6R1.5 N[C@@H]1C[C@H](O)C1 Amb22230425 [1,0,0,1,0,0|1,0,1]=4 7024 B6R1.5 O=C1CC(Br)C1 Amb22388498 [1,0,0,1,0,0|1,0,0]=3 7025 B6R1.5 O=C1CC(Br)N1 Amb24332152 [1,0,0,1,0,0|2,0,0]=4 7026 B6R1.5 O=C1CC(Cl)C1 Amb25087791 [1,0,0,1,0,0|1,0,0]=3 7027 B6R1.5 O=C1CC(Cl)N1 Amb24531401 [1,0,0,1,0,0|2,0,0]=4 7028 B6R1.5 O=C1CC(F)N1 Amb24588463 [1,0,0,1,0,0|2,0,0]=4 7029 B6R1.5 OC1CC(=O)C1 Amb22235480 [1,0,0,1,0,0|1,0,0]=3 7030 B6R1.5 OC1CC(Br)C1 Amb24544946 [1,0,0,1,0,0|1,0,1]=4 7031 B6R1.5 OC1CC(F)C1 Amb23439374 [1,0,0,1,0,0|1,0,1]=4 7032 B6R1.5 OC1CC(S)C1 Amb25847775 [1,0,0,1,0,0|1,0,1]=4 7033 B6R1.5 OC1CS(=O)C1 Amb25025463 [1,0,0,1,0,0|2,0,0]=4 7034 B6R1.5 O[C@@H]1C[C@@H](F)C1 Amb23440228 [1,0,0,1,0,0|1,0,1]=4 7035 B6R1.5 O[C@@H]1C[C@H](Cl)C1 Amb25065368 [1,0,0,1,0,0|1,0,1]=4 7036 B6R1.5 O[C@@H]1C[C@H](F)C1 Amb24183986 [1,0,0,1,0,0|1,0,1]=4 7037 B6R1.5 O[C@H]1CC(=O)O1 Amb25106737 [1,0,0,1,0,0|1,0,0]=3 7038 B6R1.8 C=C1CC1C=O Amb25288413 [1,0,0,1,0,0|0,0,2]=4 7039 B6R1.8 C=C[C@@H]1C[C@H]1Br Amb25026097 [1,0,0,1,0,0|2,0,0]=4 7040 B6R1.8 CC/1C\C1=C\Br Amb24333013 [1,0,0,1,0,0|1,0,1]=4 7041 B6R1.8 CC1=CC1C=O Amb24695489 [1,0,0,1,0,0|0,0,2]=4 7042 B6R1.8 CC1CC1C#N Amb19148757 [1,0,0,1,0,0|1,0,1]=4 7043 B6R1.8 CC1CC1C=O Amb20622289 [1,0,0,1,0,0|0,0,0]=2 7044 B6R1.8 CC1CC1CBr Amb25738234 [1,0,0,1,0,0|1,0,1]=4 7045 B6R1.8 CC1CC1CC Amb25110998 [1,0,0,1,0,0|1,0,1]=4 7046 B6R1.8 CC1CC1NC Amb18947423 [1,0,0,1,0,0|2,0,0]=4 7047 B6R1.8 CC1OC1C=O Amb24728876 [1,0,0,1,0,0|1,0,0]=3 7048 B6R1.8 CC1O[C@H]1CO Amb25146658 [1,0,0,1,0,0|1,0,1]=4 7049 B6R1.8 CCC1CC1=O Amb24686409 [1,0,0,1,0,0|1,0,0]=3 7050 B6R1.8 CCC1OC1=O Amb24426509 [1,0,0,1,0,0|0,0,0]=2 7051 B6R1.8 CCC1OC1C Amb1141391 [1,0,0,1,0,0|1,0,1]=4 7052 B6R1.8 CCC1OC1Cl Amb24571837 [1,0,0,1,0,0|1,0,1]=4 7053 B6R1.8 CC[C@@H]1C[C@@H]1O Amb25026310 [1,0,0,1,0,0|1,0,1]=4 7054 B6R1.8 CC[C@@H]1O[C@@H]1Cl Amb25179251 [1,0,0,1,0,0|1,0,1]=4 7055 B6R1.8 C[C@@H]1C[C@@H]1C=O Amb25662825 [1,0,0,1,0,0|0,0,0]=2 7056 B6R1.8 C[C@@H]1C[C@@H]1CBr Amb25336679 [1,0,0,1,0,0|1,0,1]=4 7057 B6R1.8 C[C@@H]1C[C@@H]1CC Amb25026122 [1,0,0,1,0,0|1,0,1]=4 7058 B6R1.8 C[C@@H]1C[C@@H]1CO Amb24519750 [1,0,0,1,0,0|0,0,1]=3 7059 B6R1.8 C[C@@H]1C[C@H]1C=O Amb24569326 [1,0,0,1,0,0|0,0,0]=2 7060 B6R1.8 C[C@@H]1C[C@H]1CN Amb22886350 [1,0,0,1,0,0|1,0,1]=4 7061 B6R1.8 C[C@@H]1C[C@H]1CN Amb24610044 [1,0,0,1,0,0|1,0,1]=4 7062 B6R1.8 C[C@@H]1C[C@H]1CO Amb22886842 [1,0,0,1,0,0|0,0,1]=3 7063 B6R1.8 C[C@H]1C[C@@H]1C=O Amb24617263 [1,0,0,1,0,0|0,0,0]=2 7064 B6R1.8 C[C@H]1C[C@@H]1CBr Amb24512092 [1,0,0,1,0,0|1,0,1]=4 7065 B6R1.8 C[C@H]1C[C@H]1CBr Amb25313164 [1,0,0,1,0,0|1,0,1]=4 7066 B6R1.8 C[C@H]1C[C@H]1CCl Amb25259835 [1,0,0,1,0,0|1,0,1]=4 7067 B6R1.8 C[C@H]1O[C@@H]1C=O Amb25025768 [1,0,0,1,0,0|1,0,0]=3 7068 B6R1.8 C[C@H]1O[C@H]1C=O Amb25207058 [1,0,0,1,0,0|1,0,0]=3 7069 B6R1.8 C[C@H]1O[C@H]1CO Amb24514794 [1,0,0,1,0,0|1,0,1]=4 7070 B6R1.8 NC1CC1CO Amb25104797 [1,0,0,1,0,0|1,0,1]=4 7071 B6R1.8 N[C@@H]1C[C@@H]1CO Amb24514861 [1,0,0,1,0,0|1,0,1]=4 7072 B6R1.8 N[C@@H]1C[C@H]1CO Amb25110678 [1,0,0,1,0,0|1,0,1]=4 7073 B6R1.8 O=C[C@@H]1C[C@H]1Cl Amb24571016 [1,0,0,1,0,0|1,0,0]=3 7074 B6R1.8 OCC1CC1Br Amb24531509 [1,0,0,1,0,0|1,0,1]=4 7075 B6R1.8 OCC1CC1F Amb25745067 [1,0,0,1,0,0|1,0,1]=4 7076 B6R1.8 OCC1CC1I Amb25054549 [1,0,0,1,0,0|1,0,1]=4 7077 B6R1.8 OC[C@@H]1C[C@@H]1Cl Amb24627135 [1,0,0,1,0,0|1,0,1]=4 7078 B6R1.8 OC[C@@H]1C[C@@H]1F Amb25168875 [1,0,0,1,0,0|1,0,1]=4 7079 B6R1.8 OC[C@@H]1C[C@@H]1I Amb25232607 [1,0,0,1,0,0|1,0,1]=4 7080 B6R1.8 OC[C@@H]1C[C@H]1Br Amb25744861 [1,0,0,1,0,0|1,0,1]=4 7081 B6R1.8 OC[C@@H]1C[C@H]1Cl Amb24513559 [1,0,0,1,0,0|1,0,1]=4 7082 B6R1.8 OC[C@@H]1C[C@H]1F Amb22899994 [1,0,0,1,0,0|1,0,1]=4 7083 B6R1.8 OC[C@@H]1C[C@H]1I Amb24677525 [1,0,0,1,0,0|1,0,1]=4 7084 B6R1.8 OC[C@H]1C[C@@H]1Cl Amb24677823 [1,0,0,1,0,0|1,0,1]=4 7085 B6R1.8 OC[C@H]1C[C@@H]1F Amb25245862 [1,0,0,1,0,0|1,0,1]=4 7086 B6R1.8 OC[C@H]1C[C@@H]1I Amb24519043 [1,0,0,1,0,0|1,0,1]=4 7087 B6R1.8 OC[C@H]1C[C@H]1I Amb25745690 [1,0,0,1,0,0|1,0,1]=4 7088 B6R1.9 CC1(C)C=C1Br Amb24742774 [1,0,0,1,0,0|1,0,1]=4 7089 B6R1.9 CC1(C)CC1Br Amb25738666 [1,0,0,1,0,0|1,0,1]=4 7090 B6R1.9 CC1(O)CC1=O Amb24478175 [1,0,0,1,0,0|1,0,0]=3 7091 B6R1.9 CC1CC1(C)C Amb22343249 [1,0,0,1,0,0|1,0,1]=4 7092 B6R1.9 CC1CC1(C)O Amb22157187 [1,0,0,1,0,0|1,0,1]=4 7093 B6R1.9 NC1CC1(C)C Amb13951158 [1,0,0,1,0,0|1,0,1]=4 7094 B6R1.9 NC1CC1(C)C Amb13951159 [1,0,0,1,0,0|1,0,1]=4 7095 B6R1.10 CC1(C)CCN1 Amb19338148 [1,0,0,1,0,0|1,0,1]=4 7096 B6R1.10 CC1(C)CCO1 Amb22737237 [1,0,0,1,0,0|0,0,1]=3 7097 B6R1.10 CC1(C)CNC1 Amb19514944 [1,0,0,1,0,0|2,0,0]=4 7098 B6R1.10 CC1(O)CCC1 Amb17940165 [1,0,0,1,0,0|1,0,1]=4 7099 B6R1.10 O=S1(=O)CCC1 Amb13883572 [1,0,0,1,0,0|1,0,1]=4 7100 B6R1.11 C=C(Br)C1CC1 Amb22583737 [1,0,0,1,0,0|2,0,0]=4 7101 B6R1.11 CC(=C)C1CC1 Amb25147701 [1,0,0,1,0,0|2,0,0]=4 7102 B6R1.11 CC(=O)C1CS1 Amb25373120 [1,0,0,1,0,0|2,0,0]=4 7103 B6R1.11 CC(=O)N1CC1 Amb17607538 [1,0,0,1,0,0|2,0,0]=4 7104 B6R1.11 CC(=O)[C@H]1CO1 Amb24628197 [1,0,0,1,0,0|2,0,0]=4 7105 B6R1.11 CC(C)C1CC1 Amb22343248 [1,0,0,1,0,0|1,0,1]=4 7106 B6R1.11 CC(C)C1CO1 Amb22002533 [1,0,0,1,0,0|0,0,1]=3 7107 B6R1.11 CC(C)C1CS1 Amb25684267 [1,0,0,1,0,0|0,1,1]=4 7108 B6R1.11 CC(C)[C@H]1CO1 Amb24670205 [1,0,0,1,0,0|0,0,1]=3 7109 B6R1.11 CC(C1CO1)O Amb17593033 [1,0,0,1,0,0|1,0,1]=4 7110 B6R1.11 CC(Cl)C1CO1 Amb25362259 [1,0,0,1,0,0|1,0,1]=4 7111 B6R1.11 CC(I)C1CO1 Amb24478542 [1,0,0,1,0,0|1,0,1]=4 7112 B6R1.11 CC(O)[C@H]1CO1 Amb24531369 [1,0,0,1,0,0|1,0,1]=4 7113 B6R1.11 C[C@@H](C1CC1)O Amb13952945 [1,0,0,1,0,0|1,0,1]=4 7114 B6R1.11 C[C@@H](Cl)[C@@H]1CO1 Amb25026341 [1,0,0,1,0,0|1,0,1]=4 7115 B6R1.11 C[C@@H](O)C1CO1 Amb25146411 [1,0,0,1,0,0|1,0,1]=4 7116 B6R1.11 C[C@H](Br)C1CO1 Amb24552961 [1,0,0,1,0,0|1,0,1]=4 7117 B6R1.11 C[C@H](C1CC1)O Amb13952943 [1,0,0,1,0,0|1,0,1]=4 7118 B6R1.11 C[C@H](Cl)[C@@H]1CO1 Amb25025606 [1,0,0,1,0,0|1,0,1]=4 7119 B6R1.11 C[C@H](O)[C@@H]1CO1 Amb25176470 [1,0,0,1,0,0|1,0,1]=4 7120 B6R1.11 FC(=O)C1CC1 Amb17673783 [1,0,0,1,0,0|1,0,0]=3 7121 B6R1.11 NC(=O)C1CC1 Amb1789460 [1,0,0,1,0,0|1,0,0]=3 7122 B6R1.11 NC(O)C1CC1 Amb22492754 [1,0,0,1,0,0|1,0,1]=4 7123 B6R1.11 N[13C](=O)[13CH]1[13CH2]O1 Amb17614804 [1,0,0,1,0,0|2,0,0]=4 7124 B6R1.11 O=S(Cl)C1CC1 Amb25662827 [1,0,0,1,0,0|2,0,0]=4 7125 B6R1.11 OB(C1CC1)O Amb2455832 [1,0,0,1,0,0|1,0,1]=4 7126 B6R1.11 OC(=O)C1CN1 Amb21864773 [1,0,0,1,0,0|1,0,0]=3 7127 B6R1.11 OC(=O)C1CS1 Amb24641854 [1,0,0,1,0,0|1,0,0]=3 7128 B6R1.11 OC(=O)[C@@H]1CN1 Amb22745452 [1,0,0,1,0,0|1,0,0]=3 7129 B6R1.11 OS(=O)C1CC1 Amb24334290 [1,0,0,1,0,0|1,0,0]=3 7130 B6R1.11 [O-]C(=O)C1CO1 Amb22492453 [1,0,0,1,0,0|1,0,1]=4 7131 B6R1.11 [O-]C(=O)[C@@H]1CO1 Amb22503671 [1,0,0,1,0,0|1,0,1]=4 7132 B6R1.11 [O-]C(=O)[C@H]1CO1 Amb22503672 [1,0,0,1,0,0|1,0,1]=4 7133 B6R1.11 [O-][N+](=O)C1CC1 Amb25768805 [1,0,0,1,0,0|1,0,1]=4 7134 B6R1.4 CC1CNC1=O Amb24444140 [0,0,0,1,1,0|1,0,0]=3 7135 B6R1.4 CC1COC1=O Amb25794274 [0,0,0,1,1,0|0,0,0]=2 7136 B6R1.4 CC1CSC1O Amb24353121 [0,0,0,1,1,0|0,1,1]=4 7137 B6R1.4 CC1OCC1=O Amb23456088 [0,0,0,1,1,0|2,0,0]=4 7138 B6R1.4 C[C@@H]1CCC1=O Amb24334317 [0,0,0,1,1,0|1,0,0]=3 7139 B6R1.4 C[C@@H]1CC[C@@H]1O Amb25317495 [0,0,0,1,1,0|1,0,1]=4 7140 B6R1.4 C[C@@H]1CNC1=O Amb24568896 [0,0,0,1,1,0|1,0,0]=3 7141 B6R1.4 C[C@H]1CCC1=O Amb24333446 [0,0,0,1,1,0|1,0,0]=3 7142 B6R1.4 C[C@H]1CC[C@H]1O Amb24556459 [0,0,0,1,1,0|1,0,1]=4 7143 B6R1.4 NC1CCC1=O Amb22896568 [0,0,0,1,1,0|2,0,0]=4 7144 B6R1.4 NC1CNC1=O Amb18832512 [0,0,0,1,1,0|2,0,0]=4 7145 B6R1.4 N[C@@H]1CNC1=O Amb22751418 [0,0,0,1,1,0|2,0,0]=4 7146 B6R1.4 N[C@@H]1COC1=O Amb22748014 [0,0,0,1,1,0|1,0,0]=3 7147 B6R1.4 N[C@@H]1COC1=O Amb22757168 [0,0,0,1,1,0|1,0,0]=3 7148 B6R1.4 N[C@H]1CNC1=O Amb25811302 [0,0,0,1,1,0|2,0,0]=4 7149 B6R1.4 O=C1CCC1Br Amb21964157 [0,0,0,1,1,0|2,0,0]=4 7150 B6R1.4 O=C1CCC1C Amb17593022 [0,0,0,1,1,0|1,0,0]=3 7151 B6R1.4 O=C1CCC1Cl Amb19892275 [0,0,0,1,1,0|2,0,0]=4 7152 B6R1.4 O=C1CCC1O Amb17593027 [0,0,0,1,1,0|2,0,0]=4 7153 B6R1.4 O=C1SCC1Cl Amb24502718 [0,0,0,1,1,0|1,1,0]=4 7154 B6R1.4 OC1CNC1=O Amb24689689 [0,0,0,1,1,0|2,0,0]=4 7155 B6R1.4 [NH3+][C@H]1COC1=O Amb22349488 [0,0,0,1,1,0|1,0,0]=3 7156 B8R1.3 CC1=CCC(=O)CC1 Amb17617292 [0,0,0,1,0,1|1,0,1]=4 7157 B8R1.3 CC1CC=C(C)CN1 Amb23455589 [0,0,0,1,0,1|2,0,0]=4 7158 B8R1.3 CC1CCC(=C)CC1 Amb24058250 [0,0,0,1,0,1|2,0,0]=4 7159 B8R1.3 CC1CCC(=O)C=C1 Amb24556470 [0,0,0,1,0,1|1,0,1]=4 7160 B8R1.3 CC1CCC(=O)CO1 Amb22491005 [0,0,0,1,0,1|1,0,0]=3 7161 B8R1.3 CC1CCC(=O)CS1 Amb23568547 [0,0,0,1,0,1|1,0,0]=3 7162 B8R1.3 CC1CCC(=O)NC1 Amb13952062 [0,0,0,1,0,1|1,0,0]=3 7163 B8R1.3 CC1CCC(O)CN1 Amb18641838 [0,0,0,1,0,1|1,0,1]=4 7164 B8R1.3 CC1CCC(O)CS1 Amb23568601 [0,0,0,1,0,1|1,0,1]=4 7165 B8R1.3 CC1CCN(O)CC1 Amb25188076 [0,0,0,1,0,1|2,0,0]=4 7166 B8R1.3 CC1CN=C(N)SC1 Amb25169567 [0,0,0,1,0,1|1,1,0]=4 7167 B8R1.3 CC1CNC(=N)CC1 Amb25680063 [0,0,0,1,0,1|2,0,0]=4 7168 B8R1.3 CC1CNC(=O)CN1 Amb18833035 [0,0,0,1,0,1|1,0,0]=3 7169 B8R1.3 CC1CNC(=O)CO1 Amb22371080 [0,0,0,1,0,1|1,0,0]=3 7170 B8R1.3 CC1CNC(C)CO1 Amb22751384 [0,0,0,1,0,1|1,0,1]=4 7171 B8R1.3 CC1CNC(N)=NC1 Amb24685625 [0,0,0,1,0,1|2,0,0]=4 7172 B8R1.3 CC1CNC(O)=NC1 Amb25268854 [0,0,0,1,0,1|1,0,0]=3 7173 B8R1.3 CC1CNC(S)=NC1 Amb25211387 [0,0,0,1,0,1|1,1,0]=4 7174 B8R1.3 CC1COC(=O)OC1 Amb21856480 [0,0,0,1,0,1|0,0,0]=2 7175 B8R1.3 CC1COC(C)CO1 Amb25738098 [0,0,0,1,0,1|1,0,1]=4 7176 B8R1.3 CC1SCC(=O)CS1 Amb25086708 [0,0,0,1,0,1|2,0,0]=4 7177 B8R1.3 CP1CCC(=O)CC1 Amb25767035 [0,0,0,1,0,1|2,0,0]=4 7178 B8R1.3 C[C@@H]1CCC(=O)CN1 Amb24481509 [0,0,0,1,0,1|1,0,0]=3 7179 B8R1.3 C[C@@H]1CC[C@@H](CC1)O Amb10844735 [0,0,0,1,0,1|1,0,1]=4 7180 B8R1.3 C[C@@H]1CC[C@@H](O)CN1 Amb22886214 [0,0,0,1,0,1|1,0,1]=4 7181 B8R1.3 C[C@@H]1CC[C@@H](O)CN1 Amb25175824 [0,0,0,1,0,1|1,0,1]=4 7182 B8R1.3 C[C@@H]1CC[C@@H](O)CO1 Amb25176515 [0,0,0,1,0,1|1,0,1]=4 7183 B8R1.3 C[C@@H]1CC[C@H](O)CN1 Amb22886213 [0,0,0,1,0,1|1,0,1]=4 7184 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22411475 [0,0,0,1,0,1|1,0,0]=3 7185 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22587592 [0,0,0,1,0,1|1,0,0]=3 7186 B8R1.3 C[C@@H]1CN[C@@H](C)CO1 Amb22745541 [0,0,0,1,0,1|1,0,1]=4 7187 B8R1.3 C[C@@H]1CN[C@@H](C)CO1 Amb22748917 [0,0,0,1,0,1|1,0,1]=4 7188 B8R1.3 C[C@@H]1CN[C@H](C)CO1 Amb22745542 [0,0,0,1,0,1|1,0,1]=4 7189 B8R1.3 C[C@@H]1CN[C@H](C)CO1 Amb22747293 [0,0,0,1,0,1|1,0,1]=4 7190 B8R1.3 C[C@H]1CCC(=O)CO1 Amb25262664 [0,0,0,1,0,1|1,0,0]=3 7191 B8R1.3 C[C@H]1CC[C@H](O)CN1 Amb24575263 [0,0,0,1,0,1|1,0,1]=4 7192 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22411525 [0,0,0,1,0,1|1,0,0]=3 7193 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22586634 [0,0,0,1,0,1|1,0,0]=3 7194 B8R1.3 C[C@H]1CNC(=O)CO1 Amb24589385 [0,0,0,1,0,1|1,0,0]=3 7195 B8R1.3 C[C@H]1CN[C@@H](C)CO1 Amb24087467 [0,0,0,1,0,1|1,0,1]=4 7196 B8R1.3 C[NH+]1CCC(=O)CC1 Amb10552693 [0,0,0,1,0,1|2,0,0]=4 7197 B8R1.3 NC1CCC(=O)CC1 Amb10067105 [0,0,0,1,0,1|2,0,0]=4 7198 B8R1.3 NC1CCC(=O)CC1 Amb21862513 [0,0,0,1,0,1|2,0,0]=4 7199 B8R1.3 NC1CCC(=O)CC1 Amb22831860 [0,0,0,1,0,1|2,0,0]=4 7200 B8R1.3 NC1CCC(=O)NC1 Amb13952208 [0,0,0,1,0,1|2,0,0]=4 7201 B8R1.3 NC1CNC(=O)CC1 Amb18833034 [0,0,0,1,0,1|2,0,0]=4 7202 B8R1.3 NC1CNC(O)=NC1 Amb25232194 [0,0,0,1,0,1|2,0,0]=4 7203 B8R1.3 NC1COS(=O)OC1 Amb24564500 [0,0,0,1,0,1|2,0,0]=4 7204 B8R1.3 N[C@@H]1CNC(=O)CC1 Amb22748949 [0,0,0,1,0,1|2,0,0]=4 7205 B8R1.3 O=C1CCC(F)CC1 Amb20671078 [0,0,0,1,0,1|2,0,0]=4 7206 B8R1.3 O=C1CCC(I)CN1 Amb25341317 [0,0,0,1,0,1|2,0,0]=4 7207 B8R1.3 O=C1CNC(=O)OC1 Amb24481365 [0,0,0,1,0,1|1,0,1]=4 7208 B8R1.3 O=C1NCC(Br)CN1 Amb24749834 [0,0,0,1,0,1|2,0,0]=4 7209 B8R1.3 OC1CCC(=O)NC1 Amb10066907 [0,0,0,1,0,1|2,0,0]=4 7210 B8R1.3 OC1CNC(=O)NC1 Amb19516674 [0,0,0,1,0,1|2,0,0]=4 7211 B8R1.3 OC1CNC(O)=NC1 Amb20001781 [0,0,0,1,0,1|2,0,0]=4 7212 B8R1.20 C=C1C[C@@H]1CC(O)=O Amb25331268 [0,0,0,1,0,1|0,0,2]=4 7213 B8R1.20 C=C1C[C@H]1CC(O)=O Amb24686141 [0,0,0,1,0,1|0,0,2]=4 7214 B8R1.20 CC1CC1=CC(O)=O Amb25256441 [0,0,0,1,0,1|0,0,1]=3 7215 B8R1.20 CC1CC1CB(O)O Amb24641424 [0,0,0,1,0,1|1,0,1]=4 7216 B8R1.20 CC1CC1CC(N)=O Amb25772500 [0,0,0,1,0,1|1,0,0]=3 7217 B8R1.20 CC1CC1CC(O)=O Amb25316515 [0,0,0,1,0,1|0,0,0]=2 7218 B8R1.20 CC1CC1NC(N)=O Amb25074259 [0,0,0,1,0,1|1,0,0]=3 7219 B8R1.20 CC1CC1NC(N)=S Amb25361754 [0,0,0,1,0,1|1,1,0]=4 7220 B8R1.20 CC1OC1CC(O)=O Amb24710388 [0,0,0,1,0,1|1,0,0]=3 7221 B8R1.20 C[C@@H]1C[C@H]1CC(C)=O Amb24373459 [0,0,0,1,0,1|1,0,0]=3 7222 B8R1.20 C[C@@H]1C[C@H]1NC(C)=O Amb24619123 [0,0,0,1,0,1|1,0,0]=3 7223 B8R1.20 C[C@@H]1O[C@H]1CC(N)=O Amb24629162 [0,0,0,1,0,1|2,0,0]=4 7224 B8R1.20 C[C@H]1C[C@H]1CC(C)=O Amb25257655 [0,0,0,1,0,1|1,0,0]=3 7225 B8R1.20 C[C@H]1C[C@H]1CC(O)=O Amb25174744 [0,0,0,1,0,1|0,0,0]=2 7226 B8R1.20 C[C@H]1C[C@H]1NC(N)=O Amb24532410 [0,0,0,1,0,1|1,0,0]=3 7227 B8R1.20 C[C@H]1O[C@H]1CC(O)=O Amb25747306 [0,0,0,1,0,1|1,0,0]=3 7228 B8R1.20 N[C@H]1C[C@H]1CC(O)=O Amb24585123 [0,0,0,1,0,1|1,0,0]=3 7229 B8R1.23 CC(=O)C1CC(O)C1 Amb25718423 [0,0,0,1,0,1|2,0,0]=4 7230 B8R1.23 CC(=O)N1CC(F)C1 Amb25106122 [0,0,0,1,0,1|2,0,0]=4 7231 B8R1.23 CC(=O)N1CC(N)C1 Amb19329932 [0,0,0,1,0,1|2,0,0]=4 7232 B8R1.23 CC(=O)N1CC(N)C1 Amb22406088 [0,0,0,1,0,1|2,0,0]=4 7233 B8R1.23 CC(=O)N1CC(O)C1 Amb17935746 [0,0,0,1,0,1|2,0,0]=4 7234 B8R1.23 CC(C)C1CC(=O)C1 Amb25806486 [0,0,0,1,0,1|1,0,0]=3 7235 B8R1.23 CC(C)N1CC(O)C1 Amb19516900 [0,0,0,1,0,1|1,0,1]=4 7236 B8R1.23 CC(O)C1CC(=O)O1 Amb25317296 [0,0,0,1,0,1|1,0,0]=3 7237 B8R1.23 CC1CC(C1)C(=O)Cl Amb24361916 [0,0,0,1,0,1|1,0,0]=3 7238 B8R1.23 CC1CC(C1)C(C)=O Amb23590280 [0,0,0,1,0,1|1,0,0]=3 7239 B8R1.23 CC1CC(C1)C(C)O Amb23590278 [0,0,0,1,0,1|1,0,1]=4 7240 B8R1.23 CC1CC(C1)C(O)=O Amb19515989 [0,0,0,1,0,1|0,0,0]=2 7241 B8R1.23 CC1CN(C1)C(C)=O Amb25044287 [0,0,0,1,0,1|1,0,0]=3 7242 B8R1.23 CC=1CC(C1)C(C)=O Amb24676939 [0,0,0,1,0,1|1,0,1]=4 7243 B8R1.23 CN1CC(C1)C(O)=O Amb19958116 [0,0,0,1,0,1|1,0,0]=3 7244 B8R1.23 C[C@@H]1C[C@@H](C1)C(O)=O Amb22746374 [0,0,0,1,0,1|0,0,0]=2 7245 B8R1.23 C[C@@H]1C[C@H](C1)C(O)=O Amb22746375 [0,0,0,1,0,1|0,0,0]=2 7246 B8R1.23 C[C@H](O)[C@@H]1CC(=O)O1 Amb24515159 [0,0,0,1,0,1|1,0,0]=3 7247 B8R1.23 C[C@H]1C[C@H](N1)C(O)=O Amb24514390 [0,0,0,1,0,1|0,0,0]=2 7248 B8R1.23 ClC1CC(C1)C(=O)O Amb16233600 [0,0,0,1,0,1|1,0,0]=3 7249 B8R1.23 NC(=O)C1CC(O)C1 Amb23570502 [0,0,0,1,0,1|2,0,0]=4 7250 B8R1.23 NC(=O)N1CC(F)C1 Amb25739433 [0,0,0,1,0,1|2,0,0]=4 7251 B8R1.23 NC1CC(C1)C(=O)O Amb10610660 [0,0,0,1,0,1|1,0,0]=3 7252 B8R1.23 NC1CC(C1)C(N)=O Amb20622654 [0,0,0,1,0,1|2,0,0]=4 7253 B8R1.23 NC1CC(C1)C(O)=O Amb21963541 [0,0,0,1,0,1|1,0,0]=3 7254 B8R1.23 N[C@@H]1C[C@@H](C1)C(=O)O Amb10604131 [0,0,0,1,0,1|1,0,0]=3 7255 B8R1.23 N[C@@H]1C[C@@H](C1)C(N)=O Amb22896793 [0,0,0,1,0,1|2,0,0]=4 7256 B8R1.23 N[C@@H]1C[C@H](C1)C(=O)O Amb10604102 [0,0,0,1,0,1|1,0,0]=3 7257 B8R1.23 N[C@@H]1C[C@H](C1)C(N)=O Amb22896794 [0,0,0,1,0,1|2,0,0]=4 7258 B8R1.23 N[C@@H]1C[C@H](C1)C(O)=O Amb19514893 [0,0,0,1,0,1|1,0,0]=3 7259 B8R1.23 O=C(Cl)C1CC(Cl)C1 Amb24739809 [0,0,0,1,0,1|2,0,0]=4 7260 B8R1.23 O=C1CC(C1)C(=O)O Amb1106387 [0,0,0,1,0,1|1,0,1]=4 7261 B8R1.23 O=C1CC(N1)C(=O)O Amb16232079 [0,0,0,1,0,1|1,0,1]=4 7262 B8R1.23 O=C1C[C@@H](O1)C(Cl)Cl Amb25108146 [0,0,0,1,0,1|2,0,0]=4 7263 B8R1.23 OC(=O)C1CC(F)C1 Amb20621267 [0,0,0,1,0,1|1,0,0]=3 7264 B8R1.23 OC(=O)[C@@H]1CC(=O)N1 Amb22367070 [0,0,0,1,0,1|1,0,1]=4 7265 B8R1.23 OC(=O)[C@@H]1C[C@@H](Br)C1 Amb24339433 [0,0,0,1,0,1|1,0,0]=3 7266 B8R1.23 OC(=O)[C@H]1CC(=O)O1 Amb25705638 [0,0,0,1,0,1|1,0,1]=4 7267 B8R1.23 OC1CC(C1)C(=O)Cl Amb24661280 [0,0,0,1,0,1|2,0,0]=4 7268 B8R1.23 O[C@@H]1C[C@H](C1)C(O)=O Amb19516178 [0,0,0,1,0,1|1,0,0]=3 7269 B8R1.23 O[C@H]1C[C@H](C1)C(O)=O Amb19516179 [0,0,0,1,0,1|1,0,0]=3 7270 B8R1.35 C=C(Br)CNC1CC1 Amb18969560 [0,0,0,1,0,1|2,0,0]=4 7271 B8R1.35 C=C(Cl)CNC1CC1 Amb18969181 [0,0,0,1,0,1|2,0,0]=4 7272 B8R1.35 CC(=C)CNC1CC1 Amb17317871 [0,0,0,1,0,1|2,0,0]=4 7273 B8R1.35 CC(=O)CCC1CC1 Amb25305448 [0,0,0,1,0,1|1,0,0]=3 7274 B8R1.35 CC(=O)NCC1CO1 Amb23557281 [0,0,0,1,0,1|2,0,0]=4 7275 B8R1.35 CC(=O)NC[C@H]1CO1 Amb25068125 [0,0,0,1,0,1|2,0,0]=4 7276 B8R1.35 CC(=O)OCC1CC1 Amb24502182 [0,0,0,1,0,1|1,0,0]=3 7277 B8R1.35 CC(=O)OCC1CO1 Amb10789133 [0,0,0,1,0,1|2,0,0]=4 7278 B8R1.35 CC(=O)SCC1CC1 Amb24623413 [0,0,0,1,0,1|1,0,0]=3 7279 B8R1.35 CC(=O)\C=C\C1CC1 Amb25830492 [0,0,0,1,0,1|1,0,1]=4 7280 B8R1.35 CC(C)NCC1CO1 Amb24629694 [0,0,0,1,0,1|1,0,1]=4 7281 B8R1.35 CC(C)OC[C@H]1CO1 Amb24641497 [0,0,0,1,0,1|1,0,1]=4 7282 B8R1.35 CC(C)SCC1CO1 Amb24449627 [0,0,0,1,0,1|1,0,1]=4 7283 B8R1.35 CC(CNC1CC1)O Amb17138364 [0,0,0,1,0,1|1,0,1]=4 7284 B8R1.35 CC(O)CCC1CC1 Amb25733792 [0,0,0,1,0,1|1,0,1]=4 7285 B8R1.35 C[C@@H](O)CCC1CC1 Amb24693085 [0,0,0,1,0,1|1,0,1]=4 7286 B8R1.35 C[C@@H](O)CNC1CC1 Amb25083354 [0,0,0,1,0,1|1,0,1]=4 7287 B8R1.35 C[C@H](O)CCC1CC1 Amb25025020 [0,0,0,1,0,1|1,0,1]=4 7288 B8R1.35 C[C@H](O)CNC1CC1 Amb25694355 [0,0,0,1,0,1|1,0,1]=4 7289 B8R1.35 NC(=N)CNC1CC1 Amb24495903 [0,0,0,1,0,1|2,0,0]=4 7290 B8R1.35 NC(=N)NCC1CC1 Amb19748557 [0,0,0,1,0,1|2,0,0]=4 7291 B8R1.35 NC(=N)SCC1CC1 Amb24364813 [0,0,0,1,0,1|2,0,0]=4 7292 B8R1.35 NC(=O)CNC1CC1 Amb18368582 [0,0,0,1,0,1|1,0,0]=3 7293 B8R1.35 NC(=O)NCC1CC1 Amb1138798 [0,0,0,1,0,1|1,0,0]=3 7294 B8R1.35 NC(=O)\C=C\C1CC1 Amb25226133 [0,0,0,1,0,1|1,0,1]=4 7295 B8R1.35 NC(=S)CCC1CC1 Amb24483097 [0,0,0,1,0,1|1,1,0]=4 7296 B8R1.35 NC(=S)CNC1CC1 Amb17231870 [0,0,0,1,0,1|1,1,0]=4 7297 B8R1.35 O=C(Cl)CCC1CC1 Amb25337452 [0,0,0,1,0,1|1,0,0]=3 7298 B8R1.35 O=C(Cl)OCC1CC1 Amb24370017 [0,0,0,1,0,1|1,0,0]=3 7299 B8R1.35 O=C(Cl)OCC1CO1 Amb25258534 [0,0,0,1,0,1|2,0,0]=4 7300 B8R1.35 OC(=O)C#CC1CC1 Amb1036650 [0,0,0,1,0,1|0,0,1]=3 7301 B8R1.35 OC(=O)CC=C1CC1 Amb25119812 [0,0,0,1,0,1|0,0,1]=3 7302 B8R1.35 OC(=O)\C=C\C1CC1 Amb18285135 [0,0,0,1,0,1|0,0,1]=3 7303 B8R1.35 OC(=O)\C=C\C1CO1 Amb24548089 [0,0,0,1,0,1|1,0,1]=4 7304 B8R1.35 [O-]S(=O)CCC1CC1 Amb25212503 [0,0,0,1,0,1|1,0,1]=4 7305 B8R1.51 CC1(C)C=CC(=O)N1 Amb25254168 [0,0,0,1,0,1|1,0,1]=4 7306 B8R1.51 CC1(C)C=CC(=O)O1 Amb24099124 [0,0,0,1,0,1|0,0,1]=3 7307 B8R1.51 CC1(C)CC(=O)CC1 Amb19516867 [0,0,0,1,0,1|1,0,0]=3 7308 B8R1.51 CC1(C)CC(=O)CN1 Amb24460323 [0,0,0,1,0,1|1,0,0]=3 7309 B8R1.51 CC1(C)CC(=O)CO1 Amb24083194 [0,0,0,1,0,1|1,0,0]=3 7310 B8R1.51 CC1(C)CC(=O)CS1 Amb21964095 [0,0,0,1,0,1|1,0,0]=3 7311 B8R1.51 CC1(C)CC(=O)NN1 Amb22289371 [0,0,0,1,0,1|2,0,0]=4 7312 B8R1.51 CC1(C)CC(O)CC1 Amb22549345 [0,0,0,1,0,1|1,0,1]=4 7313 B8R1.51 CC1(C)CC(O)CN1 Amb25722225 [0,0,0,1,0,1|1,0,1]=4 7314 B8R1.51 CC1(C)CC(O)CO1 Amb25296086 [0,0,0,1,0,1|1,0,1]=4 7315 B8R1.51 CC1(C)CCC(=N)N1 Amb25733497 [0,0,0,1,0,1|2,0,0]=4 7316 B8R1.51 CC1(C)CCC(=S)N1 Amb25827545 [0,0,0,1,0,1|1,1,0]=4 7317 B8R1.51 CC1(C)CN=C(N)C1 Amb24568278 [0,0,0,1,0,1|2,0,0]=4 7318 B8R1.51 CC1(C)CN=C(N)N1 Amb24454073 [0,0,0,1,0,1|2,0,0]=4 7319 B8R1.51 CC1(C)CN=C(N)O1 Amb25720624 [0,0,0,1,0,1|1,0,0]=3 7320 B8R1.51 CC1(C)COC(=O)C1 Amb22284870 [0,0,0,1,0,1|1,0,0]=3 7321 B8R1.51 CC1(C)COC(=O)N1 Amb19516997 [0,0,0,1,0,1|1,0,0]=3 7322 B8R1.51 CC1(C)COC(=O)O1 Amb24404748 [0,0,0,1,0,1|0,0,0]=2 7323 B8R1.51 CC1(C)COC(Br)=N1 Amb25185353 [0,0,0,1,0,1|2,0,0]=4 7324 B8R1.51 CC1(C)COC(N)=N1 Amb22732038 [0,0,0,1,0,1|2,0,0]=4 7325 B8R1.51 CC1(C)COC(O)C1 Amb24717478 [0,0,0,1,0,1|1,0,1]=4 7326 B8R1.51 CC1(C)CSC(=O)O1 Amb24357776 [0,0,0,1,0,1|0,0,0]=2 7327 B8R1.51 CC1(C)CSC(=S)N1 Amb25189019 [0,0,0,1,0,1|1,1,0]=4 7328 B8R1.51 CC1(C)NC(=O)CO1 Amb25254094 [0,0,0,1,0,1|1,0,0]=3 7329 B8R1.51 CC1(C)NC(=O)N=N1 Amb24481503 [0,0,0,1,0,1|2,0,0]=4 7330 B8R1.51 CC1(C)NC(=O)NN1 Amb25835118 [0,0,0,1,0,1|2,0,0]=4 7331 B8R1.51 CC1(C)NCC(=S)N1 Amb25068482 [0,0,0,1,0,1|1,1,0]=4 7332 B8R1.51 CC1(F)CNC(=O)C1 Amb24454478 [0,0,0,1,0,1|2,0,0]=4 7333 B8R1.51 CC1(N)COC(=O)C1 Amb25288591 [0,0,0,1,0,1|2,0,0]=4 7334 B8R1.51 CC1(O)CC(=O)CC1 Amb25129578 [0,0,0,1,0,1|2,0,0]=4 7335 B8R1.51 CC1(O)CCC(=O)N1 Amb24483013 [0,0,0,1,0,1|2,0,0]=4 7336 B8R1.51 CC1(O)CCC(=O)O1 Amb22338334 [0,0,0,1,0,1|1,0,0]=3 7337 B8R1.51 CC1CC(C)(O)CS1 Amb24332391 [0,0,0,1,0,1|1,0,1]=4 7338 B8R1.51 CC1CCS(=O)(=O)C1 Amb2548451 [0,0,0,1,0,1|1,0,1]=4 7339 B8R1.51 CC1CNS(=O)(=O)C1 Amb24117862 [0,0,0,1,0,1|1,0,1]=4 7340 B8R1.51 CC1COC(C)(C)O1 Amb17674077 [0,0,0,1,0,1|1,0,1]=4 7341 B8R1.51 CC1NCC(O1)(C)C Amb17506152 [0,0,0,1,0,1|1,0,1]=4 7342 B8R1.51 CC=1CNC(C)(C)C1 Amb25104519 [0,0,0,1,0,1|2,0,0]=4 7343 B8R1.51 CC=1CSC(C)(C)N1 Amb24733807 [0,0,0,1,0,1|2,0,0]=4 7344 B8R1.51 CP1(=O)CCC(=O)O1 Amb22228817 [0,0,0,1,0,1|2,0,0]=4 7345 B8R1.51 C[C@@]1(O)CNC(=O)C1 Amb24672065 [0,0,0,1,0,1|2,0,0]=4 7346 B8R1.51 C[N+]1(C)CC(=O)CC1 Amb25735729 [0,0,0,1,0,1|2,0,0]=4 7347 B8R1.51 NC1CP(O)(=O)CC1 Amb25231215 [0,0,0,1,0,1|2,0,0]=4 7348 B8R1.51 O=C1C=CC(C1)(C)C Amb15693471 [0,0,0,1,0,1|1,0,1]=4 7349 B8R1.51 O=C1CCC(O1)([2H])[2H] Amb17610398 [0,0,0,1,0,1|2,0,0]=4 7350 B8R1.51 O=C1COC(O1)(C)C Amb10601611 [0,0,0,1,0,1|0,0,0]=2 7351 B8R1.51 O=C1NCC(O1)(C)C Amb16202554 [0,0,0,1,0,1|0,0,0]=2 7352 B8R1.51 O=C1OCC(F)(F)O1 Amb24332045 [0,0,0,1,0,1|2,0,0]=4 7353 B8R1.51 OC1=N[N+](CC1)(C)C Amb10777461 [0,0,0,1,0,1|2,0,0]=4 7354 B8R1.69 CC1(C)CCC1(C)O Amb25052578 [0,0,0,1,0,1|1,0,1]=4 7355 B8R1.69 CC1(C)CCS1(=O)=O Amb22365064 [0,0,0,1,0,1|1,0,1]=4 7356 B8R1.77 CC(=O)C1=CC1(C)C Amb24456677 [0,0,0,1,0,1|1,0,1]=4 7357 B8R1.77 CC(=O)C1CC1(C)C Amb22011884 [0,0,0,1,0,1|1,0,0]=3 7358 B8R1.77 CC(O)C1CC1(C)C Amb25859391 [0,0,0,1,0,1|1,0,1]=4 7359 B8R1.77 CC(O)[C@H]1CC1(C)C Amb25185137 [0,0,0,1,0,1|1,0,1]=4 7360 B8R1.77 CC1(C)C=C1C(O)=O Amb24746031 [0,0,0,1,0,1|0,0,1]=3 7361 B8R1.77 CC1(C)NC1C(O)=O Amb23401629 [0,0,0,1,0,1|0,0,0]=2 7362 B8R1.77 CC1(C)OC1C(N)=O Amb25324328 [0,0,0,1,0,1|1,0,0]=3 7363 B8R1.77 CC1(C)OC1C(O)=O Amb24481352 [0,0,0,1,0,1|0,0,0]=2 7364 B8R1.77 CC1(C)ON1C(N)=O Amb25745268 [0,0,0,1,0,1|2,0,0]=4 7365 B8R1.77 CC1(C)S[C@H]1C(O)=O Amb24445654 [0,0,0,1,0,1|0,0,0]=2 7366 B8R1.77 CC1(Cl)CC1C(O)=O Amb24629731 [0,0,0,1,0,1|1,0,0]=3 7367 B8R1.77 C[C@@H](O)C1CC1(C)C Amb25074915 [0,0,0,1,0,1|1,0,1]=4 7368 B8R1.77 ClC(=O)C1CC1(C)C Amb16230811 [0,0,0,1,0,1|1,0,0]=3 7369 B8R1.77 NC(=O)[C@@H]1CC1(C)C Amb10072071 [0,0,0,1,0,1|1,0,0]=3 7370 B8R1.77 OC(=O)C1CC1(Br)Br Amb24651946 [0,0,0,1,0,1|2,0,0]=4 7371 B8R1.77 OC(=O)C1CC1(Cl)Cl Amb1106460 [0,0,0,1,0,1|2,0,0]=4 7372 B8R1.77 OC(=O)C1CC1(F)Cl Amb10841879 [0,0,0,1,0,1|2,0,0]=4 7373 B8R1.1 BrCC1=CC(=O)OC1 Amb17935686 [0,1,0,1,0,0|0,0,2]=4 7374 B8R1.1 C#CC1COC(=O)O1 Amb25056381 [0,1,0,1,0,0|1,0,1]=4 7375 B8R1.1 C#C[C@@H]1COC(=O)N1 Amb23401461 [0,1,0,1,0,0|1,0,1]=4 7376 B8R1.1 C#C[C@H]1CC(=O)CC1 Amb24721679 [0,1,0,1,0,0|1,0,1]=4 7377 B8R1.1 C=CC1CNC(=O)C1 Amb25117425 [0,1,0,1,0,0|1,0,1]=4 7378 B8R1.1 C=CC1COC(=O)C1 Amb22232189 [0,1,0,1,0,0|0,0,1]=3 7379 B8R1.1 C=CC1COC(=O)O1 Amb17942789 [0,1,0,1,0,0|1,0,1]=4 7380 B8R1.1 C=C[C@@H]1COC(=O)C1 Amb22232075 [0,1,0,1,0,0|0,0,1]=3 7381 B8R1.1 C=C[C@H]1CC(=O)CC1 Amb24524536 [0,1,0,1,0,0|1,0,1]=4 7382 B8R1.1 C=C[C@H]1COC(=O)C1 Amb22232080 [0,1,0,1,0,0|0,0,1]=3 7383 B8R1.1 CC1=NC(CBr)CO1 Amb25138721 [0,1,0,1,0,0|2,0,0]=4 7384 B8R1.1 CC1=NC(CO)CO1 Amb24527624 [0,1,0,1,0,0|2,0,0]=4 7385 B8R1.1 CC1CC(CBr)CO1 Amb25077494 [0,1,0,1,0,0|1,0,1]=4 7386 B8R1.1 CC1CC(CC1)=NO Amb24394648 [0,1,0,1,0,0|1,0,0]=3 7387 B8R1.1 CC1CC(CC1)C=O Amb24483120 [0,1,0,1,0,0|1,0,1]=4 7388 B8R1.1 CC1CC(CC1)CO Amb22886865 [0,1,0,1,0,0|1,0,1]=4 7389 B8R1.1 CC1CC(CCl)CO1 Amb24630118 [0,1,0,1,0,0|1,0,1]=4 7390 B8R1.1 CC1CC(CO)NC1 Amb23441155 [0,1,0,1,0,0|1,0,1]=4 7391 B8R1.1 CC1CC(CO)OC1 Amb25856417 [0,1,0,1,0,0|0,0,2]=4 7392 B8R1.1 CC1CCC(C=O)=C1 Amb18641617 [0,1,0,1,0,0|1,0,1]=4 7393 B8R1.1 CC1CCC(CO)=C1 Amb24733187 [0,1,0,1,0,0|1,0,1]=4 7394 B8R1.1 CC1CCC(CO)=N1 Amb25721614 [0,1,0,1,0,0|2,0,0]=4 7395 B8R1.1 CC1CN(CC1)C=O Amb24406673 [0,1,0,1,0,0|2,0,0]=4 7396 B8R1.1 CC1COC(CCl)=N1 Amb25244383 [0,1,0,1,0,0|2,0,0]=4 7397 B8R1.1 CC=1CC(CO)CN1 Amb25204416 [0,1,0,1,0,0|2,0,0]=4 7398 B8R1.1 CC=1C[C@H](CO)CC1 Amb24481425 [0,1,0,1,0,0|2,0,0]=4 7399 B8R1.1 CCC1CC(=O)C=C1 Amb25713811 [0,1,0,1,0,0|1,0,1]=4 7400 B8R1.1 CCC1CC(=O)CC1 Amb19267107 [0,1,0,1,0,0|1,0,0]=3 7401 B8R1.1 CCC1CC(=O)CS1 Amb25273070 [0,1,0,1,0,0|2,0,0]=4 7402 B8R1.1 CCC1CCC(=O)N1 Amb19516715 [0,1,0,1,0,0|2,0,0]=4 7403 B8R1.1 CCC1CCC(O)C1 Amb24471617 [0,1,0,1,0,0|1,0,1]=4 7404 B8R1.1 CCC1CNC(=O)C1 Amb10608005 [0,1,0,1,0,0|1,0,0]=3 7405 B8R1.1 CCC1CNC(=O)N1 Amb17506855 [0,1,0,1,0,0|2,0,0]=4 7406 B8R1.1 CCC1COC(=O)N1 Amb19516988 [0,1,0,1,0,0|1,0,0]=3 7407 B8R1.1 CCC1COC(N)=N1 Amb24436270 [0,1,0,1,0,0|2,0,0]=4 7408 B8R1.1 CCC=1CC(=O)OC1 Amb24759211 [0,1,0,1,0,0|0,0,2]=4 7409 B8R1.1 CCC=1COC(=O)C1 Amb24686984 [0,1,0,1,0,0|0,0,2]=4 7410 B8R1.1 CC[C@@H]1CC(=O)CC1 Amb25142670 [0,1,0,1,0,0|1,0,0]=3 7411 B8R1.1 CC[C@@H]1CC[C@@H](O)C1 Amb24587422 [0,1,0,1,0,0|1,0,1]=4 7412 B8R1.1 CC[C@@H]1CNC(=O)C1 Amb25367322 [0,1,0,1,0,0|1,0,0]=3 7413 B8R1.1 CC[C@@H]1CNC(=O)O1 Amb24507830 [0,1,0,1,0,0|2,0,0]=4 7414 B8R1.1 CC[C@H]1CC(=O)CC1 Amb24614252 [0,1,0,1,0,0|1,0,0]=3 7415 B8R1.1 CC[C@H]1CCC(=O)O1 Amb25795415 [0,1,0,1,0,0|2,0,0]=4 7416 B8R1.1 CC[C@H]1CNC(=O)C1 Amb24632784 [0,1,0,1,0,0|1,0,0]=3 7417 B8R1.1 CN1CN\C(\C1)=N/O Amb24680943 [0,1,0,1,0,0|2,0,0]=4 7418 B8R1.1 CNC1CNC(=O)C1 Amb25851765 [0,1,0,1,0,0|1,0,0]=3 7419 B8R1.1 CNC=1CC(=O)OC1 Amb25779165 [0,1,0,1,0,0|0,0,2]=4 7420 B8R1.1 COC1=CCC(C)N1 Amb24481331 [0,1,0,1,0,0|2,0,0]=4 7421 B8R1.1 COC1CC(=O)C=C1 Amb24425404 [0,1,0,1,0,0|1,0,1]=4 7422 B8R1.1 COC1CC(=O)CC1 Amb24483163 [0,1,0,1,0,0|1,0,0]=3 7423 B8R1.1 COC1CCC(=O)N1 Amb17617087 [0,1,0,1,0,0|2,0,0]=4 7424 B8R1.1 COC1CNC(=O)C1 Amb24683870 [0,1,0,1,0,0|1,0,0]=3 7425 B8R1.1 COC1COC(=O)N1 Amb24372259 [0,1,0,1,0,0|1,0,0]=3 7426 B8R1.1 CO[C@@H]1CC[C@@H](O)C1 Amb25283262 [0,1,0,1,0,0|1,0,1]=4 7427 B8R1.1 CO[C@H]1CC(=O)C=C1 Amb25689601 [0,1,0,1,0,0|1,0,1]=4 7428 B8R1.1 C[C@@H]1CCC(C=O)=C1 Amb25839230 [0,1,0,1,0,0|1,0,1]=4 7429 B8R1.1 C[C@@H]1C[C@H](CO)CO1 Amb25176664 [0,1,0,1,0,0|1,0,1]=4 7430 B8R1.1 C[C@@H]1C[C@H](CO)NC1 Amb22886264 [0,1,0,1,0,0|1,0,1]=4 7431 B8R1.1 C[C@H]1CC(CC1)C=O Amb24483030 [0,1,0,1,0,0|1,0,1]=4 7432 B8R1.1 C[C@H]1CC(CC1)CO Amb25676567 [0,1,0,1,0,0|1,0,1]=4 7433 B8R1.1 C[C@H]1CCC(C=O)=C1 Amb25760068 [0,1,0,1,0,0|1,0,1]=4 7434 B8R1.1 ClCC1CCC(=O)O1 Amb10608418 [0,1,0,1,0,0|2,0,0]=4 7435 B8R1.1 ClCC1CNC(=O)O1 Amb1152954 [0,1,0,1,0,0|2,0,0]=4 7436 B8R1.1 N#CC1CC(=O)CC1 Amb22886979 [0,1,0,1,0,0|1,0,1]=4 7437 B8R1.1 NC1=NC(CO)CO1 Amb25233954 [0,1,0,1,0,0|2,0,0]=4 7438 B8R1.1 NCC1CC(=O)CC1 Amb24644946 [0,1,0,1,0,0|1,0,0]=3 7439 B8R1.1 NCC1CC=C(Cl)C1 Amb23594525 [0,1,0,1,0,0|2,0,0]=4 7440 B8R1.1 NCC1CCC(=O)N1 Amb19330383 [0,1,0,1,0,0|2,0,0]=4 7441 B8R1.1 NCC1CCC(=O)N1 Amb2154785 [0,1,0,1,0,0|2,0,0]=4 7442 B8R1.1 NCC1CCC(=O)O1 Amb24482045 [0,1,0,1,0,0|2,0,0]=4 7443 B8R1.1 NCC1CCC(O)C1 Amb18641846 [0,1,0,1,0,0|1,0,1]=4 7444 B8R1.1 NCC1CCC(O)C1 Amb22886211 [0,1,0,1,0,0|1,0,1]=4 7445 B8R1.1 NCC1CNC(=O)C1 Amb22899752 [0,1,0,1,0,0|1,0,0]=3 7446 B8R1.1 NCC1CNC(=O)O1 Amb17506099 [0,1,0,1,0,0|2,0,0]=4 7447 B8R1.1 NCC1CNC(=O)O1 Amb23439310 [0,1,0,1,0,0|2,0,0]=4 7448 B8R1.1 NCC1COC(=O)C1 Amb22642236 [0,1,0,1,0,0|0,0,0]=2 7449 B8R1.1 NCC1CSC(=O)O1 Amb25843341 [0,1,0,1,0,0|1,1,0]=4 7450 B8R1.1 NCC=1CC(=O)ON1 Amb18833041 [0,1,0,1,0,0|1,0,1]=4 7451 B8R1.1 NCC=1COC(=O)C1 Amb24634773 [0,1,0,1,0,0|0,0,2]=4 7452 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb22746678 [0,1,0,1,0,0|2,0,0]=4 7453 B8R1.1 NC[C@@H]1CCC(=O)O1 Amb24656037 [0,1,0,1,0,0|2,0,0]=4 7454 B8R1.1 NC[C@@H]1CC[C@@H](C1)O Amb10066982 [0,1,0,1,0,0|1,0,1]=4 7455 B8R1.1 NC[C@@H]1CC[C@H](C1)O Amb10066974 [0,1,0,1,0,0|1,0,1]=4 7456 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439750 [0,1,0,1,0,0|1,0,0]=3 7457 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439751 [0,1,0,1,0,0|1,0,0]=3 7458 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb24183560 [0,1,0,1,0,0|2,0,0]=4 7459 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb25127772 [0,1,0,1,0,0|2,0,0]=4 7460 B8R1.1 NC[C@H]1CC(O)=NO1 Amb25334789 [0,1,0,1,0,0|2,0,0]=4 7461 B8R1.1 NC[C@H]1CCC(=O)O1 Amb24376645 [0,1,0,1,0,0|2,0,0]=4 7462 B8R1.1 NC[C@H]1CC[C@@H](C1)O Amb10066981 [0,1,0,1,0,0|1,0,1]=4 7463 B8R1.1 NC[C@H]1CC[C@H](C1)O Amb10066975 [0,1,0,1,0,0|1,0,1]=4 7464 B8R1.1 O=C1C=C(CCl)CO1 Amb24481317 [0,1,0,1,0,0|0,0,2]=4 7465 B8R1.1 O=C1C=C(CF)CO1 Amb23556961 [0,1,0,1,0,0|0,0,2]=4 7466 B8R1.1 O=C1CC(CBr)CC1 Amb24483273 [0,1,0,1,0,0|1,0,0]=3 7467 B8R1.1 O=C1CC(CBr)CN1 Amb23597459 [0,1,0,1,0,0|1,0,0]=3 7468 B8R1.1 O=C1CC(CCl)CO1 Amb25367200 [0,1,0,1,0,0|0,0,0]=2 7469 B8R1.1 O=C1CC(CF)CO1 Amb23557063 [0,1,0,1,0,0|0,0,0]=2 7470 B8R1.1 O=C1CC(CI)CN1 Amb25031171 [0,1,0,1,0,0|1,0,0]=3 7471 B8R1.1 O=C1CCC(CBr)N1 Amb22492782 [0,1,0,1,0,0|2,0,0]=4 7472 B8R1.1 O=C1CCC(CBr)O1 Amb22587611 [0,1,0,1,0,0|2,0,0]=4 7473 B8R1.1 O=C1CCC(CCl)N1 Amb25125270 [0,1,0,1,0,0|2,0,0]=4 7474 B8R1.1 O=C1CCC(CI)O1 Amb25718848 [0,1,0,1,0,0|2,0,0]=4 7475 B8R1.1 O=C1CC[C@@H](CBr)O1 Amb24483198 [0,1,0,1,0,0|2,0,0]=4 7476 B8R1.1 O=C1CC[C@@H](CF)N1 Amb19148412 [0,1,0,1,0,0|2,0,0]=4 7477 B8R1.1 O=C1C[C@@H](CF)CO1 Amb22746494 [0,1,0,1,0,0|0,0,0]=2 7478 B8R1.1 O=C1C[C@H](CBr)CO1 Amb24429041 [0,1,0,1,0,0|0,0,0]=2 7479 B8R1.1 O=C1C[C@H](CF)CO1 Amb24626048 [0,1,0,1,0,0|0,0,0]=2 7480 B8R1.1 O=C1NCC(CBr)O1 Amb24530204 [0,1,0,1,0,0|2,0,0]=4 7481 B8R1.1 O=C1NCC(CS)O1 Amb25725846 [0,1,0,1,0,0|2,0,0]=4 7482 B8R1.1 O=C1NC[C@@H](CCl)O1 Amb22232513 [0,1,0,1,0,0|2,0,0]=4 7483 B8R1.1 O=C1NC[C@H](CCl)O1 Amb25077275 [0,1,0,1,0,0|2,0,0]=4 7484 B8R1.1 O=C1N[C@@H](CI)CO1 Amb22746832 [0,1,0,1,0,0|1,0,0]=3 7485 B8R1.1 O=C1OC[C@H](CCl)O1 Amb25234049 [0,1,0,1,0,0|1,0,0]=3 7486 B8R1.1 O=C1SCC(CBr)S1 Amb24376514 [0,1,0,1,0,0|1,1,0]=4 7487 B8R1.1 O=CC1CC(=O)CC1 Amb18124240 [0,1,0,1,0,0|1,0,1]=4 7488 B8R1.1 O=CC1CC(Br)CO1 Amb22730623 [0,1,0,1,0,0|1,0,1]=4 7489 B8R1.1 O=CC1CNC(=O)C1 Amb24435979 [0,1,0,1,0,0|1,0,1]=4 7490 B8R1.1 O=C[C@@H]1CC(=O)CC1 Amb24481518 [0,1,0,1,0,0|1,0,1]=4 7491 B8R1.1 O=C[C@@H]1CNC(=O)C1 Amb24377645 [0,1,0,1,0,0|1,0,1]=4 7492 B8R1.1 O=C[C@H]1CC(=O)CC1 Amb25759704 [0,1,0,1,0,0|1,0,1]=4 7493 B8R1.1 O=S1OCC(CCl)O1 Amb24624110 [0,1,0,1,0,0|2,0,0]=4 7494 B8R1.1 O=S1OCC(CF)O1 Amb21951909 [0,1,0,1,0,0|2,0,0]=4 7495 B8R1.1 O=S1OC[C@@H](CBr)O1 Amb25834609 [0,1,0,1,0,0|2,0,0]=4 7496 B8R1.1 O=S1OC[C@H](CBr)O1 Amb24654743 [0,1,0,1,0,0|2,0,0]=4 7497 B8R1.1 O=S1OC[C@H](CCl)O1 Amb24353584 [0,1,0,1,0,0|2,0,0]=4 7498 B8R1.1 OC1CC(CC1)CS Amb25853014 [0,1,0,1,0,0|1,0,1]=4 7499 B8R1.1 OC1CCC(C1)CO Amb22168730 [0,1,0,1,0,0|1,0,1]=4 7500 B8R1.1 OC=1OC(CCl)CP1 Amb24481387 [0,1,0,1,0,0|2,0,0]=4 7501 B8R1.1 OCC1CC(=O)CC1 Amb22168734 [0,1,0,1,0,0|1,0,0]=3 7502 B8R1.1 OCC1CC(=O)CO1 Amb24117838 [0,1,0,1,0,0|2,0,0]=4 7503 B8R1.1 OCC1CC=C(Cl)C1 Amb23594524 [0,1,0,1,0,0|2,0,0]=4 7504 B8R1.1 OCC1CCC(=O)N1 Amb1162732 [0,1,0,1,0,0|2,0,0]=4 7505 B8R1.1 OCC1CCC(=O)O1 Amb20240701 [0,1,0,1,0,0|2,0,0]=4 7506 B8R1.1 OCC1CNC(=O)S1 Amb25349662 [0,1,0,1,0,0|2,0,0]=4 7507 B8R1.1 OCC1CNC(O)=N1 Amb24602100 [0,1,0,1,0,0|2,0,0]=4 7508 B8R1.1 OCC1COC(=O)C1 Amb22886806 [0,1,0,1,0,0|0,0,0]=2 7509 B8R1.1 OCC1COC(=O)N1 Amb22410779 [0,1,0,1,0,0|1,0,0]=3 7510 B8R1.1 OCC1COC(=S)O1 Amb24353008 [0,1,0,1,0,0|1,1,0]=4 7511 B8R1.1 OCC1COP(=O)O1 Amb24475979 [0,1,0,1,0,0|2,0,0]=4 7512 B8R1.1 OCC1COS(=O)O1 Amb25802802 [0,1,0,1,0,0|2,0,0]=4 7513 B8R1.1 OCC=1COC(=O)C1 Amb23557062 [0,1,0,1,0,0|0,0,2]=4 7514 B8R1.1 OC[C@@H]1CC(=O)C=C1 Amb25373368 [0,1,0,1,0,0|1,0,1]=4 7515 B8R1.1 OC[C@@H]1CC(=O)CC1 Amb22748084 [0,1,0,1,0,0|1,0,0]=3 7516 B8R1.1 OC[C@@H]1CCC(=O)N1 Amb2371840 [0,1,0,1,0,0|2,0,0]=4 7517 B8R1.1 OC[C@@H]1CCC(=O)S1 Amb24372061 [0,1,0,1,0,0|2,0,0]=4 7518 B8R1.1 OC[C@@H]1CNC(=O)C1 Amb25745471 [0,1,0,1,0,0|1,0,0]=3 7519 B8R1.1 OC[C@@H]1CNC(=O)O1 Amb24183552 [0,1,0,1,0,0|2,0,0]=4 7520 B8R1.1 OC[C@@H]1COC(=O)C1 Amb24414055 [0,1,0,1,0,0|0,0,0]=2 7521 B8R1.1 OC[C@@H]1COS(=O)O1 Amb24748538 [0,1,0,1,0,0|2,0,0]=4 7522 B8R1.1 OC[C@H]1CC(=O)C=C1 Amb25093663 [0,1,0,1,0,0|1,0,1]=4 7523 B8R1.1 OC[C@H]1CC(=O)CC1 Amb24532129 [0,1,0,1,0,0|1,0,0]=3 7524 B8R1.1 OC[C@H]1CCC(=O)S1 Amb25823343 [0,1,0,1,0,0|2,0,0]=4 7525 B8R1.1 OC[C@H]1CNC(=O)C1 Amb24515579 [0,1,0,1,0,0|1,0,0]=3 7526 B8R1.1 OC[C@H]1CNC(=O)O1 Amb22737250 [0,1,0,1,0,0|2,0,0]=4 7527 B8R1.1 OC[C@H]1CSC(=O)N1 Amb24697600 [0,1,0,1,0,0|1,1,0]=4 7528 B8R1.1 O[C@@H]1CC[C@H](C1)CO Amb22748539 [0,1,0,1,0,0|1,0,1]=4 7529 B8R1.1 O[C@H]1CC[C@@H](C1)CO Amb24544575 [0,1,0,1,0,0|1,0,1]=4 7530 B8R1.1 O[C@H]1CC[C@H](C1)CO Amb24619136 [0,1,0,1,0,0|1,0,1]=4 7531 B8R1.1 O[C@H]1CON(C1)C=O Amb25364785 [0,1,0,1,0,0|2,0,0]=4 7532 B8R1.4 CC1CC(=C)CCC1 Amb25237522 [0,1,0,1,0,0|2,0,0]=4 7533 B8R1.4 CC1CC(=C)CCO1 Amb25235098 [0,1,0,1,0,0|2,0,0]=4 7534 B8R1.4 CC1CC(=N)NCC1 Amb19930463 [0,1,0,1,0,0|2,0,0]=4 7535 B8R1.4 CC1CC(=O)C=CO1 Amb25173826 [0,1,0,1,0,0|1,0,1]=4 7536 B8R1.4 CC1CC(=O)C=CS1 Amb25053096 [0,1,0,1,0,0|1,0,1]=4 7537 B8R1.4 CC1CC(=O)CC=C1 Amb25713549 [0,1,0,1,0,0|1,0,1]=4 7538 B8R1.4 CC1CC(=O)CCN1 Amb19515809 [0,1,0,1,0,0|1,0,0]=3 7539 B8R1.4 CC1CC(=O)CCO1 Amb18833037 [0,1,0,1,0,0|1,0,0]=3 7540 B8R1.4 CC1CC(=O)NC=C1 Amb24745438 [0,1,0,1,0,0|1,0,1]=4 7541 B8R1.4 CC1CC(=O)NCC1 Amb20668125 [0,1,0,1,0,0|1,0,0]=3 7542 B8R1.4 CC1CC(Br)OCC1 Amb24433110 [0,1,0,1,0,0|1,0,1]=4 7543 B8R1.4 CC1CC(C)=CCN1 Amb25352197 [0,1,0,1,0,0|2,0,0]=4 7544 B8R1.4 CC1CC(Cl)OCC1 Amb24693934 [0,1,0,1,0,0|1,0,1]=4 7545 B8R1.4 CC1CC(N)=NCC1 Amb22496716 [0,1,0,1,0,0|2,0,0]=4 7546 B8R1.4 CC1CC(O)CCO1 Amb22757197 [0,1,0,1,0,0|1,0,1]=4 7547 B8R1.4 CC1CC(O)CNC1 Amb24507417 [0,1,0,1,0,0|1,0,1]=4 7548 B8R1.4 CC1CC(O)CSC1 Amb23568717 [0,1,0,1,0,0|0,1,1]=4 7549 B8R1.4 CC1CC=CC(=O)O1 Amb22173905 [0,1,0,1,0,0|2,0,0]=4 7550 B8R1.4 CC1CC=NC(=O)N1 Amb24580624 [0,1,0,1,0,0|2,0,0]=4 7551 B8R1.4 CC1CCCC(=O)C1 Amb1151295 [0,1,0,1,0,0|1,0,0]=3 7552 B8R1.4 CC1CCCC(=O)N1 Amb22372271 [0,1,0,1,0,0|2,0,0]=4 7553 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [0,1,0,1,0,0|2,0,0]=4 7554 B8R1.4 CC1CCNC(=N)C1 Amb17616048 [0,1,0,1,0,0|2,0,0]=4 7555 B8R1.4 CC1CCOC(=O)C1 Amb15693478 [0,1,0,1,0,0|0,0,0]=2 7556 B8R1.4 CC1CCOC(=S)N1 Amb24548582 [0,1,0,1,0,0|1,1,0]=4 7557 B8R1.4 CC1CNCC(=O)N1 Amb22587525 [0,1,0,1,0,0|2,0,0]=4 7558 B8R1.4 CC1COCC(=O)C1 Amb24431094 [0,1,0,1,0,0|0,0,0]=2 7559 B8R1.4 CC1COCC(=O)N1 Amb10608100 [0,1,0,1,0,0|1,0,0]=3 7560 B8R1.4 CC1CS(=O)CCN1 Amb18124392 [0,1,0,1,0,0|2,0,0]=4 7561 B8R1.4 CC1CSCC(=O)C1 Amb23568711 [0,1,0,1,0,0|0,1,0]=3 7562 B8R1.4 CC1CSCC(=O)N1 Amb25131602 [0,1,0,1,0,0|1,1,0]=4 7563 B8R1.4 CC1NCCC(=O)C1 Amb1087926 [0,1,0,1,0,0|1,0,0]=3 7564 B8R1.4 CC=1CC(=O)NCC1 Amb25259208 [0,1,0,1,0,0|1,0,1]=4 7565 B8R1.4 CC=1CC(=O)OCC1 Amb24751502 [0,1,0,1,0,0|0,0,1]=3 7566 B8R1.4 CC=1COCC(=O)C1 Amb25065804 [0,1,0,1,0,0|0,0,2]=4 7567 B8R1.4 CN1CC(=O)CCC1 Amb22304741 [0,1,0,1,0,0|2,0,0]=4 7568 B8R1.4 CN1CC(=O)CCC1 Amb22490632 [0,1,0,1,0,0|2,0,0]=4 7569 B8R1.4 CN1CC(=O)NCC1 Amb19958159 [0,1,0,1,0,0|2,0,0]=4 7570 B8R1.4 CN1CC(=O)OCC1 Amb21963307 [0,1,0,1,0,0|1,0,0]=3 7571 B8R1.4 CN1CC(=O)OCC1 Amb22491652 [0,1,0,1,0,0|1,0,0]=3 7572 B8R1.4 CN1CCCC(=O)C1 Amb10602467 [0,1,0,1,0,0|2,0,0]=4 7573 B8R1.4 C[C@@H]1CC(=O)C=CO1 Amb22748948 [0,1,0,1,0,0|1,0,1]=4 7574 B8R1.4 C[C@@H]1CC(=O)CCC1 Amb22799724 [0,1,0,1,0,0|1,0,0]=3 7575 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb22748911 [0,1,0,1,0,0|1,0,0]=3 7576 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb23439312 [0,1,0,1,0,0|1,0,0]=3 7577 B8R1.4 C[C@@H]1CC(=O)CCO1 Amb23440042 [0,1,0,1,0,0|1,0,0]=3 7578 B8R1.4 C[C@@H]1CC(=O)NCC1 Amb25739591 [0,1,0,1,0,0|1,0,0]=3 7579 B8R1.4 C[C@@H]1CC=CC(=O)N1 Amb25062539 [0,1,0,1,0,0|2,0,0]=4 7580 B8R1.4 C[C@@H]1CCCC(=O)N1 Amb25772093 [0,1,0,1,0,0|2,0,0]=4 7581 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22504491 [0,1,0,1,0,0|2,0,0]=4 7582 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22748720 [0,1,0,1,0,0|2,0,0]=4 7583 B8R1.4 C[C@@H]1COCC(=O)C1 Amb25746655 [0,1,0,1,0,0|0,0,0]=2 7584 B8R1.4 C[C@@H]1COCC(=O)N1 Amb15693112 [0,1,0,1,0,0|1,0,0]=3 7585 B8R1.4 C[C@@H]1CS(=O)CCN1 Amb24695988 [0,1,0,1,0,0|2,0,0]=4 7586 B8R1.4 C[C@@H]1C[C@@H](O)CCO1 Amb22753040 [0,1,0,1,0,0|1,0,1]=4 7587 B8R1.4 C[C@@H]1C[C@@H](O)CCS1 Amb24515322 [0,1,0,1,0,0|1,0,1]=4 7588 B8R1.4 C[C@@H]1C[C@H](Cl)OCC1 Amb24513485 [0,1,0,1,0,0|1,0,1]=4 7589 B8R1.4 C[C@@H]1C[C@H](O)C=CC1 Amb24614891 [0,1,0,1,0,0|1,0,1]=4 7590 B8R1.4 C[C@@H]1C[C@H](O)CCC1 Amb22800307 [0,1,0,1,0,0|1,0,1]=4 7591 B8R1.4 C[C@@H]1C[C@H](O)CCN1 Amb22406182 [0,1,0,1,0,0|1,0,1]=4 7592 B8R1.4 C[C@@H]1C[C@H](O)CCN1 Amb23440188 [0,1,0,1,0,0|1,0,1]=4 7593 B8R1.4 C[C@@H]1C[C@H](O)CCO1 Amb22746391 [0,1,0,1,0,0|1,0,1]=4 7594 B8R1.4 C[C@H]1CC(=O)C=CN1 Amb25800362 [0,1,0,1,0,0|1,0,1]=4 7595 B8R1.4 C[C@H]1CC(=O)C=CO1 Amb24483279 [0,1,0,1,0,0|1,0,1]=4 7596 B8R1.4 C[C@H]1CC(=O)CCC1 Amb21618704 [0,1,0,1,0,0|1,0,0]=3 7597 B8R1.4 C[C@H]1CC(=O)CCN1 Amb22406027 [0,1,0,1,0,0|1,0,0]=3 7598 B8R1.4 C[C@H]1CC(O)OCC1 Amb25810643 [0,1,0,1,0,0|0,0,2]=4 7599 B8R1.4 C[C@H]1CC=CC(=O)C1 Amb25723295 [0,1,0,1,0,0|1,0,0]=3 7600 B8R1.4 C[C@H]1CC=CC(=O)N1 Amb25326479 [0,1,0,1,0,0|2,0,0]=4 7601 B8R1.4 C[C@H]1CC=CC(=O)O1 Amb24584842 [0,1,0,1,0,0|2,0,0]=4 7602 B8R1.4 C[C@H]1CCCC(=O)N1 Amb25327957 [0,1,0,1,0,0|2,0,0]=4 7603 B8R1.4 C[C@H]1CNCC(=O)N1 Amb22304821 [0,1,0,1,0,0|2,0,0]=4 7604 B8R1.4 C[C@H]1CNCC(=O)N1 Amb23385344 [0,1,0,1,0,0|2,0,0]=4 7605 B8R1.4 C[C@H]1COCC(=O)N1 Amb22232054 [0,1,0,1,0,0|1,0,0]=3 7606 B8R1.4 C[C@H]1C[C@@H](C)NCO1 Amb24515076 [0,1,0,1,0,0|1,0,1]=4 7607 B8R1.4 C[C@H]1C[C@@H](O)CCC1 Amb24713971 [0,1,0,1,0,0|1,0,1]=4 7608 B8R1.4 C[C@H]1C[C@@H](O)CCN1 Amb22406181 [0,1,0,1,0,0|1,0,1]=4 7609 B8R1.4 C[C@H]1C[C@@H](O)CCS1 Amb24515349 [0,1,0,1,0,0|1,0,1]=4 7610 B8R1.4 C[C@H]1C[C@H](O)CCC1 Amb24383351 [0,1,0,1,0,0|1,0,1]=4 7611 B8R1.4 C[C@H]1C[C@H](O)CCS1 Amb24515394 [0,1,0,1,0,0|1,0,1]=4 7612 B8R1.4 C[C@H]1C[C@H](O)CNC1 Amb25206204 [0,1,0,1,0,0|1,0,1]=4 7613 B8R1.4 NC1CC(=O)CCC1 Amb23440459 [0,1,0,1,0,0|2,0,0]=4 7614 B8R1.4 NC1CC(=O)NCC1 Amb19957631 [0,1,0,1,0,0|2,0,0]=4 7615 B8R1.4 NC1CC(=O)NCC1 Amb21960626 [0,1,0,1,0,0|2,0,0]=4 7616 B8R1.4 NC1CC(=O)OCC1 Amb18641823 [0,1,0,1,0,0|1,0,0]=3 7617 B8R1.4 NC1CCNC(=O)C1 Amb10067177 [0,1,0,1,0,0|2,0,0]=4 7618 B8R1.4 N[C@@H]1CC(=O)NCC1 Amb25168718 [0,1,0,1,0,0|2,0,0]=4 7619 B8R1.4 N[C@H]1CC(=O)OCC1 Amb24550653 [0,1,0,1,0,0|1,0,0]=3 7620 B8R1.4 O=C1CC(Cl)CNN1 Amb22728306 [0,1,0,1,0,0|2,0,0]=4 7621 B8R1.4 O=C1CC(F)CCC1 Amb24578309 [0,1,0,1,0,0|2,0,0]=4 7622 B8R1.4 O=C1CC(F)OCC1 Amb21927920 [0,1,0,1,0,0|2,0,0]=4 7623 B8R1.4 O=C1CC(I)CCC1 Amb24436778 [0,1,0,1,0,0|2,0,0]=4 7624 B8R1.4 O=C1CC(I)CCN1 Amb24387789 [0,1,0,1,0,0|2,0,0]=4 7625 B8R1.4 O=C1CC(I)CNN1 Amb25250615 [0,1,0,1,0,0|2,0,0]=4 7626 B8R1.4 O=C1CC(S)CCC1 Amb25205406 [0,1,0,1,0,0|2,0,0]=4 7627 B8R1.4 O=C1COCC(=O)C1 Amb22292040 [0,1,0,1,0,0|1,0,1]=4 7628 B8R1.4 O=C1COCC(=O)C1 Amb22406411 [0,1,0,1,0,0|1,0,1]=4 7629 B8R1.4 OC1CC(=O)CCC1 Amb22754759 [0,1,0,1,0,0|2,0,0]=4 7630 B8R1.4 OC1CC(=O)CCN1 Amb24746013 [0,1,0,1,0,0|2,0,0]=4 7631 B8R1.4 OC1CC(=O)OCC1 Amb24475154 [0,1,0,1,0,0|1,0,0]=3 7632 B8R1.4 OC1CCNC(=O)C1 Amb10602744 [0,1,0,1,0,0|2,0,0]=4 7633 B8R1.4 OC1CCNC(C1)C Amb1051141 [0,1,0,1,0,0|1,0,1]=4 7634 B8R1.4 O[C@@H]1CC(=O)NCC1 Amb22744924 [0,1,0,1,0,0|2,0,0]=4 7635 B8R1.4 O[C@@H]1CCNC(=O)C1 Amb17845212 [0,1,0,1,0,0|2,0,0]=4 7636 B8R1.4 O[C@H]1CC(=O)CCC1 Amb25320136 [0,1,0,1,0,0|2,0,0]=4 7637 B8R1.4 O[C@H]1CC(=O)OCC1 Amb25320391 [0,1,0,1,0,0|1,0,0]=3 7638 B8R1.4 [O-]C1COCC(=O)C1 Amb22739834 [0,1,0,1,0,0|1,0,0]=3 7639 B8R1.18 CC1=CC(=O)CC1Br Amb24552421 [0,1,0,1,0,0|2,0,0]=4 7640 B8R1.18 CC1=CC(=O)CC1Cl Amb24711398 [0,1,0,1,0,0|2,0,0]=4 7641 B8R1.18 CC1=CC(=O)CC1O Amb24633748 [0,1,0,1,0,0|2,0,0]=4 7642 B8R1.18 CC1=CC(=O)C[C@@H]1O Amb25093715 [0,1,0,1,0,0|2,0,0]=4 7643 B8R1.18 CC1=CC(=O)C[C@H]1O Amb24612700 [0,1,0,1,0,0|2,0,0]=4 7644 B8R1.18 CC1=CC(=O)OC1Br Amb25144076 [0,1,0,1,0,0|0,0,2]=4 7645 B8R1.18 CC1=CC(=O)OC1Cl Amb24601836 [0,1,0,1,0,0|0,0,2]=4 7646 B8R1.18 CC1=CC(=O)O[C@@H]1O Amb25185238 [0,1,0,1,0,0|0,0,2]=4 7647 B8R1.18 CC1=CC(C)CC1=O Amb25187953 [0,1,0,1,0,0|1,0,1]=4 7648 B8R1.18 CC1=C[C@@H](C)CC1=O Amb24725285 [0,1,0,1,0,0|1,0,1]=4 7649 B8R1.18 CC1C=C(O)C(=O)O1 Amb24332982 [0,1,0,1,0,0|1,0,1]=4 7650 B8R1.18 CC1CC(=O)C(=O)O1 Amb24524552 [0,1,0,1,0,0|1,0,1]=4 7651 B8R1.18 CC1CC(=O)C(Br)=C1 Amb24723854 [0,1,0,1,0,0|1,0,1]=4 7652 B8R1.18 CC1CC(=O)C(O)=C1 Amb25370657 [0,1,0,1,0,0|0,0,1]=3 7653 B8R1.18 CC1CC(=O)CN1C Amb20669273 [0,1,0,1,0,0|1,0,0]=3 7654 B8R1.18 CC1CC(=O)N(C1)C Amb10068268 [0,1,0,1,0,0|1,0,0]=3 7655 B8R1.18 CC1CC(=O)N(N1)C Amb16233050 [0,1,0,1,0,0|2,0,0]=4 7656 B8R1.18 CC1CC(=O)NC1=N Amb25039964 [0,1,0,1,0,0|1,0,1]=4 7657 B8R1.18 CC1CC(C)C(O)C1 Amb17674171 [0,1,0,1,0,0|1,0,1]=4 7658 B8R1.18 CC1CC(C)NC1=O Amb24698782 [0,1,0,1,0,0|2,0,0]=4 7659 B8R1.18 CC1CC(C)OC1O Amb25226270 [0,1,0,1,0,0|1,0,1]=4 7660 B8R1.18 CC1CC(Cl)=NN1C Amb24696905 [0,1,0,1,0,0|2,0,0]=4 7661 B8R1.18 CC1CC(O)C(=O)C1 Amb25143497 [0,1,0,1,0,0|0,0,0]=2 7662 B8R1.18 CC1CC(O)C(N)C1 Amb24677532 [0,1,0,1,0,0|1,0,1]=4 7663 B8R1.18 CC1CC(O)CC1=O Amb24752493 [0,1,0,1,0,0|2,0,0]=4 7664 B8R1.18 CC1CC(O)CC1N Amb25169593 [0,1,0,1,0,0|1,0,1]=4 7665 B8R1.18 CC1CC(O)CC1O Amb25055810 [0,1,0,1,0,0|1,0,1]=4 7666 B8R1.18 CC1CC(O)CN1C Amb23453942 [0,1,0,1,0,0|1,0,1]=4 7667 B8R1.18 CC1CN(C)CC1=O Amb20622328 [0,1,0,1,0,0|2,0,0]=4 7668 B8R1.18 CC1CN(C)OC1O Amb25129773 [0,1,0,1,0,0|2,0,0]=4 7669 B8R1.18 CC1C[C@@H](N)C(=O)O1 Amb24622840 [0,1,0,1,0,0|2,0,0]=4 7670 B8R1.18 CC1NC(=O)CC1C Amb20623595 [0,1,0,1,0,0|1,0,0]=3 7671 B8R1.18 CC1NC(=O)CC1S Amb24441528 [0,1,0,1,0,0|2,0,0]=4 7672 B8R1.18 CC1NC(=O)OC1=O Amb22236022 [0,1,0,1,0,0|1,0,1]=4 7673 B8R1.18 CC1NC(=S)CC1C Amb24532333 [0,1,0,1,0,0|1,1,0]=4 7674 B8R1.18 CC1OC(=O)CC1Cl Amb24483262 [0,1,0,1,0,0|1,0,0]=3 7675 B8R1.18 CC1OC(=O)NC1C Amb25747248 [0,1,0,1,0,0|1,0,0]=3 7676 B8R1.18 CC1OC(=O)NC1N Amb24568318 [0,1,0,1,0,0|2,0,0]=4 7677 B8R1.18 CC1OC(N)=NC1C Amb24452888 [0,1,0,1,0,0|2,0,0]=4 7678 B8R1.18 CC1SC(C)CC1=O Amb25735260 [0,1,0,1,0,0|2,0,0]=4 7679 B8R1.18 CC=1CC(=O)CC1C Amb25318947 [0,1,0,1,0,0|1,0,1]=4 7680 B8R1.18 CC=1OC(=O)CC1Br Amb25101107 [0,1,0,1,0,0|1,0,1]=4 7681 B8R1.18 CC=1OC(=O)NC1C Amb19516947 [0,1,0,1,0,0|1,0,1]=4 7682 B8R1.18 CC=1OC(=O)OC1C Amb19654027 [0,1,0,1,0,0|1,0,1]=4 7683 B8R1.18 CN1CC(=O)OC1=O Amb22734007 [0,1,0,1,0,0|1,0,1]=4 7684 B8R1.18 CN1CC(N)CC1=O Amb19373494 [0,1,0,1,0,0|2,0,0]=4 7685 B8R1.18 CN1CC(O)CC1=O Amb22059466 [0,1,0,1,0,0|2,0,0]=4 7686 B8R1.18 CN1C[C@@H](N)CC1=O Amb24401527 [0,1,0,1,0,0|2,0,0]=4 7687 B8R1.18 CN1C[C@H](O)CC1=O Amb25762416 [0,1,0,1,0,0|2,0,0]=4 7688 B8R1.18 C[C@@H]1CC(=O)C(Cl)=C1 Amb25821459 [0,1,0,1,0,0|1,0,1]=4 7689 B8R1.18 C[C@@H]1CC(=O)C[C@@H]1C Amb22230244 [0,1,0,1,0,0|1,0,0]=3 7690 B8R1.18 C[C@@H]1CC(=O)C[C@H]1C Amb24470272 [0,1,0,1,0,0|1,0,0]=3 7691 B8R1.18 C[C@@H]1CC(=O)N(C)C1 Amb24182041 [0,1,0,1,0,0|1,0,0]=3 7692 B8R1.18 C[C@@H]1CC(=O)NC1=O Amb25709913 [0,1,0,1,0,0|1,0,1]=4 7693 B8R1.18 C[C@@H]1CC(=O)OC1=O Amb25791861 [0,1,0,1,0,0|0,0,1]=3 7694 B8R1.18 C[C@@H]1C[C@@H](Cl)C(=O)O1 Amb25288126 [0,1,0,1,0,0|2,0,0]=4 7695 B8R1.18 C[C@@H]1C[C@@H](O)C(=C)O1 Amb25284313 [0,1,0,1,0,0|2,0,0]=4 7696 B8R1.18 C[C@@H]1C[C@@H](O)C(=O)O1 Amb24615353 [0,1,0,1,0,0|1,0,0]=3 7697 B8R1.18 C[C@@H]1C[C@@H](O)C[C@H]1O Amb25261754 [0,1,0,1,0,0|1,0,1]=4 7698 B8R1.18 C[C@@H]1C[C@H](Cl)C(=O)O1 Amb24596085 [0,1,0,1,0,0|2,0,0]=4 7699 B8R1.18 C[C@@H]1C[C@H](N)C(=O)O1 Amb24760900 [0,1,0,1,0,0|2,0,0]=4 7700 B8R1.18 C[C@@H]1C[C@H](O)C(=O)O1 Amb24519690 [0,1,0,1,0,0|1,0,0]=3 7701 B8R1.18 C[C@@H]1C[C@H](O)CC1=O Amb25236934 [0,1,0,1,0,0|2,0,0]=4 7702 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1O Amb24760967 [0,1,0,1,0,0|2,0,0]=4 7703 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1S Amb24586770 [0,1,0,1,0,0|2,0,0]=4 7704 B8R1.18 C[C@@H]1NC(=O)C[C@H]1C Amb24550340 [0,1,0,1,0,0|1,0,0]=3 7705 B8R1.18 C[C@@H]1NC(=O)C[C@H]1O Amb25203404 [0,1,0,1,0,0|2,0,0]=4 7706 B8R1.18 C[C@@H]1NC(=O)C[C@H]1S Amb24685136 [0,1,0,1,0,0|2,0,0]=4 7707 B8R1.18 C[C@@H]1NC(=O)N[C@@H]1C Amb25791194 [0,1,0,1,0,0|2,0,0]=4 7708 B8R1.18 C[C@@H]1OC(=N)N[C@@H]1C Amb24523145 [0,1,0,1,0,0|2,0,0]=4 7709 B8R1.18 C[C@@H]1OC(=O)CC1O Amb25332464 [0,1,0,1,0,0|1,0,0]=3 7710 B8R1.18 C[C@@H]1OC(=O)C[C@H]1C Amb24583426 [0,1,0,1,0,0|0,0,0]=2 7711 B8R1.18 C[C@@H]1OC(=O)C[C@H]1O Amb25328533 [0,1,0,1,0,0|1,0,0]=3 7712 B8R1.18 C[C@@H]1OC(=O)N[C@@H]1C Amb24601098 [0,1,0,1,0,0|1,0,0]=3 7713 B8R1.18 C[C@@H]1OC(=O)N[C@H]1C Amb24516825 [0,1,0,1,0,0|1,0,0]=3 7714 B8R1.18 C[C@@H]1OC(=S)N[C@H]1C Amb24746694 [0,1,0,1,0,0|1,1,0]=4 7715 B8R1.18 C[C@@H]1O[C@@H](O)C[C@H]1C Amb24597062 [0,1,0,1,0,0|0,0,2]=4 7716 B8R1.18 C[C@@H]1SC(=O)N[C@@H]1C Amb24606920 [0,1,0,1,0,0|1,1,0]=4 7717 B8R1.18 C[C@H]1C[C@@H](C)C(=O)C1 Amb24643266 [0,1,0,1,0,0|1,0,0]=3 7718 B8R1.18 C[C@H]1C[C@@H](O)C(=S)N1 Amb25259817 [0,1,0,1,0,0|1,1,0]=4 7719 B8R1.18 C[C@H]1C[C@H](Br)C(=O)O1 Amb25322131 [0,1,0,1,0,0|2,0,0]=4 7720 B8R1.18 C[C@H]1C[C@H](C)NC1=O Amb25174475 [0,1,0,1,0,0|2,0,0]=4 7721 B8R1.18 C[C@H]1C[C@H](N)C(=O)O1 Amb24538781 [0,1,0,1,0,0|2,0,0]=4 7722 B8R1.18 C[C@H]1OC(=O)C[C@@H]1C Amb25245321 [0,1,0,1,0,0|0,0,0]=2 7723 B8R1.18 C[C@H]1OC(=O)C[C@@H]1O Amb24577403 [0,1,0,1,0,0|1,0,0]=3 7724 B8R1.18 C[C@H]1OC(=O)C[C@H]1N Amb24619491 [0,1,0,1,0,0|1,0,0]=3 7725 B8R1.18 C[C@H]1OC(O)C[C@@H]1C Amb24616560 [0,1,0,1,0,0|0,0,2]=4 7726 B8R1.18 C[C@H]1O[C@H](C)CC1=O Amb25744762 [0,1,0,1,0,0|2,0,0]=4 7727 B8R1.18 NC1CC(=O)OC1=O Amb19929452 [0,1,0,1,0,0|1,0,1]=4 7728 B8R1.18 NC1CC(=O)OC1O Amb24745298 [0,1,0,1,0,0|1,0,0]=3 7729 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [0,1,0,1,0,0|1,0,1]=4 7730 B8R1.18 O=C1C=C(C(C1)C)C Amb16191977 [0,1,0,1,0,0|1,0,0]=3 7731 B8R1.18 O=C1CC(C(=O)N1)C Amb10609734 [0,1,0,1,0,0|1,0,1]=4 7732 B8R1.18 O=C1C[C@@H](Cl)[C@H](Cl)C1 Amb25139007 [0,1,0,1,0,0|2,0,0]=4 7733 B8R1.18 O=C1C[C@H](Cl)[C@@H](Cl)C1 Amb24515104 [0,1,0,1,0,0|2,0,0]=4 7734 B8R1.18 O=C1OC(=O)CC1Cl Amb24677749 [0,1,0,1,0,0|1,0,1]=4 7735 B8R1.18 O=C1OC(=O)C[C@@H]1Br Amb24558394 [0,1,0,1,0,0|1,0,1]=4 7736 B8R1.18 O=C1OC(=O)C[C@@H]1Cl Amb25837364 [0,1,0,1,0,0|1,0,1]=4 7737 B8R1.18 O=C1OC(Cl)C(Cl)O1 Amb20670724 [0,1,0,1,0,0|2,0,0]=4 7738 B8R1.18 O=C1O[C@@H](Cl)[C@H](Cl)O1 Amb25061412 [0,1,0,1,0,0|2,0,0]=4 7739 B8R1.18 OC1=CC(O)CC1=O Amb24736347 [0,1,0,1,0,0|1,0,1]=4 7740 B8R1.18 OC1CC(=O)CC1=O Amb24330382 [0,1,0,1,0,0|1,0,1]=4 7741 B8R1.18 OC1CC(=O)CC1O Amb25834386 [0,1,0,1,0,0|2,0,0]=4 7742 B8R1.18 OC1CC(=O)N(Br)C1 Amb25215402 [0,1,0,1,0,0|2,0,0]=4 7743 B8R1.18 O[C@@H]1CC(=O)OC1=O Amb25142904 [0,1,0,1,0,0|1,0,1]=4 7744 B8R1.29 CC1(C)CC(=O)C1=C Amb25322814 [0,1,0,1,0,0|1,0,0]=3 7745 B8R1.29 CC1(C)CC(Br)C1=O Amb25346948 [0,1,0,1,0,0|1,0,1]=4 7746 B8R1.29 CC1(C)C[C@H](O)[C@@H]1O Amb24542177 [0,1,0,1,0,0|0,0,2]=4 7747 B8R1.29 CC1(C)NC(=O)C1N Amb24416566 [0,1,0,1,0,0|1,0,0]=3 7748 B8R1.29 CC1(C)SC(=O)C1N Amb25836418 [0,1,0,1,0,0|0,1,0]=3 7749 B8R1.29 CC1=CC(C)(C)C1=O Amb24633449 [0,1,0,1,0,0|1,0,1]=4 7750 B8R1.29 CC1C(=O)NC1(C)C Amb22490971 [0,1,0,1,0,0|1,0,0]=3 7751 B8R1.31 CC(=O)C1CCN1C Amb25196048 [0,1,0,1,0,0|2,0,0]=4 7752 B8R1.31 CC(=O)C1COC1=O Amb24601316 [0,1,0,1,0,0|1,0,1]=4 7753 B8R1.31 CC(C)C1CSC1O Amb25058549 [0,1,0,1,0,0|0,1,1]=4 7754 B8R1.31 CC(C)C1OCC1=O Amb23456090 [0,1,0,1,0,0|0,0,0]=2 7755 B8R1.31 CC(O)C1CCC1=O Amb24363437 [0,1,0,1,0,0|2,0,0]=4 7756 B8R1.31 CC1CCC1C(=O)Cl Amb25123268 [0,1,0,1,0,0|1,0,0]=3 7757 B8R1.31 CC1CCC1C(C)=O Amb25101506 [0,1,0,1,0,0|1,0,0]=3 7758 B8R1.31 CC1CCC1C(C)O Amb25270791 [0,1,0,1,0,0|1,0,1]=4 7759 B8R1.31 CC1CCC1C(N)=O Amb24481452 [0,1,0,1,0,0|1,0,0]=3 7760 B8R1.31 CC1CCC1C(O)=O Amb21857447 [0,1,0,1,0,0|0,0,0]=2 7761 B8R1.31 CC1CCN1C(N)=O Amb24748909 [0,1,0,1,0,0|2,0,0]=4 7762 B8R1.31 CN(C)C1CCC1=O Amb25142634 [0,1,0,1,0,0|2,0,0]=4 7763 B8R1.31 CN1CCC1C(N)=O Amb22227962 [0,1,0,1,0,0|2,0,0]=4 7764 B8R1.31 CN1CCC1C(O)=O Amb22011586 [0,1,0,1,0,0|1,0,0]=3 7765 B8R1.31 CN1CC[C@@H]1C(O)=O Amb24183372 [0,1,0,1,0,0|1,0,0]=3 7766 B8R1.31 CN1CC[C@H]1C(O)=O Amb24699921 [0,1,0,1,0,0|1,0,0]=3 7767 B8R1.31 C[C@@H]1CC[C@H]1C(O)=O Amb25174793 [0,1,0,1,0,0|0,0,0]=2 7768 B8R1.31 C[C@@H]1CN[C@@H]1C(O)=O Amb24597629 [0,1,0,1,0,0|0,0,0]=2 7769 B8R1.31 C[C@H](O)[C@@H]1CNC1=O Amb25224413 [0,1,0,1,0,0|2,0,0]=4 7770 B8R1.31 C[C@H]1CC[C@@H]1C(O)=O Amb24561899 [0,1,0,1,0,0|0,0,0]=2 7771 B8R1.31 C[C@H]1CC[C@H]1C(O)=O Amb25259513 [0,1,0,1,0,0|0,0,0]=2 7772 B8R1.31 C[C@H]1CN[C@@H]1C(O)=O Amb24629618 [0,1,0,1,0,0|0,0,0]=2 7773 B8R1.31 NC(=O)C1CCC1Cl Amb24482516 [0,1,0,1,0,0|2,0,0]=4 7774 B8R1.31 NC(=O)[C@@H]1CC[C@@H]1Cl Amb25174435 [0,1,0,1,0,0|2,0,0]=4 7775 B8R1.31 NC(=O)[C@@H]1CC[C@H]1Cl Amb25024326 [0,1,0,1,0,0|2,0,0]=4 7776 B8R1.31 NC1CCC1C(N)=O Amb20248288 [0,1,0,1,0,0|2,0,0]=4 7777 B8R1.31 NC1COC1C(N)=O Amb25309396 [0,1,0,1,0,0|2,0,0]=4 7778 B8R1.31 NN1CCC1C(O)=O Amb25189887 [0,1,0,1,0,0|2,0,0]=4 7779 B8R1.31 N[C@@H]1CC[C@@H]1C(N)=O Amb24670123 [0,1,0,1,0,0|2,0,0]=4 7780 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24117048 [0,1,0,1,0,0|1,0,0]=3 7781 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24183584 [0,1,0,1,0,0|1,0,0]=3 7782 B8R1.31 N[C@@H]1CO[C@@H]1C(O)=O Amb24568133 [0,1,0,1,0,0|1,0,0]=3 7783 B8R1.31 N[C@@H]1CO[C@H]1C(O)=O Amb24681491 [0,1,0,1,0,0|1,0,0]=3 7784 B8R1.31 N[C@H]1CC[C@H]1C(N)=O Amb25326921 [0,1,0,1,0,0|2,0,0]=4 7785 B8R1.31 N[C@H]1CO[C@@H]1C(O)=O Amb25324265 [0,1,0,1,0,0|1,0,0]=3 7786 B8R1.31 O=C(Cl)C1CCC1Cl Amb25718688 [0,1,0,1,0,0|2,0,0]=4 7787 B8R1.31 O=C(Cl)[C@@H]1CC[C@@H]1Cl Amb25361006 [0,1,0,1,0,0|2,0,0]=4 7788 B8R1.31 OC(=O)C1C=CC1Cl Amb24482989 [0,1,0,1,0,0|1,0,1]=4 7789 B8R1.31 OC(=O)C1CCC1S Amb25830696 [0,1,0,1,0,0|1,0,0]=3 7790 B8R1.31 OC(=O)C1CNC1=O Amb24524290 [0,1,0,1,0,0|1,0,1]=4 7791 B8R1.31 OC(=O)[C@@H]1CC[C@@H]1Cl Amb24514834 [0,1,0,1,0,0|1,0,0]=3 7792 B8R1.31 OC(=O)[C@@H]1CC[C@H]1Cl Amb24580965 [0,1,0,1,0,0|1,0,0]=3 7793 B8R1.31 OC1CCC1C(O)=O Amb24481384 [0,1,0,1,0,0|1,0,0]=3 7794 B8R1.31 [C@H]1(CNC1=O)[C@@H](C)O Amb17843592 [0,1,0,1,0,0|2,0,0]=4 7795 B8R1.34 CC(=C)CC1CCC1 Amb25141378 [0,1,0,1,0,0|2,0,0]=4 7796 B8R1.34 CC(=C)CC1CNC1 Amb24576858 [0,1,0,1,0,0|2,0,0]=4 7797 B8R1.34 CC(=O)CC1CCC1 Amb20668826 [0,1,0,1,0,0|1,0,0]=3 7798 B8R1.34 CC(=O)CC1COC1 Amb22728373 [0,1,0,1,0,0|1,0,0]=3 7799 B8R1.34 CC(=O)CN1CCC1 Amb25266769 [0,1,0,1,0,0|2,0,0]=4 7800 B8R1.34 CC(=O)NC1CNC1 Amb21960869 [0,1,0,1,0,0|2,0,0]=4 7801 B8R1.34 CC(=O)OC1CCC1 Amb25215621 [0,1,0,1,0,0|2,0,0]=4 7802 B8R1.34 CC(=O)OC1CNC1 Amb21956164 [0,1,0,1,0,0|2,0,0]=4 7803 B8R1.34 CC(=O)OC1CNC1 Amb21959342 [0,1,0,1,0,0|2,0,0]=4 7804 B8R1.34 CC(=O)OC1COC1 Amb25257353 [0,1,0,1,0,0|2,0,0]=4 7805 B8R1.34 CC(O)CC1CCC1 Amb24590967 [0,1,0,1,0,0|1,0,1]=4 7806 B8R1.34 CC(O)CC1CSC1 Amb25746467 [0,1,0,1,0,0|1,0,1]=4 7807 B8R1.34 C[C@@H](O)CC1CCC1 Amb24673338 [0,1,0,1,0,0|1,0,1]=4 7808 B8R1.34 C[C@H](O)CC1CCC1 Amb24719399 [0,1,0,1,0,0|1,0,1]=4 7809 B8R1.34 NC(=N)CC1CCC1 Amb25693457 [0,1,0,1,0,0|2,0,0]=4 7810 B8R1.34 NC(=O)CC1CCN1 Amb24561003 [0,1,0,1,0,0|1,0,0]=3 7811 B8R1.34 NC(=O)CC1COC1 Amb25080580 [0,1,0,1,0,0|1,0,0]=3 7812 B8R1.34 NC(=O)CN1CCC1 Amb25167404 [0,1,0,1,0,0|2,0,0]=4 7813 B8R1.34 NC(=O)NC1CCC1 Amb24692278 [0,1,0,1,0,0|2,0,0]=4 7814 B8R1.34 NC(=O)OC1CNC1 Amb23598269 [0,1,0,1,0,0|2,0,0]=4 7815 B8R1.34 NC(=O)OC1CSC1 Amb22364584 [0,1,0,1,0,0|2,0,0]=4 7816 B8R1.34 O=C(Cl)CC1CCC1 Amb22491179 [0,1,0,1,0,0|1,0,0]=3 7817 B8R1.34 OC(=O)C=C1CCC1 Amb20667794 [0,1,0,1,0,0|0,0,2]=4 7818 B8R1.34 OC(=O)C=C1CSC1 Amb24379733 [0,1,0,1,0,0|0,0,2]=4 7819 B8R1.34 OC(=O)CC1CCN1 Amb25068427 [0,1,0,1,0,0|0,0,0]=2 7820 B8R1.34 OC(=O)CC1CNC1 Amb21856240 [0,1,0,1,0,0|0,0,0]=2 7821 B8R1.34 OC(=O)CC1CNC1 Amb22057370 [0,1,0,1,0,0|0,0,0]=2 7822 B8R1.34 OC(=O)CC1CNC1 Amb22739043 [0,1,0,1,0,0|0,0,0]=2 7823 B8R1.34 OC(=O)CC1COC1 Amb18199145 [0,1,0,1,0,0|0,0,0]=2 7824 B8R1.34 OC(=O)CC=1CCC1 Amb24397299 [0,1,0,1,0,0|0,0,1]=3 7825 B8R1.34 OC(=O)CN1CCC1 Amb22059611 [0,1,0,1,0,0|1,0,0]=3 7826 B8R1.34 [O-][N+](=O)CC1COC1 Amb21961002 [0,1,0,1,0,0|1,0,1]=4 7827 B8R1.40 BrCC(=O)NC1CC1 Amb17331226 [0,1,0,1,0,0|2,0,0]=4 7828 B8R1.40 C#CC(=O)NC1CC1 Amb23556886 [0,1,0,1,0,0|2,0,0]=4 7829 B8R1.40 C=CC(O)CC1CC1 Amb24469416 [0,1,0,1,0,0|1,0,1]=4 7830 B8R1.40 CC(CC1CC1)=NN Amb24619029 [0,1,0,1,0,0|2,0,0]=4 7831 B8R1.40 CC(CC1CC1)C=O Amb25100922 [0,1,0,1,0,0|1,0,1]=4 7832 B8R1.40 CC(CC1CC1)CO Amb24433846 [0,1,0,1,0,0|1,0,1]=4 7833 B8R1.40 CC(CC1CC1)NO Amb24388093 [0,1,0,1,0,0|1,0,1]=4 7834 B8R1.40 CC(CC1CO1)SC Amb24376170 [0,1,0,1,0,0|1,0,1]=4 7835 B8R1.40 CCC(O)CC1CC1 Amb24481406 [0,1,0,1,0,0|1,0,1]=4 7836 B8R1.40 CC[C@H](O)CC1CC1 Amb25693970 [0,1,0,1,0,0|1,0,1]=4 7837 B8R1.40 CN(CC1CC1)C=O Amb24117127 [0,1,0,1,0,0|2,0,0]=4 7838 B8R1.40 CNC(=O)NC1CC1 Amb2132760 [0,1,0,1,0,0|2,0,0]=4 7839 B8R1.40 COC(=N)CC1CC1 Amb24377021 [0,1,0,1,0,0|1,0,0]=3 7840 B8R1.40 COC(=O)CC1CC1 Amb20622313 [0,1,0,1,0,0|0,0,0]=2 7841 B8R1.40 COC(=O)NC1CC1 Amb17869115 [0,1,0,1,0,0|1,0,0]=3 7842 B8R1.40 COC(C)=NC1CC1 Amb25349452 [0,1,0,1,0,0|2,0,0]=4 7843 B8R1.40 CON(C)CC1CC1 Amb25077342 [0,1,0,1,0,0|2,0,0]=4 7844 B8R1.40 CO\C(\C)=N\C1CC1 Amb22356785 [0,1,0,1,0,0|2,0,0]=4 7845 B8R1.40 C\C(\C=O)=C/C1CC1 Amb25086591 [0,1,0,1,0,0|1,0,1]=4 7846 B8R1.40 NC(CC1CC1)CO Amb18203350 [0,1,0,1,0,0|1,0,1]=4 7847 B8R1.40 NCC(=O)CC1CC1 Amb18203369 [0,1,0,1,0,0|1,0,0]=3 7848 B8R1.40 NCC(=O)NC1CC1 Amb2371201 [0,1,0,1,0,0|2,0,0]=4 7849 B8R1.40 NCC(=O)OC1CC1 Amb17942928 [0,1,0,1,0,0|2,0,0]=4 7850 B8R1.40 NCC(O)CC1CC1 Amb18833011 [0,1,0,1,0,0|1,0,1]=4 7851 B8R1.40 O=C(CBr)CC1CC1 Amb24364944 [0,1,0,1,0,0|1,0,0]=3 7852 B8R1.40 O=C(CCl)CC1CC1 Amb22395343 [0,1,0,1,0,0|1,0,0]=3 7853 B8R1.40 O=C(CF)NC1CC1 Amb25108089 [0,1,0,1,0,0|2,0,0]=4 7854 B8R1.40 O=C(CI)NC1CC1 Amb23512747 [0,1,0,1,0,0|2,0,0]=4 7855 B8R1.40 O=C(CS)NC1CC1 Amb24183332 [0,1,0,1,0,0|1,1,0]=4 7856 B8R1.40 OCC(=O)OC1CC1 Amb25317031 [0,1,0,1,0,0|1,0,0]=3 7857 B8R1.40 ONC(=O)CC1CC1 Amb25704077 [0,1,0,1,0,0|0,0,0]=2 7858 B8R1.40 O\N=C(\NC1CC1)/N Amb10066962 [0,1,0,1,0,0|2,0,0]=4 7859 B8R1.42 CC(=O)CC1(C)CC1 Amb10607353 [0,1,0,1,0,0|1,0,0]=3 7860 B8R1.42 CC(=O)CC1(C)CO1 Amb25232199 [0,1,0,1,0,0|1,0,0]=3 7861 B8R1.42 CC(=O)CC1(F)CC1 Amb24748494 [0,1,0,1,0,0|1,0,0]=3 7862 B8R1.42 CC(=O)NC1(C)CC1 Amb24372211 [0,1,0,1,0,0|2,0,0]=4 7863 B8R1.42 CC(=O)OC1(C)CC1 Amb10069988 [0,1,0,1,0,0|2,0,0]=4 7864 B8R1.42 CC(C)CC1(C)CO1 Amb24715821 [0,1,0,1,0,0|1,0,1]=4 7865 B8R1.42 CC(O)CC1(C)CO1 Amb25135513 [0,1,0,1,0,0|1,0,1]=4 7866 B8R1.42 CC(O)CC1(N)CC1 Amb18833015 [0,1,0,1,0,0|1,0,1]=4 7867 B8R1.42 CC(O)CC1(O)CC1 Amb25336996 [0,1,0,1,0,0|1,0,1]=4 7868 B8R1.42 CC1(CC(N)=O)CC1 Amb24393728 [0,1,0,1,0,0|1,0,0]=3 7869 B8R1.42 CC1(CC(O)=O)CC1 Amb18833039 [0,1,0,1,0,0|0,0,0]=2 7870 B8R1.42 CC1(CC1)NC(N)=O Amb24579273 [0,1,0,1,0,0|2,0,0]=4 7871 B8R1.42 C[C@@H](O)C[C@]1(C)CO1 Amb25218841 [0,1,0,1,0,0|1,0,1]=4 7872 B8R1.42 NC1(CC(O)=O)CC1 Amb18833024 [0,1,0,1,0,0|0,0,0]=2 7873 B8R1.42 NC1(CC(O)=O)CC1 Amb21964520 [0,1,0,1,0,0|0,0,0]=2 7874 B8R1.42 OC(=O)CC1(O)CC1 Amb24117238 [0,1,0,1,0,0|0,0,0]=2 7875 B8R1.43 C#C[C@@H]1C[C@H]1C(O)=O Amb25294666 [0,1,0,1,0,0|0,0,1]=3 7876 B8R1.43 C#C[C@H]1C[C@@H]1C(O)=O Amb24076488 [0,1,0,1,0,0|0,0,1]=3 7877 B8R1.43 C=CC1CC1C(N)=O Amb24530246 [0,1,0,1,0,0|1,0,1]=4 7878 B8R1.43 C=C[C@H]1C[C@@H]1C(O)=O Amb24562586 [0,1,0,1,0,0|0,0,1]=3 7879 B8R1.43 C=C[C@H]1C[C@H]1C(O)=O Amb25173924 [0,1,0,1,0,0|0,0,1]=3 7880 B8R1.43 CC(=O)C1CC1CO Amb25762004 [0,1,0,1,0,0|1,0,0]=3 7881 B8R1.43 CC(=O)[C@@H]1C[C@@H]1C=C Amb25784181 [0,1,0,1,0,0|1,0,1]=4 7882 B8R1.43 CC(=O)[C@H]1C[C@@H]1C=C Amb24570441 [0,1,0,1,0,0|1,0,1]=4 7883 B8R1.43 CC(C)C1CC1C=O Amb24561916 [0,1,0,1,0,0|1,0,1]=4 7884 B8R1.43 CC(C)C1OC1CO Amb25107087 [0,1,0,1,0,0|0,0,2]=4 7885 B8R1.43 CC(C)[C@@H]1C[C@@H]1C=O Amb24561087 [0,1,0,1,0,0|1,0,1]=4 7886 B8R1.43 CC(C)[C@H]1O[C@H]1C=O Amb25366618 [0,1,0,1,0,0|0,0,1]=3 7887 B8R1.43 CC(C)[C@H]1O[C@H]1CO Amb25176376 [0,1,0,1,0,0|0,0,2]=4 7888 B8R1.43 CC(O)[C@@H]1C[C@H]1CC Amb24733487 [0,1,0,1,0,0|1,0,1]=4 7889 B8R1.43 CC(O)[C@H]1C[C@H]1CO Amb25260054 [0,1,0,1,0,0|1,0,1]=4 7890 B8R1.43 CCC1CC1C(N)=O Amb24482378 [0,1,0,1,0,0|1,0,0]=3 7891 B8R1.43 CCC1CC1C(O)=O Amb18961272 [0,1,0,1,0,0|0,0,0]=2 7892 B8R1.43 CCC1OC1C(O)=O Amb24640795 [0,1,0,1,0,0|1,0,0]=3 7893 B8R1.43 CC[C@@H]1C[C@@H]1C(C)=O Amb25779618 [0,1,0,1,0,0|1,0,0]=3 7894 B8R1.43 CC[C@@H]1C[C@H]1C(=O)Cl Amb24606720 [0,1,0,1,0,0|1,0,0]=3 7895 B8R1.43 CC[C@@H]1C[C@H]1C(C)=O Amb25809901 [0,1,0,1,0,0|1,0,0]=3 7896 B8R1.43 CC[C@@H]1C[C@H]1C(N)=O Amb24532446 [0,1,0,1,0,0|1,0,0]=3 7897 B8R1.43 CC[C@@H]1C[C@H]1C(O)=O Amb24112910 [0,1,0,1,0,0|0,0,0]=2 7898 B8R1.43 CC[C@@H]1O[C@H]1C(O)=O Amb24587605 [0,1,0,1,0,0|1,0,0]=3 7899 B8R1.43 CC[C@H]1C[C@H]1C(C)=O Amb24635581 [0,1,0,1,0,0|1,0,0]=3 7900 B8R1.43 COC1CC1C(C)=O Amb25252874 [0,1,0,1,0,0|1,0,0]=3 7901 B8R1.43 COC1CC1C(O)=O Amb25081919 [0,1,0,1,0,0|0,0,0]=2 7902 B8R1.43 CO[C@@H]1C[C@H]1C(O)=O Amb24514838 [0,1,0,1,0,0|0,0,0]=2 7903 B8R1.43 C[C@@H](O)[C@@H]1C[C@@H]1CC Amb25358065 [0,1,0,1,0,0|1,0,1]=4 7904 B8R1.43 C[C@@H](O)[C@@H]1C[C@@H]1CO Amb25206739 [0,1,0,1,0,0|1,0,1]=4 7905 B8R1.43 C[C@H](O)[C@@H]1C[C@@H]1CO Amb25175328 [0,1,0,1,0,0|1,0,1]=4 7906 B8R1.43 C[C@H](O)[C@@H]1C[C@H]1CO Amb24588289 [0,1,0,1,0,0|1,0,1]=4 7907 B8R1.43 C[C@H](O)[C@H]1C[C@H]1CO Amb24732834 [0,1,0,1,0,0|1,0,1]=4 7908 B8R1.43 C\C=C/1\CC1C(O)=O Amb24386730 [0,1,0,1,0,0|0,0,1]=3 7909 B8R1.43 C\C=C/1\C[C@H]1C(O)=O Amb25359125 [0,1,0,1,0,0|0,0,1]=3 7910 B8R1.43 N#CC1CC1C(O)=O Amb24183452 [0,1,0,1,0,0|0,0,1]=3 7911 B8R1.43 N#C[C@@H]1C[C@@H]1C(O)=O Amb24183522 [0,1,0,1,0,0|0,0,1]=3 7912 B8R1.43 N#C[C@@H]1C[C@H]1C(O)=O Amb24183456 [0,1,0,1,0,0|0,0,1]=3 7913 B8R1.43 N#C[C@H]1C[C@H]1C(O)=O Amb25168974 [0,1,0,1,0,0|0,0,1]=3 7914 B8R1.43 NC(=O)C1CC1CO Amb23538670 [0,1,0,1,0,0|1,0,0]=3 7915 B8R1.43 NC(=O)C1OC1CBr Amb25702387 [0,1,0,1,0,0|2,0,0]=4 7916 B8R1.43 NC(=O)C1OC1CO Amb25351466 [0,1,0,1,0,0|2,0,0]=4 7917 B8R1.43 NC(=O)[C@@H]1O[C@H]1CO Amb25229010 [0,1,0,1,0,0|2,0,0]=4 7918 B8R1.43 NCC1CC1C(N)=O Amb24604918 [0,1,0,1,0,0|1,0,0]=3 7919 B8R1.43 NC[C@@H]1C[C@@H]1C(O)=O Amb24680970 [0,1,0,1,0,0|0,0,0]=2 7920 B8R1.43 NNC1CC1C(=O)O Amb10576221 [0,1,0,1,0,0|1,0,0]=3 7921 B8R1.43 OB(O)[C@H]1C[C@@H]1CCl Amb24551898 [0,1,0,1,0,0|1,0,1]=4 7922 B8R1.43 OC(=O)[C@@H]1C[C@H]1C=O Amb25174216 [0,1,0,1,0,0|0,0,1]=3 7923 B8R1.43 OC(=O)[C@@H]1C[C@H]1CCl Amb24698643 [0,1,0,1,0,0|0,0,0]=2 7924 B8R1.43 OC(=O)[C@H]1C[C@@H]1C=O Amb25188101 [0,1,0,1,0,0|0,0,1]=3 7925 B8R1.43 OC(=O)[C@H]1C[C@@H]1CBr Amb24515045 [0,1,0,1,0,0|0,0,0]=2 7926 B8R1.43 OC(=O)[C@H]1O[C@@H]1CBr Amb24603042 [0,1,0,1,0,0|1,0,0]=3 7927 B8R1.43 OCC1CC1C(O)=O Amb25173469 [0,1,0,1,0,0|0,0,0]=2 7928 B8R1.43 OC[C@@H]1C[C@H]1C(O)=O Amb25231147 [0,1,0,1,0,0|0,0,0]=2 7929 B8R1.43 OC[C@H]1C[C@@H]1C(O)=O Amb25319844 [0,1,0,1,0,0|0,0,0]=2 7930 B8R1.43 [O-]C(=O)C1OC1CO Amb24557010 [0,1,0,1,0,0|1,0,1]=4 7931 B8R1.43 [O-]C(=O)[C@@H]1O[C@H]1CO Amb25215740 [0,1,0,1,0,0|1,0,1]=4 7932 B8R1.43 [O-]C(=O)[C@H]1O[C@@H]1CO Amb24541614 [0,1,0,1,0,0|1,0,1]=4 7933 B8R1.43 [O-][N+](=O)C1CC1CO Amb23571861 [0,1,0,1,0,0|1,0,1]=4 7934 B8R1.53 CC1(C)CC(=C1)C#N Amb22524661 [0,1,0,1,0,0|2,0,0]=4 7935 B8R1.53 CC1(C)CC(C#N)O1 Amb24445344 [0,1,0,1,0,0|1,0,1]=4 7936 B8R1.53 CC1(C)CC(C1)=NN Amb25810830 [0,1,0,1,0,0|2,0,0]=4 7937 B8R1.53 CC1(C)CC(C1)=NO Amb25177757 [0,1,0,1,0,0|1,0,0]=3 7938 B8R1.53 CC1(C)CC(CBr)O1 Amb23440281 [0,1,0,1,0,0|1,0,1]=4 7939 B8R1.53 CC1(C)CC(CN)O1 Amb23440280 [0,1,0,1,0,0|1,0,1]=4 7940 B8R1.53 CC1(C)CC(CO)C1 Amb22011882 [0,1,0,1,0,0|1,0,1]=4 7941 B8R1.53 CC1(C)CC(CO)O1 Amb23440279 [0,1,0,1,0,0|0,0,2]=4 7942 B8R1.53 CC1(C)CN(C1)C=O Amb25134216 [0,1,0,1,0,0|2,0,0]=4 7943 B8R1.53 CNC1CS(=O)(=O)C1 Amb24631404 [0,1,0,1,0,0|1,0,1]=4 7944 B8R1.53 C[C@@]1(O)C[C@@H](CN)C1 Amb23440209 [0,1,0,1,0,0|1,0,1]=4 7945 B8R1.53 C[C@@]1(O)C[C@H](CN)C1 Amb23440242 [0,1,0,1,0,0|1,0,1]=4 7946 B8R1.53 O=S1(=O)CC(CBr)C1 Amb24663256 [0,1,0,1,0,0|1,0,1]=4 7947 B8R1.62 CC1(CC(=O)C1)C#N Amb25830064 [0,1,0,1,0,0|1,0,1]=4 7948 B8R1.62 CC1(CC(=O)N1)C=C Amb24347816 [0,1,0,1,0,0|1,0,1]=4 7949 B8R1.62 CC1(CCl)CC(=O)O1 Amb25784185 [0,1,0,1,0,0|0,0,0]=2 7950 B8R1.62 CC1(CN)CC(=C)C1 Amb25227928 [0,1,0,1,0,0|2,0,0]=4 7951 B8R1.62 CC1(CO)CC(=O)C1 Amb22406263 [0,1,0,1,0,0|1,0,0]=3 7952 B8R1.62 CC1(CS)CC(=O)N1 Amb25771053 [0,1,0,1,0,0|1,0,0]=3 7953 B8R1.62 CC1CC(C)(C1)C=O Amb23449252 [0,1,0,1,0,0|1,0,1]=4 7954 B8R1.62 CC1CC(C)(CO)C1 Amb23449214 [0,1,0,1,0,0|1,0,1]=4 7955 B8R1.62 CC1CC(O)(CN)C1 Amb25189044 [0,1,0,1,0,0|1,0,1]=4 7956 B8R1.62 CCC1(C)CC(=O)N1 Amb24443895 [0,1,0,1,0,0|1,0,0]=3 7957 B8R1.62 CCC1(O)CC(C)C1 Amb25746141 [0,1,0,1,0,0|1,0,1]=4 7958 B8R1.62 CC[C@@]1(C)CC(=O)N1 Amb25766440 [0,1,0,1,0,0|1,0,0]=3 7959 B8R1.62 COC1(C)CC(=O)C1 Amb24686485 [0,1,0,1,0,0|1,0,0]=3 7960 B8R1.62 C[C@@H]1C[C@@](C)(CO)O1 Amb24719752 [0,1,0,1,0,0|1,0,1]=4 7961 B8R1.62 C[C@@]1(CC(=O)N1)C=C Amb25770505 [0,1,0,1,0,0|1,0,1]=4 7962 B8R1.62 C[C@H]1C[C@@](C)(CO)O1 Amb24688454 [0,1,0,1,0,0|1,0,1]=4 7963 B8R1.65 CC1(C)CC1(Br)C=O Amb24682736 [0,1,0,1,0,0|1,0,1]=4 7964 B8R1.65 CC1(C)CC1(C)C=O Amb24483067 [0,1,0,1,0,0|1,0,1]=4 7965 B8R1.65 CC1(C)CC1(C)CO Amb25712593 [0,1,0,1,0,0|1,0,1]=4 7966 B8R1.65 CC1(C)CC1(N)CO Amb25195940 [0,1,0,1,0,0|1,0,1]=4 7967 B8R1.67 CC(=O)C1C(C)C1C Amb24722893 [0,1,0,1,0,0|1,0,0]=3 7968 B8R1.67 CC(=O)[C@@H]1[C@@H](C)C1=C Amb24634605 [0,1,0,1,0,0|1,0,1]=4 7969 B8R1.67 CC(=O)[C@H]1[C@H](C)C1=C Amb25336490 [0,1,0,1,0,0|1,0,1]=4 7970 B8R1.67 CC(C)C1C(Cl)=C1Cl Amb24725187 [0,1,0,1,0,0|2,0,0]=4 7971 B8R1.67 CC(O)C1C(C)C1C Amb25199981 [0,1,0,1,0,0|1,0,1]=4 7972 B8R1.67 CC1C(C1C)C(N)=O Amb24627878 [0,1,0,1,0,0|1,0,0]=3 7973 B8R1.67 CC1C(C1C)C(O)=O Amb25314641 [0,1,0,1,0,0|0,0,0]=2 7974 B8R1.67 CC1C(Cl)C1C(C)=O Amb25122776 [0,1,0,1,0,0|1,0,0]=3 7975 B8R1.67 CC1C(N)C1C(O)=O Amb25764435 [0,1,0,1,0,0|0,0,0]=2 7976 B8R1.67 CC=1C(C(O)=O)C1C Amb25737086 [0,1,0,1,0,0|0,0,1]=3 7977 B8R1.67 CC=1C(C)C1C(O)=O Amb24586301 [0,1,0,1,0,0|0,0,1]=3 7978 B8R1.67 CC=1[C@H](C)C1C(O)=O Amb24445514 [0,1,0,1,0,0|0,0,1]=3 7979 B8R1.67 C[C@@H]1[C@@H](Br)[C@H]1C(C)=O Amb24654990 [0,1,0,1,0,0|1,0,0]=3 7980 B8R1.67 C[C@@H]1[C@H]([C@@H]1C)C(N)=O Amb24332855 [0,1,0,1,0,0|1,0,0]=3 7981 B8R1.67 C[C@@H]1[C@H]([C@@H]1C)C(O)=O Amb25378219 [0,1,0,1,0,0|0,0,0]=2 7982 B8R1.67 C[C@H]1C([C@@H]1C)C(O)=O Amb25811791 [0,1,0,1,0,0|0,0,0]=2 7983 B8R1.67 C[C@H]1[C@@H](Br)[C@@H]1C(C)=O Amb25216918 [0,1,0,1,0,0|1,0,0]=3 7984 B8R1.67 C[C@H]1[C@@H](Cl)[C@@H]1C(C)=O Amb25179034 [0,1,0,1,0,0|1,0,0]=3 7985 B8R1.67 C[C@H]1[C@H](Br)[C@@H]1C(C)=O Amb25300342 [0,1,0,1,0,0|1,0,0]=3 7986 B8R1.67 C[C@H]1[C@H](N)[C@@H]1C(O)=O Amb24698691 [0,1,0,1,0,0|0,0,0]=2 7987 B8R1.83 CC(NO)C1CC1C Amb24383458 [0,1,0,1,0,0|1,0,1]=4 7988 B8R1.83 CC1CC1C(=N)NC Amb25831689 [0,1,0,1,0,0|2,0,0]=4 7989 B8R1.83 CC1CC1C(=N)OC Amb24705967 [0,1,0,1,0,0|1,0,0]=3 7990 B8R1.83 CC1CC1C(=O)C=C Amb25173576 [0,1,0,1,0,0|1,0,0]=3 7991 B8R1.83 CC1CC1C(=O)CBr Amb24526945 [0,1,0,1,0,0|1,0,0]=3 7992 B8R1.83 CC1CC1C(=O)CCl Amb24104125 [0,1,0,1,0,0|1,0,0]=3 7993 B8R1.83 CC1CC1C(=O)CN Amb24524253 [0,1,0,1,0,0|1,0,0]=3 7994 B8R1.83 CC1CC1C(=O)NN Amb1130542 [0,1,0,1,0,0|1,0,0]=3 7995 B8R1.83 CC1CC1C(C)=NN Amb25701135 [0,1,0,1,0,0|2,0,0]=4 7996 B8R1.83 CC1CC1C(C)=NO Amb25697279 [0,1,0,1,0,0|1,0,0]=3 7997 B8R1.83 CC1CC1C(N)=NN Amb24672641 [0,1,0,1,0,0|2,0,0]=4 7998 B8R1.83 CC1CC1C(N)=NO Amb25186813 [0,1,0,1,0,0|1,0,0]=3 7999 B8R1.83 CC1CC1C(O)C#C Amb25084872 [0,1,0,1,0,0|1,0,1]=4 8000 B8R1.83 CC1CC1C(O)C#N Amb25087929 [0,1,0,1,0,0|1,0,1]=4 8001 B8R1.83 CC1OC1C(=O)NC Amb25204387 [0,1,0,1,0,0|2,0,0]=4 8002 B8R1.83 CC1OC1C(=O)OC Amb22055865 [0,1,0,1,0,0|1,0,0]=3 8003 B8R1.83 CCC(=O)[C@@H]1C[C@@H]1Cl Amb24602103 [0,1,0,1,0,0|2,0,0]=4 8004 B8R1.83 COC(=O)C1CC1F Amb25373911 [0,1,0,1,0,0|1,0,0]=3 8005 B8R1.83 COC(=O)C1CC1O Amb25328067 [0,1,0,1,0,0|1,0,0]=3 8006 B8R1.83 COC(=O)[C@@H]1C[C@@H]1Br Amb25242493 [0,1,0,1,0,0|1,0,0]=3 8007 B8R1.83 COC(=O)[C@@H]1C[C@@H]1Cl Amb24519340 [0,1,0,1,0,0|1,0,0]=3 8008 B8R1.83 COC(=O)[C@@H]1C[C@H]1Cl Amb24610039 [0,1,0,1,0,0|1,0,0]=3 8009 B8R1.83 COC(=O)[C@H]1C[C@@H]1Cl Amb24519701 [0,1,0,1,0,0|1,0,0]=3 8010 B8R1.83 COC(=O)[C@H]1C[C@@H]1N Amb24629188 [0,1,0,1,0,0|1,0,0]=3 8011 B8R1.83 C[C@@H]1C[C@H]1C(=C)CO Amb24515469 [0,1,0,1,0,0|1,0,0]=3 8012 B8R1.83 C[C@@H]1C[C@H]1C(O)C#N Amb25307554 [0,1,0,1,0,0|1,0,1]=4 8013 B8R1.83 C[C@@H]1N[C@H]1C(=O)OC Amb24120620 [0,1,0,1,0,0|1,0,0]=3 8014 B8R1.83 C[C@H]1C[C@@H]1C(=O)CC Amb25272348 [0,1,0,1,0,0|1,0,0]=3 8015 B8R1.83 C[C@H]1C[C@@H]1C(=O)NO Amb25358413 [0,1,0,1,0,0|0,0,0]=2 8016 B8R1.83 C[C@H]1C[C@H]1C(=C)CO Amb25266793 [0,1,0,1,0,0|1,0,0]=3 8017 B8R1.83 C[C@H]1C[C@H]1[C@@H](O)CC Amb25285604 [0,1,0,1,0,0|1,0,1]=4 8018 B8R1.21 CC(C)(C)[C@@H]1O[C@@H]1Cl Amb25025953 [0,1,0,1,0,0|1,0,1]=4 8019 B8R1.21 CC(C)(C)[C@@H]1O[C@H]1Br Amb25250706 [0,1,0,1,0,0|1,0,1]=4 8020 B8R1.21 CC1OC1P(O)(O)=O Amb22730952 [0,1,0,1,0,0|2,0,0]=4 8021 B8R1.21 C[C@@H]1O[C@@H]1P(O)(=O)=O Amb22801578 [0,1,0,1,0,0|2,0,0]=4 8022 B8R1.21 C[C@@H]1O[C@@H]1P(O)(O)=O Amb22167220 [0,1,0,1,0,0|2,0,0]=4 8023 B8R1.21 C[C@@H]1O[C@@H]1P(O)(O)=O Amb25328384 [0,1,0,1,0,0|2,0,0]=4 8024 B8R1.21 C[Si](C)(C)C1CC1=O Amb25059280 [0,1,0,1,0,0|1,1,0]=4 8025 B8R1.21 [13CH3][13CH]1O[13CH]1P(=O)(O)O Amb17614611 [0,1,0,1,0,0|2,0,0]=4 8026 B8R1.56 CC(C)(O)CC1CC1 Amb24689606 [0,1,0,1,0,0|1,0,1]=4 8027 B8R1.56 CC(C)(O)CC1CO1 Amb25117815 [0,1,0,1,0,0|1,0,1]=4 8028 B8R1.56 NS(=O)(=O)CC1CC1 Amb19338125 [0,1,0,1,0,0|1,0,1]=4 8029 B8R1.56 O=S(=O)(Cl)CC1CC1 Amb18176559 [0,1,0,1,0,0|1,0,1]=4 8030 B8R1.56 [O-]S(=O)(=O)CC1CC1 Amb25242906 [0,1,0,1,0,0|1,0,1]=4 8031 B8R1.73 CC1(C)CC(C)(O)C1 Amb25274190 [0,1,0,1,0,0|1,0,1]=4 8032 B8R1.30 C=C1CC1(N)C(O)=O Amb22274582 [0,1,0,1,0,0|0,0,2]=4 8033 B8R1.30 CC(=O)C1(C)CC1Cl Amb24481567 [0,1,0,1,0,0|2,0,0]=4 8034 B8R1.30 CC(=O)C1(C)CC1F Amb25248317 [0,1,0,1,0,0|2,0,0]=4 8035 B8R1.30 CC(=O)[C@@]1(C)C[C@H]1Br Amb25176069 [0,1,0,1,0,0|2,0,0]=4 8036 B8R1.30 CC(=O)[C@]1(C)C[C@@H]1Br Amb25242518 [0,1,0,1,0,0|2,0,0]=4 8037 B8R1.30 CC(=O)[C@]1(C)C[C@H]1Br Amb24698158 [0,1,0,1,0,0|2,0,0]=4 8038 B8R1.30 CC(C)[C@@]1(Cl)O[C@@H]1Cl Amb25784212 [0,1,0,1,0,0|1,0,1]=4 8039 B8R1.30 CC(C)[C@@]1(Cl)O[C@H]1Cl Amb25834660 [0,1,0,1,0,0|1,0,1]=4 8040 B8R1.30 CC1(CC1Br)C(N)=O Amb24687532 [0,1,0,1,0,0|2,0,0]=4 8041 B8R1.30 CC1(CC1Cl)C(=O)Cl Amb25700456 [0,1,0,1,0,0|2,0,0]=4 8042 B8R1.30 CC1(CC1F)C(N)=O Amb24630009 [0,1,0,1,0,0|2,0,0]=4 8043 B8R1.30 CC1(CC1F)C(O)=O Amb24445672 [0,1,0,1,0,0|1,0,0]=3 8044 B8R1.30 CC1(OC1C)C(=O)O Amb17593199 [0,1,0,1,0,0|1,0,0]=3 8045 B8R1.30 CC1CC1(C)C(C)=O Amb24570372 [0,1,0,1,0,0|1,0,0]=3 8046 B8R1.30 CC1CC1(C)C(C)O Amb24705805 [0,1,0,1,0,0|1,0,1]=4 8047 B8R1.30 CC1CC1(Cl)C(O)=O Amb25376529 [0,1,0,1,0,0|0,0,0]=2 8048 B8R1.30 CC1CC1(O)C(O)=O Amb24481340 [0,1,0,1,0,0|0,0,0]=2 8049 B8R1.30 CC1OC1(C)C(C)=O Amb25745803 [0,1,0,1,0,0|2,0,0]=4 8050 B8R1.30 CC1OC1(C)C(N)=O Amb24482460 [0,1,0,1,0,0|2,0,0]=4 8051 B8R1.30 CC1OC1(Cl)C(O)=O Amb24604328 [0,1,0,1,0,0|1,0,0]=3 8052 B8R1.30 C[C@@H]1C[C@@]1(C)C(O)=O Amb24680945 [0,1,0,1,0,0|0,0,0]=2 8053 B8R1.30 C[C@@H]1C[C@@]1(C)[C@@H](C)O Amb25285546 [0,1,0,1,0,0|1,0,1]=4 8054 B8R1.30 C[C@@H]1C[C@@]1(N)C(O)=O Amb23452877 [0,1,0,1,0,0|0,0,0]=2 8055 B8R1.30 C[C@@H]1C[C@]1(N)C(O)=O Amb23452872 [0,1,0,1,0,0|0,0,0]=2 8056 B8R1.30 C[C@@H]1C[C@]1(O)C(O)=O Amb24630291 [0,1,0,1,0,0|0,0,0]=2 8057 B8R1.30 C[C@@H]1O[C@@]1(C)C(N)=O Amb24760855 [0,1,0,1,0,0|2,0,0]=4 8058 B8R1.30 C[C@@H]1O[C@@]1(C)C(O)=O Amb25174091 [0,1,0,1,0,0|1,0,0]=3 8059 B8R1.30 C[C@@]1(C[C@H]1Cl)C(O)=O Amb25025974 [0,1,0,1,0,0|1,0,0]=3 8060 B8R1.30 C[C@H]1CC1(N)C(O)=O Amb25064269 [0,1,0,1,0,0|0,0,0]=2 8061 B8R1.30 C[C@H]1C[C@@]1(O)C(O)=O Amb25174792 [0,1,0,1,0,0|0,0,0]=2 8062 B8R1.30 C[C@H]1C[C@]1(C)C(C)=O Amb24550104 [0,1,0,1,0,0|1,0,0]=3 8063 B8R1.30 C[C@H]1O[C@@]1(C)C(C)=O Amb25207221 [0,1,0,1,0,0|2,0,0]=4 8064 B8R1.30 C[C@]1(C[C@@H]1F)C(O)=O Amb24053139 [0,1,0,1,0,0|1,0,0]=3 8065 B8R1.30 N[C@@]1(C[C@H]1Cl)C(O)=O Amb22748908 [0,1,0,1,0,0|1,0,0]=3 8066 B8R1.30 N[C@]1(C[C@@H]1Cl)C(O)=O Amb25245700 [0,1,0,1,0,0|1,0,0]=3 8067 B8R1.30 N[C@]1(C[C@H]1Br)C(O)=O Amb24567904 [0,1,0,1,0,0|1,0,0]=3 8068 B8R1.50 BrC1C(=O)COC1=O Amb17594578 [0,1,0,1,0,0|1,0,1]=4 8069 B8R1.50 C=C1C(N)COC1=O Amb18641720 [0,1,0,1,0,0|1,0,1]=4 8070 B8R1.50 C=C1[C@@H](N)COC1=O Amb24744705 [0,1,0,1,0,0|1,0,1]=4 8071 B8R1.50 C=C1[C@@H](O)COC1=O Amb24435902 [0,1,0,1,0,0|1,0,1]=4 8072 B8R1.50 CC1=NOC(=O)C1C Amb19958218 [0,1,0,1,0,0|1,0,1]=4 8073 B8R1.50 CC1C(=O)CCN1C Amb24453852 [0,1,0,1,0,0|2,0,0]=4 8074 B8R1.50 CC1C(C)CNC1=N Amb24481323 [0,1,0,1,0,0|2,0,0]=4 8075 B8R1.50 CC1C(C)CNC1=O Amb24334186 [0,1,0,1,0,0|1,0,0]=3 8076 B8R1.50 CC1C(C)SC=C1O Amb22167478 [0,1,0,1,0,0|2,0,0]=4 8077 B8R1.50 CC1C(C)SCC1=O Amb24687046 [0,1,0,1,0,0|2,0,0]=4 8078 B8R1.50 CC1C(N)COC1=O Amb18641824 [0,1,0,1,0,0|1,0,0]=3 8079 B8R1.50 CC1C(O)CNC1=O Amb24441657 [0,1,0,1,0,0|2,0,0]=4 8080 B8R1.50 CC1C(O)COC1=O Amb25357313 [0,1,0,1,0,0|1,0,0]=3 8081 B8R1.50 CC1C(O)OCC1C Amb25802956 [0,1,0,1,0,0|0,0,2]=4 8082 B8R1.50 CC1C=CC(=O)C1C Amb25284741 [0,1,0,1,0,0|1,0,1]=4 8083 B8R1.50 CC1C=CC(=O)C1Cl Amb24634012 [0,1,0,1,0,0|1,0,1]=4 8084 B8R1.50 CC1CCC(=O)C1=O Amb22233560 [0,1,0,1,0,0|1,0,1]=4 8085 B8R1.50 CC1CCC(=O)C1Br Amb24356701 [0,1,0,1,0,0|1,0,0]=3 8086 B8R1.50 CC1CCC(=O)C1N Amb25675652 [0,1,0,1,0,0|1,0,0]=3 8087 B8R1.50 CC1CCC(=O)C1O Amb25773264 [0,1,0,1,0,0|1,0,0]=3 8088 B8R1.50 CC1CCC(=O)N1C Amb15693449 [0,1,0,1,0,0|2,0,0]=4 8089 B8R1.50 CC1CCC(O)C1C Amb24406635 [0,1,0,1,0,0|1,0,1]=4 8090 B8R1.50 CC1CCC(O)[C@H]1O Amb24642421 [0,1,0,1,0,0|1,0,1]=4 8091 B8R1.50 CC1CNC(=O)C1Cl Amb24610736 [0,1,0,1,0,0|1,0,0]=3 8092 B8R1.50 CC1CNC(=S)C1O Amb24482492 [0,1,0,1,0,0|1,1,0]=4 8093 B8R1.50 CC1COC(=O)C1Cl Amb25240615 [0,1,0,1,0,0|0,0,0]=2 8094 B8R1.50 CC1COC(=O)C1N Amb24482307 [0,1,0,1,0,0|0,0,0]=2 8095 B8R1.50 CC1COC(=S)N1C Amb24524261 [0,1,0,1,0,0|1,1,0]=4 8096 B8R1.50 CC1CSC(=O)C1N Amb25169595 [0,1,0,1,0,0|0,1,0]=3 8097 B8R1.50 CC1NNC(=O)C1O Amb25739720 [0,1,0,1,0,0|2,0,0]=4 8098 B8R1.50 CC1OCC(=O)C1N Amb24601568 [0,1,0,1,0,0|2,0,0]=4 8099 B8R1.50 CC1ONC(=O)C1N Amb25063865 [0,1,0,1,0,0|2,0,0]=4 8100 B8R1.50 CC1SOC(=O)C1N Amb24665733 [0,1,0,1,0,0|1,0,0]=3 8101 B8R1.50 CC=1C(=O)OCC1C Amb25859061 [0,1,0,1,0,0|0,0,2]=4 8102 B8R1.50 CC=1COC(=O)C1N Amb25025754 [0,1,0,1,0,0|0,0,2]=4 8103 B8R1.50 CC=1COC(=O)C1O Amb23571854 [0,1,0,1,0,0|0,0,2]=4 8104 B8R1.50 C[C@@H]1C(=O)CCN1C Amb18833064 [0,1,0,1,0,0|2,0,0]=4 8105 B8R1.50 C[C@@H]1C(O)OC[C@@H]1C Amb24735043 [0,1,0,1,0,0|0,0,2]=4 8106 B8R1.50 C[C@@H]1CCC(=O)C1=O Amb24357250 [0,1,0,1,0,0|1,0,1]=4 8107 B8R1.50 C[C@@H]1CCC(=O)C1C Amb25834175 [0,1,0,1,0,0|1,0,0]=3 8108 B8R1.50 C[C@@H]1CCC(=O)[C@H]1Br Amb24706631 [0,1,0,1,0,0|1,0,0]=3 8109 B8R1.50 C[C@@H]1CC[C@@H](O)[C@@H]1O Amb25218831 [0,1,0,1,0,0|1,0,1]=4 8110 B8R1.50 C[C@@H]1CC[C@@H](O)[C@H]1C Amb24619635 [0,1,0,1,0,0|1,0,1]=4 8111 B8R1.50 C[C@@H]1CC[C@@H](O)[C@H]1N Amb25366548 [0,1,0,1,0,0|1,0,1]=4 8112 B8R1.50 C[C@@H]1COC(=O)[C@H]1N Amb25216668 [0,1,0,1,0,0|0,0,0]=2 8113 B8R1.50 C[C@@H]1NNC(=O)[C@@H]1O Amb24599440 [0,1,0,1,0,0|2,0,0]=4 8114 B8R1.50 C[C@@H]1[C@@H](O)COC1=O Amb25176469 [0,1,0,1,0,0|1,0,0]=3 8115 B8R1.50 C[C@H]1C(=O)CCN1C Amb25762428 [0,1,0,1,0,0|2,0,0]=4 8116 B8R1.50 C[C@H]1C=CC(=O)[C@@H]1O Amb25024971 [0,1,0,1,0,0|1,0,1]=4 8117 B8R1.50 C[C@H]1C=CC(=O)[C@H]1C Amb25373043 [0,1,0,1,0,0|1,0,1]=4 8118 B8R1.50 C[C@H]1C=CC(=O)[C@H]1Cl Amb25348042 [0,1,0,1,0,0|1,0,1]=4 8119 B8R1.50 C[C@H]1CCC(=O)C1=C Amb24737469 [0,1,0,1,0,0|1,0,1]=4 8120 B8R1.50 C[C@H]1CCC(=O)[C@H]1Br Amb25286608 [0,1,0,1,0,0|1,0,0]=3 8121 B8R1.50 C[C@H]1CCC(=O)[C@H]1C Amb24557180 [0,1,0,1,0,0|1,0,0]=3 8122 B8R1.50 C[C@H]1CCC(=O)[C@H]1Cl Amb24544320 [0,1,0,1,0,0|1,0,0]=3 8123 B8R1.50 C[C@H]1CCC(O)[C@@H]1C Amb25357992 [0,1,0,1,0,0|1,0,1]=4 8124 B8R1.50 C[C@H]1CNC(=S)[C@H]1O Amb24581277 [0,1,0,1,0,0|1,1,0]=4 8125 B8R1.50 C[C@H]1COC(=O)[C@@H]1N Amb25339475 [0,1,0,1,0,0|0,0,0]=2 8126 B8R1.50 C[C@H]1COC(=O)[C@@H]1O Amb25320667 [0,1,0,1,0,0|0,0,0]=2 8127 B8R1.50 C[C@H]1OCC(=O)[C@@H]1O Amb25026255 [0,1,0,1,0,0|2,0,0]=4 8128 B8R1.50 C[C@H]1ONC(=O)[C@H]1N Amb24514974 [0,1,0,1,0,0|2,0,0]=4 8129 B8R1.50 C[C@H]1[C@@H](C)CNC1=O Amb24761480 [0,1,0,1,0,0|1,0,0]=3 8130 B8R1.50 C[C@H]1[C@H](N)COC1=O Amb24514746 [0,1,0,1,0,0|1,0,0]=3 8131 B8R1.50 C[C@H]1[C@H](O)CCC1=O Amb24631662 [0,1,0,1,0,0|2,0,0]=4 8132 B8R1.50 C[C@H]1[C@H](O)OC[C@H]1C Amb24620807 [0,1,0,1,0,0|0,0,2]=4 8133 B8R1.50 NC1C(N)CNC1=O Amb18641832 [0,1,0,1,0,0|2,0,0]=4 8134 B8R1.50 NC1C(O)CNC1=O Amb24374633 [0,1,0,1,0,0|2,0,0]=4 8135 B8R1.50 NC1C(O)COC1=O Amb25746355 [0,1,0,1,0,0|1,0,0]=3 8136 B8R1.50 NC1CNC(=O)C1O Amb24481564 [0,1,0,1,0,0|2,0,0]=4 8137 B8R1.50 NC1COC(=O)C1O Amb24724728 [0,1,0,1,0,0|1,0,0]=3 8138 B8R1.50 N[C@@H]1[C@@H](O)CNC1=O Amb24612410 [0,1,0,1,0,0|2,0,0]=4 8139 B8R1.50 N[C@@H]1[C@H](O)COC1=O Amb25260781 [0,1,0,1,0,0|1,0,0]=3 8140 B8R1.50 N[C@H]1CNC(=O)[C@@H]1O Amb24612411 [0,1,0,1,0,0|2,0,0]=4 8141 B8R1.50 N[C@H]1[C@@H](O)COC1=O Amb24697759 [0,1,0,1,0,0|1,0,0]=3 8142 B8R1.50 N[C@H]1[C@H](N)CNC1=O Amb24566659 [0,1,0,1,0,0|2,0,0]=4 8143 B8R1.50 O=C1C(Br)COC1=O Amb25760646 [0,1,0,1,0,0|1,0,1]=4 8144 B8R1.50 OC1C(=O)COC1=O Amb25143349 [0,1,0,1,0,0|1,0,1]=4 8145 B8R1.50 OC1C(F)COC1=O Amb25831080 [0,1,0,1,0,0|1,0,0]=3 8146 B8R1.50 OC1C(O)COC1=O Amb22730078 [0,1,0,1,0,0|1,0,0]=3 8147 B8R1.50 OC1CCC(=O)C1O Amb24627902 [0,1,0,1,0,0|2,0,0]=4 8148 B8R1.50 OC1COC(=O)C1Br Amb24482051 [0,1,0,1,0,0|1,0,0]=3 8149 B8R1.50 OC1COC(=O)C1F Amb24529261 [0,1,0,1,0,0|1,0,0]=3 8150 B8R1.50 O[C@@H]1[C@@H](O)COC1=O Amb15692412 [0,1,0,1,0,0|1,0,0]=3 8151 B8R1.50 O[C@H]1COC(=O)[C@H]1Br Amb10067848 [0,1,0,1,0,0|1,0,0]=3 8152 B8R1.50 O[C@H]1[C@H](F)COC1=O Amb25356232 [0,1,0,1,0,0|1,0,0]=3 8153 B8R1.50 O[C@H]1[C@H](O)COC1=O Amb24609731 [0,1,0,1,0,0|1,0,0]=3 8154 B8R1.54 C=C(C1CC1)C(O)=O Amb24481397 [0,1,0,1,0,0|0,0,1]=3 8155 B8R1.54 CC(=O)C(=O)C1CC1 Amb20241141 [0,1,0,1,0,0|1,0,1]=4 8156 B8R1.54 CC(C(=O)O)C1CC1 Amb17087493 [0,1,0,1,0,0|0,0,0]=2 8157 B8R1.54 CC(C(O)=O)=C1CC1 Amb24450586 [0,1,0,1,0,0|0,0,2]=4 8158 B8R1.54 CC(C)C(O)C1CO1 Amb25117792 [0,1,0,1,0,0|1,0,1]=4 8159 B8R1.54 CC(C)[C@@H](O)[C@H]1CO1 Amb25176736 [0,1,0,1,0,0|1,0,1]=4 8160 B8R1.54 CC(C)[C@H](O)[C@H]1CO1 Amb25296359 [0,1,0,1,0,0|1,0,1]=4 8161 B8R1.54 CC(C1CC1)C(=O)Cl Amb25244618 [0,1,0,1,0,0|1,0,0]=3 8162 B8R1.54 CC(C1CC1)C(C)=O Amb25798488 [0,1,0,1,0,0|1,0,0]=3 8163 B8R1.54 CC(C1CC1)C(N)=N Amb23443623 [0,1,0,1,0,0|2,0,0]=4 8164 B8R1.54 CC(C1CC1)C(N)=O Amb23443624 [0,1,0,1,0,0|1,0,0]=3 8165 B8R1.54 CC(C1CC1)C(N)=S Amb23443616 [0,1,0,1,0,0|1,1,0]=4 8166 B8R1.54 C[C@@H](O)[C@H](N)C1CC1 Amb24604396 [0,1,0,1,0,0|1,0,1]=4 8167 B8R1.54 NC(=O)C(O)C1CC1 Amb20630809 [0,1,0,1,0,0|1,0,0]=3 8168 B8R1.54 NC(C1CC1)C(=O)Cl Amb25733572 [0,1,0,1,0,0|1,0,0]=3 8169 B8R1.54 NC(C1CC1)C(N)=O Amb18282442 [0,1,0,1,0,0|1,0,0]=3 8170 B8R1.54 NC(C1CC1)C(O)=O Amb19515010 [0,1,0,1,0,0|0,0,0]=2 8171 B8R1.54 N[C@@H](C1CC1)C(O)=O Amb19929447 [0,1,0,1,0,0|0,0,0]=2 8172 B8R1.54 O=C(C(=O)O)C1CC1 Amb16233327 [0,1,0,1,0,0|0,0,1]=3 8173 B8R1.54 OC(=O)C(Br)C1CC1 Amb24634830 [0,1,0,1,0,0|0,0,0]=2 8174 B8R1.54 OC(=O)C(Cl)=C1CC1 Amb24427356 [0,1,0,1,0,0|0,0,2]=4 8175 B8R1.54 OC(=O)C(Cl)C1CC1 Amb24333436 [0,1,0,1,0,0|0,0,0]=2 8176 B8R1.54 OC(C1CC1)C(O)=O Amb18282441 [0,1,0,1,0,0|0,0,0]=2 8177 B8R1.54 O[C@@H](C1CC1)C(O)=O Amb25312037 [0,1,0,1,0,0|0,0,0]=2 8178 B8R1.54 O[C@H](C1CC1)C(O)=O Amb25715899 [0,1,0,1,0,0|0,0,0]=2 8179 B8R1.54 [O-]C(=O)C(=O)C1CC1 Amb22641890 [0,1,0,1,0,0|0,0,2]=4 8180 B8R2.4 O=C1CC2CC1C2 Amb24426322 [0,0,0,2,0,0|1,0,0]=3 8181 B8R2.4 O[C@@H]1C[C@H]2C[C@@H]1C2 Amb25272289 [0,0,0,2,0,0|1,0,1]=4 8182 B8R2.18 O=C1CC2CC2C1 Amb25750119 [0,0,0,2,0,0|1,0,0]=3 8183 B8R2.18 O=C1CC2OC2C1 Amb25050255 [0,0,0,2,0,0|2,0,0]=4 8184 B8R2.18 O=C1C[C@@H]2O[C@@H]2C1 Amb25768575 [0,0,0,2,0,0|2,0,0]=4 8185 B8R2.18 OC1CC2CC2C1 Amb21864713 [0,0,0,2,0,0|1,0,1]=4 8186 B8R2.18 O[C@@H]1C[C@@H]2C[C@@H]2C1 Amb22746717 [0,0,0,2,0,0|1,0,1]=4 8187 B8R2.18 O[C@@H]1C[C@H]2C[C@H]2C1 Amb24576455 [0,0,0,2,0,0|1,0,1]=4 8188 B8R2.38 O=C1CCC2CC12 Amb22736104 [0,0,0,2,0,0|1,0,0]=3 8189 B8R2.38 O=C1CC[C@@H]2C[C@H]12 Amb24623125 [0,0,0,2,0,0|1,0,0]=3 8190 B8R2.38 O=C1CC[C@@H]2O[C@H]12 Amb25025235 [0,0,0,2,0,0|2,0,0]=4 8191 B8R2.38 O=C1CNC2CC12 Amb25104969 [0,0,0,2,0,0|2,0,0]=4 8192 B8R2.38 O=C1NCC2CC12 Amb22546330 [0,0,0,2,0,0|1,0,0]=3 8193 B8R2.38 O=C1NC[C@H]2C[C@@H]12 Amb24654659 [0,0,0,2,0,0|1,0,0]=3 8194 B8R2.38 O=C1NC[C@H]2O[C@@H]12 Amb25261527 [0,0,0,2,0,0|2,0,0]=4 8195 B8R2.38 O=C1OCC2CC12 Amb24113373 [0,0,0,2,0,0|0,0,0]=2 8196 B8R2.38 O=C1OCC2OC12 Amb24061718 [0,0,0,2,0,0|1,0,0]=3 8197 B8R2.38 OC1CCC2CC21 Amb25040476 [0,0,0,2,0,0|1,0,1]=4 8198 B8R2.38 OC1CC[C@@H]2C[C@@H]21 Amb25128724 [0,0,0,2,0,0|1,0,1]=4 8199 B8R2.38 OC1CC[C@H]2C[C@H]21 Amb25240579 [0,0,0,2,0,0|1,0,1]=4 8200 B8R2.38 OC1OC[C@H]2C[C@H]21 Amb25175311 [0,0,0,2,0,0|0,0,2]=4 8201 B8R2.38 O[C@H]1CC[C@@H]2C[C@@H]21 Amb25811014 [0,0,0,2,0,0|1,0,1]=4 8202 B8R2.66 CC(=O)C12CC1C2 Amb25723785 [0,0,0,2,0,0|1,0,0]=3 8203 B8R2.66 OC(=O)C12CC1C2 Amb24732235 [0,0,0,2,0,0|0,0,0]=2 8204 B8R2.53 O=C1CC2(C1)CC2 Amb24106341 [0,0,0,2,0,0|1,0,0]=3 8205 B8R2.24 C(C1CO1)C2CC2 Amb25088515 [0,0,0,2,0,0|1,0,1]=4 8206 B8R0.28 CC(=C)\C=C\CC(O)=O Amb18642409 [0,0,0,0,0,2|0,0,2]=4 8207 B8R0.28 CC(=N)NCCC(O)=O Amb25836109 [0,0,0,0,0,2|1,0,1]=4 8208 B8R0.28 CC(=O)CC=C=C(C)C Amb17593280 [0,0,0,0,0,2|1,0,1]=4 8209 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [0,0,0,0,0,2|1,0,1]=4 8210 B8R0.28 CC(=O)CCO[SiH](C)C Amb25233637 [0,0,0,0,0,2|1,1,0]=4 8211 B8R0.28 CC(=O)CNCC(O)=O Amb24375747 [0,0,0,0,0,2|1,0,1]=4 8212 B8R0.28 CC(=O)C\C=C/N(C)C Amb25335355 [0,0,0,0,0,2|2,0,0]=4 8213 B8R0.28 CC(=O)C\C=C\C(=O)O Amb16232091 [0,0,0,0,0,2|1,0,1]=4 8214 B8R0.28 CC(=O)OCCC(O)=O Amb18642866 [0,0,0,0,0,2|1,0,1]=4 8215 B8R0.28 CC(=O)SCC=C(C)C Amb17617246 [0,0,0,0,0,2|1,0,1]=4 8216 B8R0.28 CC(=O)\C=C\CN(C)C Amb24557401 [0,0,0,0,0,2|2,0,0]=4 8217 B8R0.28 CC(=O)\C=N/CC(O)=O Amb25347610 [0,0,0,0,0,2|1,0,1]=4 8218 B8R0.28 CC(=S)SCCC(O)=O Amb24480281 [0,0,0,0,0,2|1,0,1]=4 8219 B8R0.28 CC(Br)=CCCC(O)=O Amb25200944 [0,0,0,0,0,2|1,0,1]=4 8220 B8R0.28 CC(Br)CCCC(=O)Cl Amb25364942 [0,0,0,0,0,2|2,0,0]=4 8221 B8R0.28 CC(Br)CCCC(C)=O Amb24340312 [0,0,0,0,0,2|2,0,0]=4 8222 B8R0.28 CC(Br)CCCC(O)=O Amb24480052 [0,0,0,0,0,2|1,0,0]=3 8223 B8R0.28 CC(Br)CCNC(C)=O Amb24618949 [0,0,0,0,0,2|2,0,0]=4 8224 B8R0.28 CC(Br)CCOC(C)=O Amb24626624 [0,0,0,0,0,2|2,0,0]=4 8225 B8R0.28 CC(C)/C=C/CC(O)=O Amb17844074 [0,0,0,0,0,2|0,0,0]=2 8226 B8R0.28 CC(C)=CC#CC(O)=O Amb24670652 [0,0,0,0,0,2|0,0,2]=4 8227 B8R0.28 CC(C)=CCCC(N)=O Amb24655596 [0,0,0,0,0,2|1,0,1]=4 8228 B8R0.28 CC(C)=CCNC(N)=O Amb25858742 [0,0,0,0,0,2|1,0,1]=4 8229 B8R0.28 CC(C)=CCOC(=O)Cl Amb24455011 [0,0,0,0,0,2|1,0,1]=4 8230 B8R0.28 CC(C)=CCOC(C)=O Amb22002433 [0,0,0,0,0,2|1,0,1]=4 8231 B8R0.28 CC(C)=CCOC(N)=O Amb25378568 [0,0,0,0,0,2|1,0,1]=4 8232 B8R0.28 CC(C)=COCC(C)=O Amb24389019 [0,0,0,0,0,2|1,0,1]=4 8233 B8R0.28 CC(C)=C\C=C\C(O)=O Amb18642414 [0,0,0,0,0,2|0,0,2]=4 8234 B8R0.28 CC(C)C=C=CC(C)=O Amb25834315 [0,0,0,0,0,2|1,0,1]=4 8235 B8R0.28 CC(C)C=NNC(C)=O Amb24481921 [0,0,0,0,0,2|1,0,1]=4 8236 B8R0.28 CC(C)CCCB(O)O Amb24593360 [0,0,0,0,0,2|1,0,1]=4 8237 B8R0.28 CC(C)CCCC(=O)Cl Amb24477882 [0,0,0,0,0,2|1,0,0]=3 8238 B8R0.28 CC(C)CCCC(C)=C Amb22228386 [0,0,0,0,0,2|2,0,0]=4 8239 B8R0.28 CC(C)CCCC(N)=N Amb23569433 [0,0,0,0,0,2|2,0,0]=4 8240 B8R0.28 CC(C)CCCC(N)=O Amb24579456 [0,0,0,0,0,2|1,0,0]=3 8241 B8R0.28 CC(C)CCCS(C)=O Amb24577266 [0,0,0,0,0,2|2,0,0]=4 8242 B8R0.28 CC(C)CCC[C@@H](C)O Amb22746847 [0,0,0,0,0,2|1,0,1]=4 8243 B8R0.28 CC(C)CCNC(=O)Cl Amb25378849 [0,0,0,0,0,2|1,0,0]=3 8244 B8R0.28 CC(C)CCNC(C)=S Amb25298880 [0,0,0,0,0,2|1,1,0]=4 8245 B8R0.28 CC(C)CCNC(N)=N Amb20631267 [0,0,0,0,0,2|2,0,0]=4 8246 B8R0.28 CC(C)CCNC(N)=N Amb24524670 [0,0,0,0,0,2|2,0,0]=4 8247 B8R0.28 CC(C)CCOC(N)=O Amb25299964 [0,0,0,0,0,2|1,0,0]=3 8248 B8R0.28 CC(C)CCOC(N)=S Amb25785397 [0,0,0,0,0,2|1,1,0]=4 8249 B8R0.28 CC(C)CCOC([S-])=S Amb19748289 [0,0,0,0,0,2|0,2,0]=4 8250 B8R0.28 CC(C)CCOS([O-])=O Amb24524507 [0,0,0,0,0,2|1,0,1]=4 8251 B8R0.28 CC(C)CCSC(N)=N Amb20676007 [0,0,0,0,0,2|2,0,0]=4 8252 B8R0.28 CC(C)CCSC(N)=O Amb24680835 [0,0,0,0,0,2|1,0,0]=3 8253 B8R0.28 CC(C)CNCC(=C)Br Amb19005215 [0,0,0,0,0,2|2,0,0]=4 8254 B8R0.28 CC(C)CNCC(=C)Cl Amb19004837 [0,0,0,0,0,2|2,0,0]=4 8255 B8R0.28 CC(C)CNCC(C)=O Amb25067661 [0,0,0,0,0,2|1,0,0]=3 8256 B8R0.28 CC(C)CNCC(O)=O Amb19373106 [0,0,0,0,0,2|0,0,0]=2 8257 B8R0.28 CC(C)CNCS(O)=O Amb24478690 [0,0,0,0,0,2|1,0,0]=3 8258 B8R0.28 CC(C)CNC[C@@H](C)O Amb25135487 [0,0,0,0,0,2|1,0,1]=4 8259 B8R0.28 CC(C)CNC[C@H](C)O Amb25079110 [0,0,0,0,0,2|1,0,1]=4 8260 B8R0.28 CC(C)CNN=C(C)C Amb24749343 [0,0,0,0,0,2|2,0,0]=4 8261 B8R0.28 CC(C)CNNC(N)=O Amb24359844 [0,0,0,0,0,2|1,0,0]=3 8262 B8R0.28 CC(C)COC[C@@H](C)O Amb24423772 [0,0,0,0,0,2|1,0,1]=4 8263 B8R0.28 CC(C)CONS(C)=O Amb24551950 [0,0,0,0,0,2|2,0,0]=4 8264 B8R0.28 CC(C)CSCC(C)=C Amb24371809 [0,0,0,0,0,2|2,0,0]=4 8265 B8R0.28 CC(C)CSCC(N)=O Amb25283648 [0,0,0,0,0,2|1,0,0]=3 8266 B8R0.28 CC(C)C\C=C\B(O)O Amb21856369 [0,0,0,0,0,2|1,0,1]=4 8267 B8R0.28 CC(C)C\C=C\C(N)=O Amb25731688 [0,0,0,0,0,2|1,0,0]=3 8268 B8R0.28 CC(C)C\C=C\[C@@H](C)O Amb25720117 [0,0,0,0,0,2|1,0,1]=4 8269 B8R0.28 CC(C)N=CCC(C)=O Amb25198123 [0,0,0,0,0,2|1,0,0]=3 8270 B8R0.28 CC(C)NCC=C(C)C Amb18642550 [0,0,0,0,0,2|2,0,0]=4 8271 B8R0.28 CC(C)NCCC(C)=C Amb19025196 [0,0,0,0,0,2|2,0,0]=4 8272 B8R0.28 CC(C)NCCC(C)O Amb24117028 [0,0,0,0,0,2|1,0,1]=4 8273 B8R0.28 CC(C)NCCC(N)=N Amb25162018 [0,0,0,0,0,2|2,0,0]=4 8274 B8R0.28 CC(C)NCC[C@@H](C)O Amb24351618 [0,0,0,0,0,2|1,0,1]=4 8275 B8R0.28 CC(C)NCSC(C)=O Amb25314413 [0,0,0,0,0,2|1,0,0]=3 8276 B8R0.28 CC(C)NOCC(C)=C Amb24539135 [0,0,0,0,0,2|2,0,0]=4 8277 B8R0.28 CC(C)N\C=C\C(O)=O Amb24623070 [0,0,0,0,0,2|0,0,1]=3 8278 B8R0.28 CC(C)OCCC(=O)Cl Amb24423336 [0,0,0,0,0,2|1,0,0]=3 8279 B8R0.28 CC(C)OCCC(C)=O Amb22229804 [0,0,0,0,0,2|1,0,0]=3 8280 B8R0.28 CC(C)OCCC(N)=O Amb25783535 [0,0,0,0,0,2|1,0,0]=3 8281 B8R0.28 CC(C)OCCS(O)=O Amb24551322 [0,0,0,0,0,2|1,0,0]=3 8282 B8R0.28 CC(C)OCC[C@H](C)O Amb25090046 [0,0,0,0,0,2|1,0,1]=4 8283 B8R0.28 CC(C)OCSC(N)=N Amb25366389 [0,0,0,0,0,2|2,0,0]=4 8284 B8R0.28 CC(C)ONCC(=C)Br Amb24600754 [0,0,0,0,0,2|2,0,0]=4 8285 B8R0.28 CC(C)ONCC(=C)Cl Amb24432081 [0,0,0,0,0,2|2,0,0]=4 8286 B8R0.28 CC(C)ONCC(C)=C Amb25279062 [0,0,0,0,0,2|2,0,0]=4 8287 B8R0.28 CC(C)ONCC(C)O Amb25272674 [0,0,0,0,0,2|1,0,1]=4 8288 B8R0.28 CC(C)ONCC(O)=O Amb24690245 [0,0,0,0,0,2|0,0,0]=2 8289 B8R0.28 CC(C)O\C=C\C(O)=O Amb25731158 [0,0,0,0,0,2|0,0,1]=3 8290 B8R0.28 CC(C)SCCC(N)=O Amb25739954 [0,0,0,0,0,2|1,0,0]=3 8291 B8R0.28 CC(C)SCC[N+]([O-])=O Amb24407962 [0,0,0,0,0,2|1,0,1]=4 8292 B8R0.28 CC(C)SNCC(N)=O Amb25118863 [0,0,0,0,0,2|1,0,0]=3 8293 B8R0.28 CC(C)SSCC(O)=O Amb24425479 [0,0,0,0,0,2|0,0,0]=2 8294 B8R0.28 CC(C)\C=C\CC(C)O Amb25700152 [0,0,0,0,0,2|1,0,1]=4 8295 B8R0.28 CC(C)\C=C\NC(C)=O Amb24761262 [0,0,0,0,0,2|1,0,1]=4 8296 B8R0.28 CC(C)\C=C\NC(N)=O Amb24578881 [0,0,0,0,0,2|1,0,1]=4 8297 B8R0.28 CC(C)\N=C\CC(C)=O Amb25773461 [0,0,0,0,0,2|1,0,0]=3 8298 B8R0.28 CC(CCCC(=O)O)O Amb2371277 [0,0,0,0,0,2|1,0,0]=3 8299 B8R0.28 CC(CCCC(=O)[O-])O Amb17615415 [0,0,0,0,0,2|1,0,1]=4 8300 B8R0.28 CC(CCNC(=O)N)C Amb1104833 [0,0,0,0,0,2|1,0,0]=3 8301 B8R0.28 CC(CCOC(=S)[S-])C Amb13777309 [0,0,0,0,0,2|0,2,0]=4 8302 B8R0.28 CC(CNCC(=C)C)C Amb17308640 [0,0,0,0,0,2|2,0,0]=4 8303 B8R0.28 CC(CNCC(=O)N)C Amb1118171 [0,0,0,0,0,2|1,0,0]=3 8304 B8R0.28 CC(CNSC(=S)N)C Amb10565824 [0,0,0,0,0,2|1,1,0]=4 8305 B8R0.28 CC(COCC(=O)N)C Amb2131093 [0,0,0,0,0,2|1,0,0]=3 8306 B8R0.28 CC(CSCC(=O)O)C Amb1134811 [0,0,0,0,0,2|0,0,0]=2 8307 B8R0.28 CC(Cl)CCCC(C)=O Amb25724389 [0,0,0,0,0,2|2,0,0]=4 8308 B8R0.28 CC(Cl)CCCC(O)=O Amb24740888 [0,0,0,0,0,2|1,0,0]=3 8309 B8R0.28 CC(Cl)CCSC(C)=O Amb25146226 [0,0,0,0,0,2|2,0,0]=4 8310 B8R0.28 CC(Cl)COCC(O)=O Amb24480258 [0,0,0,0,0,2|1,0,0]=3 8311 B8R0.28 CC(F)CCOC(C)=O Amb24481945 [0,0,0,0,0,2|2,0,0]=4 8312 B8R0.28 CC(F)COCC(C)=O Amb25178543 [0,0,0,0,0,2|2,0,0]=4 8313 B8R0.28 CC(N)CCCC(O)=O Amb22059416 [0,0,0,0,0,2|1,0,0]=3 8314 B8R0.28 CC(N)CCNC(C)=O Amb24384456 [0,0,0,0,0,2|2,0,0]=4 8315 B8R0.28 CC(N)COCC(O)=O Amb25368702 [0,0,0,0,0,2|1,0,0]=3 8316 B8R0.28 CC(NCCC(=O)O)C Amb1106349 [0,0,0,0,0,2|0,0,0]=2 8317 B8R0.28 CC(NCCC(=S)N)C Amb17232016 [0,0,0,0,0,2|1,1,0]=4 8318 B8R0.28 CC(O)CCCC(C)=O Amb24340114 [0,0,0,0,0,2|2,0,0]=4 8319 B8R0.28 CC(O)CCCC(N)=O Amb24622764 [0,0,0,0,0,2|2,0,0]=4 8320 B8R0.28 CC(O)CCOC(N)=O Amb25293990 [0,0,0,0,0,2|2,0,0]=4 8321 B8R0.28 CC(O)CCSC(C)=O Amb25846896 [0,0,0,0,0,2|2,0,0]=4 8322 B8R0.28 CC(O)CNCC(C)=O Amb24589662 [0,0,0,0,0,2|2,0,0]=4 8323 B8R0.28 CC(O)CONC(N)=O Amb24604387 [0,0,0,0,0,2|2,0,0]=4 8324 B8R0.28 CC(O)CSCC(N)=O Amb25690591 [0,0,0,0,0,2|2,0,0]=4 8325 B8R0.28 CC(O)CSCC(O)=O Amb19005278 [0,0,0,0,0,2|1,0,0]=3 8326 B8R0.28 CC(O)C\C=C\C(O)=O Amb18642771 [0,0,0,0,0,2|1,0,0]=3 8327 B8R0.28 CC(O)NCCC(N)=O Amb24446895 [0,0,0,0,0,2|2,0,0]=4 8328 B8R0.28 CC(S)CCOC(C)=O Amb25077156 [0,0,0,0,0,2|2,0,0]=4 8329 B8R0.28 CC(S)\C=C/CC(O)=O Amb18644289 [0,0,0,0,0,2|1,0,0]=3 8330 B8R0.28 CC(S)\C=C\CC(O)=O Amb24514919 [0,0,0,0,0,2|1,0,0]=3 8331 B8R0.28 CC(SCCC(=S)N)C Amb17307561 [0,0,0,0,0,2|1,1,0]=4 8332 B8R0.28 CN(C)C=NCC(O)=O Amb24740176 [0,0,0,0,0,2|1,0,0]=3 8333 B8R0.28 CN(C)CC#CC(O)=O Amb24471923 [0,0,0,0,0,2|1,0,0]=3 8334 B8R0.28 CN(C)CCNC(O)=S Amb25106929 [0,0,0,0,0,2|1,1,0]=4 8335 B8R0.28 CN(C)C\C=C\C(=O)Cl Amb22274553 [0,0,0,0,0,2|2,0,0]=4 8336 B8R0.28 CN(C)C\C=C\C(N)=O Amb24476695 [0,0,0,0,0,2|2,0,0]=4 8337 B8R0.28 CN(C)NCCC(O)=O Amb24113891 [0,0,0,0,0,2|1,0,0]=3 8338 B8R0.28 CN(C)N\C=C\C(O)=O Amb24383674 [0,0,0,0,0,2|1,0,1]=4 8339 B8R0.28 CN(CCNC(=O)N)C Amb1129425 [0,0,0,0,0,2|2,0,0]=4 8340 B8R0.28 CN(C\C=C\C(=O)O)C Amb15695416 [0,0,0,0,0,2|1,0,0]=3 8341 B8R0.28 CS(=O)CCCC(O)=O Amb18306076 [0,0,0,0,0,2|2,0,0]=4 8342 B8R0.28 CS(=O)C\C=C\C(O)=O Amb24586059 [0,0,0,0,0,2|2,0,0]=4 8343 B8R0.28 CS(=O)NOCC(O)=O Amb24588744 [0,0,0,0,0,2|2,0,0]=4 8344 B8R0.28 C[C@@H](N)CCCC(O)=O Amb24435680 [0,0,0,0,0,2|1,0,0]=3 8345 B8R0.28 C[C@@H](N)COCC(O)=O Amb24641471 [0,0,0,0,0,2|1,0,0]=3 8346 B8R0.28 C[C@@H](O)CCOC(C)=O Amb25357488 [0,0,0,0,0,2|2,0,0]=4 8347 B8R0.28 C[C@@H](O)CNCC(N)=O Amb25260382 [0,0,0,0,0,2|2,0,0]=4 8348 B8R0.28 C[C@@H](O)CSCC(N)=O Amb25799456 [0,0,0,0,0,2|2,0,0]=4 8349 B8R0.28 C[C@@H](O)C\C=C\C(O)=O Amb25250610 [0,0,0,0,0,2|1,0,0]=3 8350 B8R0.28 C[C@H](N)COCC(O)=O Amb25305053 [0,0,0,0,0,2|1,0,0]=3 8351 B8R0.28 C[C@H](N)CSCC(N)=O Amb25054209 [0,0,0,0,0,2|2,0,0]=4 8352 B8R0.28 C[C@H](O)CC#CC(O)=O Amb24627681 [0,0,0,0,0,2|1,0,0]=3 8353 B8R0.28 C[C@H](O)CCCC(O)=O Amb25842809 [0,0,0,0,0,2|1,0,0]=3 8354 B8R0.28 C[C@H](O)CCNC(N)=O Amb25272281 [0,0,0,0,0,2|2,0,0]=4 8355 B8R0.28 C[C@H](O)CSCC(N)=O Amb25202527 [0,0,0,0,0,2|2,0,0]=4 8356 B8R0.28 OC(=O)CCC=C(C)C Amb10601609 [0,0,0,0,0,2|0,0,1]=3 8357 B8R0.28 OC(=O)CCCC(Cl)Cl Amb24479944 [0,0,0,0,0,2|2,0,0]=4 8358 B8R0.28 OC(=O)CCCC(F)F Amb24117996 [0,0,0,0,0,2|2,0,0]=4 8359 B8R0.28 OC(=O)CCNC(=O)C Amb1104704 [0,0,0,0,0,2|1,0,1]=4 8360 B8R0.28 OC(=O)CCOC(F)F Amb25342869 [0,0,0,0,0,2|2,0,0]=4 8361 B8R0.28 OC(=O)CCSC(=O)C Amb17607685 [0,0,0,0,0,2|1,0,1]=4 8362 B8R0.28 OC(=O)CNCC(F)F Amb24433048 [0,0,0,0,0,2|2,0,0]=4 8363 B8R0.28 OC(=O)CSCC(F)F Amb18791606 [0,0,0,0,0,2|2,0,0]=4 8364 B8R0.28 OC(=O)CSSC(Cl)Cl Amb24390437 [0,0,0,0,0,2|2,0,0]=4 8365 B8R0.28 OC(O)CCCC(O)=O Amb25205498 [0,0,0,0,0,2|2,0,0]=4