0 B7R0.6 BrC(Br)=NN=C(Br)Br Amb19890629 [0,0,0,0,0,0|4,0,0]=4 1 B7R0.6 C=C(Cl)CCC(N)=O Amb25843741 [0,0,0,0,0,0|4,0,0]=4 2 B7R0.6 CC(=C)\C=C\C(N)=O Amb25259797 [0,0,0,0,0,0|4,0,0]=4 3 B7R0.6 CC(=NNC(=O)C)C Amb1047247 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.6 CC(=O)C=CC(C)=O Amb22346013 [0,0,0,0,0,0|4,0,0]=4 5 B7R0.6 CC(=O)CCC(=O)Cl Amb17142859 [0,0,0,0,0,0|4,0,0]=4 6 B7R0.6 CC(=O)CCC(=O)N Amb17142854 [0,0,0,0,0,0|3,0,0]=3 7 B7R0.6 CC(=O)CCC([O-])=O Amb22350071 [0,0,0,0,0,0|4,0,0]=4 8 B7R0.6 CC(=O)CNC(N)=O Amb24697691 [0,0,0,0,0,0|2,0,1]=3 9 B7R0.6 CC(=O)CSC(N)=N Amb24084924 [0,0,0,0,0,0|4,0,0]=4 10 B7R0.6 CC(=O)CSC(N)=S Amb25044427 [0,0,0,0,0,0|3,1,0]=4 11 B7R0.6 CC(=O)NCC(=O)N Amb17231824 [0,0,0,0,0,0|2,0,1]=3 12 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [0,0,0,0,0,0|3,0,1]=4 13 B7R0.6 CC(=O)NCC(=S)N Amb17231879 [0,0,0,0,0,0|2,1,1]=4 14 B7R0.6 CC(=O)NNC(=S)N Amb2543737 [0,0,0,0,0,0|1,1,2]=4 15 B7R0.6 CC(=O)OC=C(C)N Amb24573507 [0,0,0,0,0,0|4,0,0]=4 16 B7R0.6 CC(=O)OCC(=O)Br Amb25032214 [0,0,0,0,0,0|4,0,0]=4 17 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [0,0,0,0,0,0|4,0,0]=4 18 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [0,0,0,0,0,0|3,0,0]=3 19 B7R0.6 CC(=O)OOC(C)=O Amb22230214 [0,0,0,0,0,0|4,0,0]=4 20 B7R0.6 CC(=O)OSC(N)=S Amb24381984 [0,0,0,0,0,0|3,1,0]=4 21 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [0,0,0,0,0,0|4,0,0]=4 22 B7R0.6 CC(=O)SCC(=O)O Amb17607669 [0,0,0,0,0,0|4,0,0]=4 23 B7R0.6 CC(=O)SCC(C)=O Amb25131248 [0,0,0,0,0,0|4,0,0]=4 24 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [0,0,0,0,0,0|3,0,0]=3 25 B7R0.6 CC(=O)SNC(N)=O Amb25843227 [0,0,0,0,0,0|2,0,1]=3 26 B7R0.6 CC(=O)SSC(C)=O Amb24099405 [0,0,0,0,0,0|4,0,0]=4 27 B7R0.6 CC(=O)\C=C/C(C)=O Amb24551133 [0,0,0,0,0,0|4,0,0]=4 28 B7R0.6 CC(=O)\C=C/C(O)=O Amb24662475 [0,0,0,0,0,0|4,0,0]=4 29 B7R0.6 CC(=O)\C=C\C(=O)Cl Amb24643241 [0,0,0,0,0,0|4,0,0]=4 30 B7R0.6 CC(=O)\C=C\C(N)=O Amb24516266 [0,0,0,0,0,0|3,0,0]=3 31 B7R0.6 CC(C)=NCC(O)=O Amb24481383 [0,0,0,0,0,0|4,0,0]=4 32 B7R0.6 CC(C)=NN=C(C)C Amb22338208 [0,0,0,0,0,0|4,0,0]=4 33 B7R0.6 CC(C)=NNC(N)=N Amb22261438 [0,0,0,0,0,0|3,0,1]=4 34 B7R0.6 CC(C)=NNC(N)=N Amb22453675 [0,0,0,0,0,0|3,0,1]=4 35 B7R0.6 CC(Cl)=CCC(N)=O Amb25324975 [0,0,0,0,0,0|4,0,0]=4 36 B7R0.6 CC(Cl)C=NC(N)=O Amb24612038 [0,0,0,0,0,0|3,0,1]=4 37 B7R0.6 CC(N)=NCC(=C)Br Amb25355414 [0,0,0,0,0,0|4,0,0]=4 38 B7R0.6 CC(N)=NCC(=C)Cl Amb25200362 [0,0,0,0,0,0|4,0,0]=4 39 B7R0.6 CC(N)=NN=C(C)N Amb24550277 [0,0,0,0,0,0|2,0,0]=2 40 B7R0.6 CC(N)CCC(N)=O Amb18641901 [0,0,0,0,0,0|3,0,1]=4 41 B7R0.6 CC(N)CNC(N)=O Amb18202688 [0,0,0,0,0,0|2,0,2]=4 42 B7R0.6 CC(O)=NNC(N)=O Amb17777869 [0,0,0,0,0,0|1,0,2]=3 43 B7R0.6 CS(=O)CCC(N)=O Amb24475802 [0,0,0,0,0,0|4,0,0]=4 44 B7R0.6 CS(=O)NCC(N)=O Amb24589713 [0,0,0,0,0,0|3,0,1]=4 45 B7R0.6 NC(=N)CCC(=O)Cl Amb24565938 [0,0,0,0,0,0|4,0,0]=4 46 B7R0.6 NC(=N)CCC(O)=O Amb25736788 [0,0,0,0,0,0|4,0,0]=4 47 B7R0.6 NC(=N)N=NC(N)=N Amb23481619 [0,0,0,0,0,0|2,0,0]=2 48 B7R0.6 NC(=N)NCC(=O)Cl Amb25258517 [0,0,0,0,0,0|3,0,1]=4 49 B7R0.6 NC(=N)NCC(=O)O Amb16231404 [0,0,0,0,0,0|3,0,1]=4 50 B7R0.6 NC(=N)NNC(=S)N Amb16492743 [0,0,0,0,0,0|1,1,2]=4 51 B7R0.6 NC(=N)N[13CH2][13C](=O)O Amb17614848 [0,0,0,0,0,0|3,0,1]=4 52 B7R0.6 NC(=N)OCC(O)=O Amb24394884 [0,0,0,0,0,0|4,0,0]=4 53 B7R0.6 NC(=N)SCC(O)=O Amb21955777 [0,0,0,0,0,0|4,0,0]=4 54 B7R0.6 NC(=N)SSC(=N)N Amb10807419 [0,0,0,0,0,0|4,0,0]=4 55 B7R0.6 NC(=N)SSC(N)=N Amb22360747 [0,0,0,0,0,0|4,0,0]=4 56 B7R0.6 NC(=O)CCC(=O)N Amb1353209 [0,0,0,0,0,0|2,0,0]=2 57 B7R0.6 NC(=O)CCC(N)=N Amb25680023 [0,0,0,0,0,0|3,0,0]=3 58 B7R0.6 NC(=O)CCP(O)=O Amb25840251 [0,0,0,0,0,0|4,0,0]=4 59 B7R0.6 NC(=O)CNC(O)=O Amb24705097 [0,0,0,0,0,0|2,0,1]=3 60 B7R0.6 NC(=O)CNC(S)=S Amb24697901 [0,0,0,0,0,0|2,1,1]=4 61 B7R0.6 NC(=O)CNC([O-])=S Amb25146514 [0,0,0,0,0,0|2,0,2]=4 62 B7R0.6 NC(=O)CSC(N)=N Amb22261500 [0,0,0,0,0,0|3,0,0]=3 63 B7R0.6 NC(=O)NCC(=O)N Amb1136421 [0,0,0,0,0,0|1,0,1]=2 64 B7R0.6 NC(=O)NCC(=O)O Amb16205895 [0,0,0,0,0,0|2,0,1]=3 65 B7R0.6 NC(=O)NNC(=S)N Amb10558894 [0,0,0,0,0,0|0,1,2]=3 66 B7R0.6 NC(=O)OCC(=O)Cl Amb25259155 [0,0,0,0,0,0|3,0,0]=3 67 B7R0.6 NC(=O)OCC(N)=O Amb25724808 [0,0,0,0,0,0|2,0,0]=2 68 B7R0.6 NC(=O)OCC(O)=O Amb25777061 [0,0,0,0,0,0|3,0,0]=3 69 B7R0.6 NC(=O)SCC(N)=O Amb24359876 [0,0,0,0,0,0|2,0,0]=2 70 B7R0.6 NC(=O)SCC(O)=O Amb24640543 [0,0,0,0,0,0|3,0,0]=3 71 B7R0.6 NC(=O)\C=C\[N+]([O-])=O Amb25253537 [0,0,0,0,0,0|4,0,0]=4 72 B7R0.6 NC(=S)CCC(=S)N Amb10552426 [0,0,0,0,0,0|2,2,0]=4 73 B7R0.6 NC(=S)CCC(O)=O Amb18102382 [0,0,0,0,0,0|3,1,0]=4 74 B7R0.6 NC(=S)CNC(N)=O Amb24667922 [0,0,0,0,0,0|1,1,1]=3 75 B7R0.6 NC(=S)NNC(=S)N Amb1639325 [0,0,0,0,0,0|0,2,2]=4 76 B7R0.6 NC(=S)OCC(O)=O Amb25340403 [0,0,0,0,0,0|3,1,0]=4 77 B7R0.6 NC(=S)SCC(O)=O Amb25108057 [0,0,0,0,0,0|3,1,0]=4 78 B7R0.6 NC(=S)SSC(N)=S Amb19861230 [0,0,0,0,0,0|2,2,0]=4 79 B7R0.6 NC(=S)\C=C\C(O)=O Amb25707640 [0,0,0,0,0,0|3,1,0]=4 80 B7R0.6 O=C(F)CCC(=O)F Amb24483270 [0,0,0,0,0,0|4,0,0]=4 81 B7R0.6 O=C([OH2+])[13C]#CC(=O)[OH2+] Amb22336968 [0,0,0,0,0,0|4,0,0]=4 82 B7R0.6 OC(=O)C=CC(O)=O Amb22487311 [0,0,0,0,0,0|4,0,0]=4 83 B7R0.6 OC(=O)C=CC(O)=O Amb22487315 [0,0,0,0,0,0|4,0,0]=4 84 B7R0.6 OC(=O)CCC(=O)Cl Amb17593468 [0,0,0,0,0,0|4,0,0]=4 85 B7R0.6 OC(=O)CCC(O)=O Amb22168124 [0,0,0,0,0,0|4,0,0]=4 86 B7R0.6 OC(=O)CCC(O)=O Amb22349196 [0,0,0,0,0,0|4,0,0]=4 87 B7R0.6 OC(=O)CCC(O)=O Amb22353352 [0,0,0,0,0,0|4,0,0]=4 88 B7R0.6 OC(=O)CCC(O)=O Amb22360649 [0,0,0,0,0,0|4,0,0]=4 89 B7R0.6 OC(=O)CNC(=O)Cl Amb25277149 [0,0,0,0,0,0|3,0,1]=4 90 B7R0.6 OC(=O)C[13CH2][13C](O)=O Amb22353421 [0,0,0,0,0,0|4,0,0]=4 91 B7R0.6 OC(=O)SCC(O)=O Amb24699018 [0,0,0,0,0,0|4,0,0]=4 92 B7R0.6 OC(=O)[13CH2][13CH2]C(O)=O Amb22338081 [0,0,0,0,0,0|4,0,0]=4 93 B7R0.6 OC(=O)[14CH2][14CH2]C(O)=O Amb22337597 [0,0,0,0,0,0|4,0,0]=4 94 B7R0.6 OC(=O)\C=C/C(O)=O Amb22274309 [0,0,0,0,0,0|4,0,0]=4 95 B7R0.6 OC(=O)\C=C/C(O)=O Amb22350132 [0,0,0,0,0,0|4,0,0]=4 96 B7R0.6 OC(=O)\C=C\C(=O)O Amb10072561 [0,0,0,0,0,0|4,0,0]=4 97 B7R0.6 OC(=O)\C=C\C(O)=O Amb22336584 [0,0,0,0,0,0|4,0,0]=4 98 B7R0.6 OC(=O)\C=C\C(O)=O Amb22352586 [0,0,0,0,0,0|4,0,0]=4 99 B7R0.6 OC(=O)\C=C\C(O)=O Amb22353441 [0,0,0,0,0,0|4,0,0]=4 100 B7R0.6 OC(=O)\C=C\C(O)=O Amb22353537 [0,0,0,0,0,0|4,0,0]=4 101 B7R0.6 OC(=O)\C=C\C(O)=O Amb22360655 [0,0,0,0,0,0|4,0,0]=4 102 B7R0.6 OC(=O)\[13CH]=[13CH]\C(O)=O Amb22363150 [0,0,0,0,0,0|4,0,0]=4 103 B7R0.6 OC(=O)\[14CH]=[14CH]/C(O)=O Amb22352435 [0,0,0,0,0,0|4,0,0]=4 104 B7R0.6 O[13C](=O)CC[13C](O)=O Amb22056173 [0,0,0,0,0,0|4,0,0]=4 105 B7R0.6 O[13C](=O)[13CH2][13CH2][13C](O)=O Amb22056172 [0,0,0,0,0,0|4,0,0]=4 106 B7R0.6 O[13C](=O)\[13CH]=[13CH]\[13C](O)=O Amb22055283 [0,0,0,0,0,0|4,0,0]=4 107 B7R0.6 O[14C](=O)CC[14C](O)=O Amb22352661 [0,0,0,0,0,0|4,0,0]=4 108 B7R0.6 [13CH3][13C](=O)[13CH2]CC(O)=O Amb22056002 [0,0,0,0,0,0|4,0,0]=4 109 B7R0.6 [15NH2][13C](=O)NN[13C](=O)[15NH2] Amb17615003 [0,0,0,0,0,0|0,0,2]=2 110 B7R0.6 [O-]C(=O)/C=C/C([O-])=O Amb17942943 [0,0,0,0,0,0|4,0,0]=4 111 B7R0.6 [O-]C(=O)C#CC(O)=O Amb19748298 [0,0,0,0,0,0|4,0,0]=4 112 B7R0.6 [O-]C(=O)CCC(O)=O Amb22730137 [0,0,0,0,0,0|4,0,0]=4 113 B7R0.6 [O-]C(=O)CCC(O)=O Amb22733837 [0,0,0,0,0,0|4,0,0]=4 114 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22230230 [0,0,0,0,0,0|4,0,0]=4 115 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22330623 [0,0,0,0,0,0|4,0,0]=4 116 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22360668 [0,0,0,0,0,0|4,0,0]=4 117 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22731284 [0,0,0,0,0,0|4,0,0]=4 118 B7R0.6 [O-]C(=O)NCC([O-])=O Amb22731445 [0,0,0,0,0,0|3,0,1]=4 119 B7R0.6 [O-]C(=O)\C=C/C(O)=O Amb22168115 [0,0,0,0,0,0|4,0,0]=4 120 B7R0.6 [O-]C(=O)\C=C/C([O-])=O Amb22731335 [0,0,0,0,0,0|4,0,0]=4 121 B7R0.6 [O-]C(=O)\C=C/C([O-])=O Amb22733809 [0,0,0,0,0,0|4,0,0]=4 122 B7R0.6 [O-]C(=O)\C=C/C([O-])=O Amb24325338 [0,0,0,0,0,0|4,0,0]=4 123 B7R0.6 [O-]C(=O)\C=C\C(O)=O Amb22043387 [0,0,0,0,0,0|4,0,0]=4 124 B7R0.6 [O-]C(=O)\C=C\C(O)=O Amb22734231 [0,0,0,0,0,0|4,0,0]=4 125 B7R0.6 [O-]C(=O)\C=C\C([O-])=O Amb20246799 [0,0,0,0,0,0|4,0,0]=4 126 B7R0.6 [O-]C(=O)\C=C\C([O-])=O Amb22002520 [0,0,0,0,0,0|4,0,0]=4 127 B7R0.6 [O-]C(=O)\C=C\C([O-])=O Amb22043369 [0,0,0,0,0,0|4,0,0]=4 128 B7R0.6 [O-]C(=O)\C=C\C([O-])=O Amb22730640 [0,0,0,0,0,0|4,0,0]=4 129 B7R0.6 [O-]C(=O)\C=C\C([O-])=O Amb22732045 [0,0,0,0,0,0|4,0,0]=4 130 B6R0.4 C=C(N)NNC=O Amb20223981 [1,0,0,0,0,0|1,0,2]=4 131 B6R0.4 C=COCC(N)=O Amb25075789 [1,0,0,0,0,0|3,0,0]=4 132 B6R0.4 C=C\C=C\C(N)=O Amb25222345 [1,0,0,0,0,0|3,0,0]=4 133 B6R0.4 CC(=O)CCC=O Amb18639597 [1,0,0,0,0,0|3,0,0]=4 134 B6R0.4 CC(=O)CNC=O Amb23442787 [1,0,0,0,0,0|2,0,1]=4 135 B6R0.4 CC(=O)COC=O Amb24736861 [1,0,0,0,0,0|3,0,0]=4 136 B6R0.4 CC(=O)NCC=O Amb25757509 [1,0,0,0,0,0|2,0,1]=4 137 B6R0.4 CC(=O)NNC=O Amb25663184 [1,0,0,0,0,0|1,0,2]=4 138 B6R0.4 CC(=O)ON=CCl Amb24677824 [1,0,0,0,0,0|3,0,0]=4 139 B6R0.4 CC(=O)ON=CN Amb25732130 [1,0,0,0,0,0|2,0,0]=3 140 B6R0.4 CC(=O)O\N=C/Cl Amb24373196 [1,0,0,0,0,0|3,0,0]=4 141 B6R0.4 CC(=O)\C=C\C=O Amb18120765 [1,0,0,0,0,0|3,0,0]=4 142 B6R0.4 CC=NNC(N)=N Amb25113440 [1,0,0,0,0,0|2,0,1]=4 143 B6R0.4 CC=NNC(N)=O Amb24351023 [1,0,0,0,0,0|1,0,1]=3 144 B6R0.4 CC\C=N\C(N)=O Amb24479183 [1,0,0,0,0,0|2,0,1]=4 145 B6R0.4 CON=CC(N)=O Amb24719410 [1,0,0,0,0,0|3,0,0]=4 146 B6R0.4 CO\N=C\C(N)=O Amb24663668 [1,0,0,0,0,0|3,0,0]=4 147 B6R0.4 C\C(\N)=N\OC=C Amb24443424 [1,0,0,0,0,0|3,0,0]=4 148 B6R0.4 C\C=C\NC(N)=O Amb25340023 [1,0,0,0,0,0|2,0,1]=4 149 B6R0.4 C\C=N\CC(O)=O Amb24618330 [1,0,0,0,0,0|3,0,0]=4 150 B6R0.4 NC(=N)N=CC=O Amb25252156 [1,0,0,0,0,0|2,0,0]=3 151 B6R0.4 NC(=N)NNC=O Amb20000948 [1,0,0,0,0,0|1,0,2]=4 152 B6R0.4 NC(=O)CNC=O Amb25770889 [1,0,0,0,0,0|1,0,1]=3 153 B6R0.4 NC(=O)NCN=O Amb22490284 [1,0,0,0,0,0|2,0,1]=4 154 B6R0.4 NC(=O)OCC=O Amb24446581 [1,0,0,0,0,0|2,0,0]=3 155 B6R0.4 NC(=O)\C=C\C=O Amb24480849 [1,0,0,0,0,0|2,0,0]=3 156 B6R0.4 NC(=S)CNC=O Amb24479904 [1,0,0,0,0,0|1,1,1]=4 157 B6R0.4 NC(=S)SCC=O Amb24713465 [1,0,0,0,0,0|2,1,0]=4 158 B6R0.4 NCCCC(=O)N Amb2099583 [1,0,0,0,0,0|2,0,1]=4 159 B6R0.4 NCCNC(N)=O Amb19374121 [1,0,0,0,0,0|1,0,2]=4 160 B6R0.4 NCCOC(N)=O Amb22059480 [1,0,0,0,0,0|2,0,1]=4 161 B6R0.4 NCCOC(N)=O Amb24271076 [1,0,0,0,0,0|2,0,1]=4 162 B6R0.4 NNCCC(N)=O Amb24406769 [1,0,0,0,0,0|3,0,0]=4 163 B6R0.4 O=CCOC(=O)C Amb10070247 [1,0,0,0,0,0|3,0,0]=4 164 B6R0.4 O=CNCC(=O)O Amb1911508 [1,0,0,0,0,0|2,0,1]=4 165 B6R0.4 O=CNN=C(C)C Amb2419224 [1,0,0,0,0,0|2,0,1]=4 166 B6R0.4 O=CNNC(=N)N Amb10559704 [1,0,0,0,0,0|1,0,2]=4 167 B6R0.4 O=CNNC(=N)N Amb10560413 [1,0,0,0,0,0|1,0,2]=4 168 B6R0.4 O=CNNC(=S)N Amb1790065 [1,0,0,0,0,0|0,1,2]=4 169 B6R0.4 OC(=O)CCC=O Amb17673897 [1,0,0,0,0,0|3,0,0]=4 170 B8R0.9 C#CC(=O)NCC(N)=O Amb24732631 [0,1,0,0,0,0|2,0,1]=4 171 B8R0.9 CC(=CCl)N=NC(N)=O Amb24670505 [0,1,0,0,0,0|2,0,0]=3 172 B8R0.9 CC(=CCl)\N=N\C(N)=O Amb24550462 [0,1,0,0,0,0|2,0,0]=3 173 B8R0.9 CC(=NOC(N)=O)SC Amb25743978 [0,1,0,0,0,0|2,1,0]=4 174 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [0,1,0,0,0,0|3,0,0]=4 175 B8R0.9 CC(=O)CNC(=O)CN Amb25837037 [0,1,0,0,0,0|2,0,1]=4 176 B8R0.9 CC(=O)CNC(=O)NC Amb25228227 [0,1,0,0,0,0|2,0,1]=4 177 B8R0.9 CC(=O)NCC(=O)NN Amb24524168 [0,1,0,0,0,0|2,0,1]=4 178 B8R0.9 CC(=O)NCC(=O)NO Amb25340085 [0,1,0,0,0,0|2,0,1]=4 179 B8R0.9 CC(=O)NN=C(N)CC Amb24477734 [0,1,0,0,0,0|2,0,1]=4 180 B8R0.9 CC(=O)NNC(=O)CN Amb17334122 [0,1,0,0,0,0|1,0,2]=4 181 B8R0.9 CC(=O)ON=C(N)CC Amb24532432 [0,1,0,0,0,0|3,0,0]=4 182 B8R0.9 CC(=O)O\N=C(/N)\C#N Amb24560330 [0,1,0,0,0,0|3,0,0]=4 183 B8R0.9 CC(C#N)=NNC(N)=O Amb25146073 [0,1,0,0,0,0|1,0,2]=4 184 B8R0.9 CC(C)=NOC(=O)CN Amb25328478 [0,1,0,0,0,0|3,0,0]=4 185 B8R0.9 CC(CBr)=NNC(N)=O Amb25059220 [0,1,0,0,0,0|2,0,1]=4 186 B8R0.9 CC(CC)=NNC(N)=O Amb25855979 [0,1,0,0,0,0|2,0,1]=4 187 B8R0.9 CC(CN)=NNC(N)=O Amb25286950 [0,1,0,0,0,0|1,0,1]=3 188 B8R0.9 CC(N)=NOC(=O)CC Amb24351573 [0,1,0,0,0,0|3,0,0]=4 189 B8R0.9 CCC(=O)CCC(N)=O Amb24669836 [0,1,0,0,0,0|3,0,0]=4 190 B8R0.9 CCC(=O)NCC(=O)N Amb17231864 [0,1,0,0,0,0|2,0,1]=4 191 B8R0.9 CCC(N)=NNC(N)=O Amb25340034 [0,1,0,0,0,0|1,0,1]=3 192 B8R0.9 CNC(=N)SNC(N)=O Amb25146034 [0,1,0,0,0,0|2,0,1]=4 193 B8R0.9 CNC(=O)CCC(=O)C Amb17334107 [0,1,0,0,0,0|3,0,0]=4 194 B8R0.9 CNC(=O)CCC(=O)N Amb17334114 [0,1,0,0,0,0|2,0,0]=3 195 B8R0.9 CNC(=O)CNC(O)=O Amb24740399 [0,1,0,0,0,0|2,0,1]=4 196 B8R0.9 CNC(=O)CSC(N)=N Amb25106852 [0,1,0,0,0,0|3,0,0]=4 197 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,1,0,0,0,0|2,0,1]=4 198 B8R0.9 CNC(=O)NCC(N)=N Amb25114509 [0,1,0,0,0,0|2,0,1]=4 199 B8R0.9 CNC(=O)NCC(N)=O Amb24481795 [0,1,0,0,0,0|1,0,1]=3 200 B8R0.9 CNC(=O)NNC(N)=S Amb25726192 [0,1,0,0,0,0|0,1,2]=4 201 B8R0.9 CNC(=O)NOC(N)=O Amb25672371 [0,1,0,0,0,0|1,0,1]=3 202 B8R0.9 CNC(=O)ON=C(Cl)Cl Amb25326238 [0,1,0,0,0,0|3,0,0]=4 203 B8R0.9 CNC(=O)SCC(O)=O Amb24763198 [0,1,0,0,0,0|3,0,0]=4 204 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [0,1,0,0,0,0|3,0,0]=4 205 B8R0.9 COC(=O)CNC(=O)N Amb1126846 [0,1,0,0,0,0|2,0,1]=4 206 B8R0.9 COC(=O)CSC(N)=O Amb24672643 [0,1,0,0,0,0|3,0,0]=4 207 B8R0.9 COC(=O)N=NC(C)N Amb25062994 [0,1,0,0,0,0|2,0,1]=4 208 B8R0.9 COC(=O)\C=C\C(N)=O Amb24458702 [0,1,0,0,0,0|3,0,0]=4 209 B8R0.9 CS\C(=N/N=C(C)C)\N Amb16228499 [0,1,0,0,0,0|2,1,0]=4 210 B8R0.9 C\C(\C=C)=N\NC(N)=O Amb25055146 [0,1,0,0,0,0|2,0,1]=4 211 B8R0.9 C\C(\C=O)=N/NC(N)=S Amb24750183 [0,1,0,0,0,0|1,1,1]=4 212 B8R0.9 C\C(\CC)=N\N=C(/C)\N Amb24659832 [0,1,0,0,0,0|3,0,0]=4 213 B8R0.9 C\C(\CCl)=N/NC(N)=O Amb21963832 [0,1,0,0,0,0|2,0,1]=4 214 B8R0.9 C\C(\CO)=N/NC(N)=O Amb25131193 [0,1,0,0,0,0|1,0,2]=4 215 B8R0.9 C\C(\N)=N\OC(=O)OC Amb25728140 [0,1,0,0,0,0|3,0,0]=4 216 B8R0.9 NC(=NN)SCC(N)=O Amb25680981 [0,1,0,0,0,0|3,0,0]=4 217 B8R0.9 NC(=O)CCC(=O)N=O Amb24445359 [0,1,0,0,0,0|2,0,1]=4 218 B8R0.9 NC(=O)CCC(=O)NBr Amb24390936 [0,1,0,0,0,0|2,0,0]=3 219 B8R0.9 NC(=O)CCC(=O)NCl Amb24425513 [0,1,0,0,0,0|2,0,0]=3 220 B8R0.9 NC(=O)CCC(=O)NO Amb24340146 [0,1,0,0,0,0|2,0,0]=3 221 B8R0.9 NC(=O)CNC(=O)CBr Amb25201255 [0,1,0,0,0,0|2,0,1]=4 222 B8R0.9 NC(=O)CNC(=O)CN Amb22730172 [0,1,0,0,0,0|1,0,1]=3 223 B8R0.9 NC(=O)CNC(=O)CN Amb22734748 [0,1,0,0,0,0|1,0,1]=3 224 B8R0.9 NC(=O)CNC(=O)CS Amb24405222 [0,1,0,0,0,0|2,0,1]=4 225 B8R0.9 NC(=O)COC(=O)CO Amb25739390 [0,1,0,0,0,0|3,0,0]=4 226 B8R0.9 NC(=O)NCC(=O)NN Amb24477825 [0,1,0,0,0,0|1,0,1]=3 227 B8R0.9 NC(=O)NN=C(Br)C#N Amb24739488 [0,1,0,0,0,0|1,0,2]=4 228 B8R0.9 NC(=O)NNC(=O)CO Amb25328968 [0,1,0,0,0,0|1,0,2]=4 229 B8R0.9 NC(=S)NCC(=O)NN Amb25367548 [0,1,0,0,0,0|1,1,1]=4 230 B8R0.9 NC(NCC(N)=O)=NN Amb25266048 [0,1,0,0,0,0|2,0,1]=4 231 B8R0.9 NC(NCC(N)=O)=NO Amb25759831 [0,1,0,0,0,0|1,0,2]=4 232 B8R0.9 NCC(=O)CC[13C](O)=O Amb22367280 [0,1,0,0,0,0|3,0,0]=4 233 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,1,0,0,0,0|2,0,1]=4 234 B8R0.9 NCC(=O)OCC(O)=O Amb25710415 [0,1,0,0,0,0|3,0,0]=4 235 B8R0.9 NCC(=O)[13CH2]CC(=O)O Amb17608125 [0,1,0,0,0,0|3,0,0]=4 236 B8R0.9 NNC(=O)CCC(O)=O Amb22270256 [0,1,0,0,0,0|3,0,0]=4 237 B8R0.9 NNC(=O)CNC(O)=O Amb25093417 [0,1,0,0,0,0|2,0,1]=4 238 B8R0.9 NNC(=O)\C=C/C(O)=O Amb25046308 [0,1,0,0,0,0|3,0,0]=4 239 B8R0.9 N[13CH2]C(=O)CCC(O)=O Amb22367582 [0,1,0,0,0,0|3,0,0]=4 240 B8R0.9 N[C@@H](CCC(N)=O)C=O Amb25104754 [0,1,0,0,0,0|2,0,1]=4 241 B8R0.9 OC(=O)CNC(=O)NO Amb25228420 [0,1,0,0,0,0|2,0,1]=4 242 B8R0.9 ONC(=O)/C=C\C(O)=O Amb17673396 [0,1,0,0,0,0|3,0,0]=4 243 B8R0.23 C=C(CC(N)=O)C(N)=O Amb25338425 [0,1,0,0,0,0|2,0,0]=3 244 B8R0.23 C=C(CC(N)=O)C(O)=O Amb24333452 [0,1,0,0,0,0|3,0,0]=4 245 B8R0.23 C=C(CC(O)=O)C(N)=O Amb22011744 [0,1,0,0,0,0|3,0,0]=4 246 B8R0.23 CC(=CC(N)=O)C(O)=O Amb24744881 [0,1,0,0,0,0|3,0,0]=4 247 B8R0.23 CC(=O)C(=O)NC(N)=O Amb24411479 [0,1,0,0,0,0|2,0,1]=4 248 B8R0.23 CC(=O)C(C)=NC(C)=O Amb25349449 [0,1,0,0,0,0|3,0,0]=4 249 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,1,0,0,0,0|3,0,0]=4 250 B8R0.23 CC(=O)NC(C(=O)N)N Amb10558230 [0,1,0,0,0,0|2,0,1]=4 251 B8R0.23 CC(=O)NN(C)C(N)=O Amb24449373 [0,1,0,0,0,0|1,0,2]=4 252 B8R0.23 CC(=O)N[C@@H](C)C(N)=O Amb22168264 [0,1,0,0,0,0|2,0,1]=4 253 B8R0.23 CC(=O)N[C@H](C)C(N)=O Amb24478101 [0,1,0,0,0,0|2,0,1]=4 254 B8R0.23 CC(=O)O[C@@H](C)C(N)=O Amb25733380 [0,1,0,0,0,0|3,0,0]=4 255 B8R0.23 CC(=O)\C(\C)=N/C(C)=O Amb24072927 [0,1,0,0,0,0|3,0,0]=4 256 B8R0.23 CC(CC(N)=O)C(N)=N Amb25325023 [0,1,0,0,0,0|3,0,0]=4 257 B8R0.23 CC(CC(O)=O)C(N)=O Amb25737942 [0,1,0,0,0,0|3,0,0]=4 258 B8R0.23 CC(N=C(N)S)C(O)=O Amb22229340 [0,1,0,0,0,0|2,1,0]=4 259 B8R0.23 CC(NC(N)=N)C(N)=O Amb24425222 [0,1,0,0,0,0|2,0,1]=4 260 B8R0.23 CC(NC(N)=O)C(N)=N Amb25733715 [0,1,0,0,0,0|2,0,1]=4 261 B8R0.23 CN(CC(N)=N)C(N)=O Amb24696765 [0,1,0,0,0,0|2,0,1]=4 262 B8R0.23 CN(CC(N)=O)C(N)=N Amb25072715 [0,1,0,0,0,0|2,0,1]=4 263 B8R0.23 CN(CC(N)=S)C(N)=O Amb24621757 [0,1,0,0,0,0|1,1,1]=4 264 B8R0.23 CN(NC(N)=O)C(N)=O Amb24743493 [0,1,0,0,0,0|0,0,2]=3 265 B8R0.23 C[C@H](CC(N)=O)C(N)=O Amb25126983 [0,1,0,0,0,0|2,0,0]=3 266 B8R0.23 C[C@H](CC(N)=O)C(O)=O Amb25077589 [0,1,0,0,0,0|3,0,0]=4 267 B8R0.23 C[C@H](OC(N)=O)C(O)=O Amb24427686 [0,1,0,0,0,0|3,0,0]=4 268 B8R0.23 C\C(=C\C(N)=O)\C(N)=O Amb25146105 [0,1,0,0,0,0|2,0,0]=3 269 B8R0.23 C\C(=C\C(N)=O)\C(O)=O Amb25199871 [0,1,0,0,0,0|3,0,0]=4 270 B8R0.23 NC(=O)C(Br)CC(N)=O Amb24373945 [0,1,0,0,0,0|2,0,0]=3 271 B8R0.23 NC(=O)C(N)CC(N)=O Amb18289248 [0,1,0,0,0,0|2,0,0]=3 272 B8R0.23 NC(=O)C(N)CC(O)=O Amb18124347 [0,1,0,0,0,0|3,0,0]=4 273 B8R0.23 NC(=O)C(O)CC(O)=O Amb25378786 [0,1,0,0,0,0|3,0,0]=4 274 B8R0.23 NC(=O)CC(=O)C(O)=O Amb25146116 [0,1,0,0,0,0|3,0,0]=4 275 B8R0.23 NC(=O)C[C@@H](C(=O)N)N Amb16183882 [0,1,0,0,0,0|2,0,0]=3 276 B8R0.23 NC(=O)C[C@@H](C(=O)O)C Amb10843937 [0,1,0,0,0,0|3,0,0]=4 277 B8R0.23 NC(=O)C[C@@H](O)C(O)=O Amb24681022 [0,1,0,0,0,0|3,0,0]=4 278 B8R0.23 NC(=O)C[C@H](Br)C(O)=O Amb25137878 [0,1,0,0,0,0|3,0,0]=4 279 B8R0.23 NC(=O)C[C@H](C(=O)O)N Amb10071271 [0,1,0,0,0,0|3,0,0]=4 280 B8R0.23 NC(=O)C[C@H](Cl)C(O)=O Amb24479999 [0,1,0,0,0,0|3,0,0]=4 281 B8R0.23 NC(=O)C[C@H]([15NH2])C(O)=O Amb22338491 [0,1,0,0,0,0|3,0,0]=4 282 B8R0.23 NC(=O)NC(=O)C(O)=O Amb18124345 [0,1,0,0,0,0|2,0,1]=4 283 B8R0.23 NC(=O)NC(N)C(O)=O Amb24418886 [0,1,0,0,0,0|2,0,1]=4 284 B8R0.23 NC(=O)NC(O)C(O)=O Amb22350130 [0,1,0,0,0,0|2,0,1]=4 285 B8R0.23 NC(=O)NC(O)C(O)=O Amb24592607 [0,1,0,0,0,0|2,0,1]=4 286 B8R0.23 NC(=O)[C@@H](N)CC(N)=O Amb22801077 [0,1,0,0,0,0|2,0,0]=3 287 B8R0.23 NC(=O)[C@@H](N)CC(O)=O Amb19334954 [0,1,0,0,0,0|3,0,0]=4 288 B8R0.23 NC(=O)[C@@H](O)CC(N)=O Amb24435465 [0,1,0,0,0,0|2,0,0]=3 289 B8R0.23 NC(=O)[C@H](Br)CC(N)=O Amb24480049 [0,1,0,0,0,0|2,0,0]=3 290 B8R0.23 NC(=O)\C(\Cl)=C/C(N)=O Amb24598183 [0,1,0,0,0,0|2,0,0]=3 291 B8R0.23 NC(=O)\C(\Cl)=C\C(N)=O Amb25369859 [0,1,0,0,0,0|2,0,0]=3 292 B8R0.23 NC(=O)\C=C(\Cl)/C(O)=O Amb24540540 [0,1,0,0,0,0|3,0,0]=4 293 B8R0.23 N[13C](=O)[13CH2][13C@H](N)[13C](O)=O Amb22367522 [0,1,0,0,0,0|3,0,0]=4 294 B8R0.23 N[C@@H](C[13C](N)=O)C(O)=O Amb22353613 [0,1,0,0,0,0|3,0,0]=4 295 B8R0.23 N[C@H](CC(N)=O)C(O)=O Amb17749060 [0,1,0,0,0,0|3,0,0]=4 296 B8R0.23 OC(=O)CN(C(=O)N)C Amb2371395 [0,1,0,0,0,0|2,0,1]=4 297 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22337484 [0,1,0,0,0,0|3,0,0]=4 298 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22351412 [0,1,0,0,0,0|3,0,0]=4 299 B8R0.23 [15NH2][13C](=O)[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337495 [0,1,0,0,0,0|3,0,0]=4 300 B8R0.29 CC(C)(C)N=NC(N)=O Amb24452670 [0,1,0,0,0,0|2,0,1]=4 301 B8R0.29 CS(C)(=O)=NCC(N)=O Amb24572132 [0,1,0,0,0,0|3,0,0]=4 302 B8R1.3 CC1=CNC(=O)C=N1 Amb22489545 [0,0,0,1,0,0|3,0,0]=4 303 B8R1.3 CC1=CNC(=O)N=C1 Amb21964512 [0,0,0,1,0,0|3,0,0]=4 304 B8R1.3 CC=1CSC(N)=NN1 Amb23559271 [0,0,0,1,0,0|2,1,0]=4 305 B8R1.3 CC=1NN=C(N)NN1 Amb20414075 [0,0,0,1,0,0|2,0,1]=4 306 B8R1.3 CC=1NNC(=S)NN1 Amb21979333 [0,0,0,1,0,0|1,1,1]=4 307 B8R1.3 Cc1[n]cc(N)[n][n]1 Amb25840913 [0,0,0,1,0,0|2,0,1]=4 308 B8R1.3 Cc1c[n]c(N)[n][n]1 Amb22494754 [0,0,0,1,0,0|3,0,0]=4 309 B8R1.3 Clc1cnc(=O)[nH]c1 Amb17942888 [0,0,0,1,0,0|3,0,0]=4 310 B8R1.3 NC1=CNC(=O)N=C1 Amb18124224 [0,0,0,1,0,0|2,0,0]=3 311 B8R1.3 NC1=NNC(=O)NN1 Amb17912787 [0,0,0,1,0,0|1,0,1]=3 312 B8R1.3 NC1=NNC(N)=CS1 Amb25736100 [0,0,0,1,0,0|1,1,1]=4 313 B8R1.3 NC1=NNC(S)=NN1 Amb17912786 [0,0,0,1,0,0|1,1,1]=4 314 B8R1.3 NC=1C=CC(=O)NC1 Amb19958325 [0,0,0,1,0,0|3,0,0]=4 315 B8R1.3 NC=1C=CC(=O)NN1 Amb18124225 [0,0,0,1,0,0|2,0,1]=4 316 B8R1.3 NC=1C=CC(=O)NN1 Amb24271086 [0,0,0,1,0,0|2,0,1]=4 317 B8R1.3 NC=1N=CC(=O)NN1 Amb18641677 [0,0,0,1,0,0|2,0,0]=3 318 B8R1.3 Nc1[n]cc(Br)[n][n]1 Amb22493915 [0,0,0,1,0,0|3,0,0]=4 319 B8R1.3 Nc1[n]cc(Cl)[n][n]1 Amb22495136 [0,0,0,1,0,0|3,0,0]=4 320 B8R1.3 Nc1[n]cc(I)[n][n]1 Amb22494755 [0,0,0,1,0,0|3,0,0]=4 321 B8R1.3 Nc1c[n]c(N)[n]c1 Amb23437172 [0,0,0,1,0,0|3,0,0]=4 322 B8R1.3 Nc1c[n]c(N)c[n]1 Amb19516034 [0,0,0,1,0,0|3,0,0]=4 323 B8R1.3 Nc1c[n]c(N)c[n]1 Amb22436787 [0,0,0,1,0,0|3,0,0]=4 324 B8R1.3 Nc1c[n]c(N)cc1 Amb19958409 [0,0,0,1,0,0|3,0,0]=4 325 B8R1.3 Nc1ccc(N)[n][n]1 Amb22489557 [0,0,0,1,0,0|2,0,0]=3 326 B8R1.3 Nc1ccc(O)[n][n]1 Amb18943976 [0,0,0,1,0,0|2,0,1]=4 327 B8R1.3 Nc1ccc(S)[n][n]1 Amb24427280 [0,0,0,1,0,0|2,1,0]=4 328 B8R1.3 Nc1ccc(nn1)Cl Amb1152568 [0,0,0,1,0,0|3,0,0]=4 329 B8R1.3 Nc1ccc(nn1)F Amb10067581 [0,0,0,1,0,0|3,0,0]=4 330 B8R1.3 Nc1ccc(nn1)I Amb13883812 [0,0,0,1,0,0|3,0,0]=4 331 B8R1.3 Nc1ccc(nn1)N Amb10067596 [0,0,0,1,0,0|2,0,0]=3 332 B8R1.3 Nc1ncc(cn1)N Amb2223199 [0,0,0,1,0,0|3,0,0]=4 333 B8R1.3 Nc1nnc(nn1)N Amb1044004 [0,0,0,1,0,0|2,0,0]=3 334 B8R1.3 O=C1C=CC(=O)N=N1 Amb22498641 [0,0,0,1,0,0|2,0,0]=3 335 B8R1.3 O=C1C=CC(=O)NN1 Amb19651991 [0,0,0,1,0,0|2,0,0]=3 336 B8R1.3 O=C1C=CC(=O)NN1 Amb21973274 [0,0,0,1,0,0|2,0,0]=3 337 B8R1.3 O=C1C=NC(=O)C=C1 Amb25322789 [0,0,0,1,0,0|3,0,0]=4 338 B8R1.3 O=C1C=NC(F)=CN1 Amb22388305 [0,0,0,1,0,0|3,0,0]=4 339 B8R1.3 O=C1CCC(=O)CN1 Amb15692796 [0,0,0,1,0,0|3,0,0]=4 340 B8R1.3 O=C1CCC(=O)NN1 Amb22365926 [0,0,0,1,0,0|2,0,0]=3 341 B8R1.3 O=C1CNC(=O)CC1 Amb22491034 [0,0,0,1,0,0|3,0,0]=4 342 B8R1.3 O=C1CNC(=O)OC1 Amb24481365 [0,0,0,1,0,0|3,0,0]=4 343 B8R1.3 O=C1CNC(=S)NN1 Amb24517488 [0,0,0,1,0,0|1,1,1]=4 344 B8R1.3 O=C1NC=C(Br)C=N1 Amb19895337 [0,0,0,1,0,0|3,0,0]=4 345 B8R1.3 O=C1NC=C(Br)C=N1 Amb21857588 [0,0,0,1,0,0|3,0,0]=4 346 B8R1.3 O=C1NC=C(Cl)C=N1 Amb20239358 [0,0,0,1,0,0|3,0,0]=4 347 B8R1.3 O=C1NC=C(F)C=N1 Amb19666817 [0,0,0,1,0,0|3,0,0]=4 348 B8R1.3 O=C1NC=C(I)C=N1 Amb22388529 [0,0,0,1,0,0|3,0,0]=4 349 B8R1.3 O=C1NCC(=O)NC1 Amb1011605 [0,0,0,1,0,0|2,0,1]=4 350 B8R1.3 O=C1NNC(=O)NN1 Amb17730891 [0,0,0,1,0,0|0,0,2]=3 351 B8R1.3 O=C1NNC(=S)NN1 Amb21979336 [0,0,0,1,0,0|0,1,2]=4 352 B8R1.3 OC1=CNC(=O)N=C1 Amb23442838 [0,0,0,1,0,0|2,0,1]=4 353 B8R1.3 SC=1NNC(S)=NN1 Amb21948925 [0,0,0,1,0,0|0,2,0]=3 354 B8R1.23 NC(=O)C1CC(=O)C1 Amb22896730 [0,0,0,1,0,0|3,0,0]=4 355 B8R1.23 O=C1CC(N1)C(=O)O Amb16232079 [0,0,0,1,0,0|3,0,0]=4 356 B8R1.23 OC(=O)[C@@H]1CC(=O)N1 Amb22367070 [0,0,0,1,0,0|3,0,0]=4 357 B8R1.35 NC(=O)NN=C1CC1 Amb25843237 [0,0,0,1,0,0|2,0,1]=4 358 B8R1.51 CC1(C)NC(=O)N=N1 Amb24481503 [0,0,0,1,0,0|2,0,1]=4 359 B6R0.2 C=C(Br)CC(N)=O Amb25174913 [0,0,0,0,1,0|3,0,0]=4 360 B6R0.2 C=C(Cl)CC(N)=O Amb24376175 [0,0,0,0,1,0|3,0,0]=4 361 B6R0.2 C=C(N)OC(=C)N Amb25678856 [0,0,0,0,1,0|3,0,0]=4 362 B6R0.2 CC(=CC(=O)N)C Amb10561758 [0,0,0,0,1,0|3,0,0]=4 363 B6R0.2 CC(=N)CC(N)=O Amb25259783 [0,0,0,0,1,0|2,0,1]=4 364 B6R0.2 CC(=O)CC(=O)Br Amb24422459 [0,0,0,0,1,0|3,0,0]=4 365 B6R0.2 CC(=O)CC(C)=O Amb22727963 [0,0,0,0,1,0|3,0,0]=4 366 B6R0.2 CC(=O)CC(N)=S Amb24102403 [0,0,0,0,1,0|2,1,0]=4 367 B6R0.2 CC(=O)CC(O)=O Amb22348460 [0,0,0,0,1,0|3,0,0]=4 368 B6R0.2 CC(=O)CC([O-])=O Amb22265051 [0,0,0,0,1,0|3,0,0]=4 369 B6R0.2 CC(=O)NC(=S)N Amb10068733 [0,0,0,0,1,0|1,1,1]=4 370 B6R0.2 CC(=O)NC(N)=N Amb22754056 [0,0,0,0,1,0|2,0,1]=4 371 B6R0.2 CC(=O)OC(N)=N Amb25242014 [0,0,0,0,1,0|3,0,0]=4 372 B6R0.2 CC(=S)CC(N)=O Amb24479846 [0,0,0,0,1,0|2,1,0]=4 373 B6R0.2 CC(C)=NC(N)=O Amb24682478 [0,0,0,0,1,0|2,0,0]=3 374 B6R0.2 CC(Cl)=CC(N)=O Amb24567853 [0,0,0,0,1,0|3,0,0]=4 375 B6R0.2 CC(N)=CC(N)=S Amb24097463 [0,0,0,0,1,0|2,1,0]=4 376 B6R0.2 CC(N)=CC(O)=O Amb25856437 [0,0,0,0,1,0|3,0,0]=4 377 B6R0.2 CC(N)CC(N)=O Amb18281237 [0,0,0,0,1,0|2,0,1]=4 378 B6R0.2 CN(N)NC(N)=O Amb25327360 [0,0,0,0,1,0|2,0,1]=4 379 B6R0.2 CS(=O)CC(N)=O Amb24394100 [0,0,0,0,1,0|3,0,0]=4 380 B6R0.2 C[13C](=O)O[13C](C)=O Amb22353530 [0,0,0,0,1,0|3,0,0]=4 381 B6R0.2 C[C@@H](N)CC(N)=O Amb25789836 [0,0,0,0,1,0|2,0,1]=4 382 B6R0.2 C\C(=C/C(=O)C)\N Amb1149988 [0,0,0,0,1,0|3,0,0]=4 383 B6R0.2 C\C(\Cl)=C\C(N)=O Amb24714532 [0,0,0,0,1,0|3,0,0]=4 384 B6R0.2 C\C(\I)=C/C(N)=O Amb25378941 [0,0,0,0,1,0|3,0,0]=4 385 B6R0.2 C\C(\N)=C\C(N)=O Amb22002462 [0,0,0,0,1,0|2,0,0]=3 386 B6R0.2 C\C(\N)=C\C(N)=S Amb19929130 [0,0,0,0,1,0|2,1,0]=4 387 B6R0.2 NC(=N)CC(=O)N Amb1981332 [0,0,0,0,1,0|2,0,0]=3 388 B6R0.2 NC(=N)NC(=N)N Amb16232098 [0,0,0,0,1,0|2,0,1]=4 389 B6R0.2 NC(=N)NC(=O)C Amb2236591 [0,0,0,0,1,0|2,0,1]=4 390 B6R0.2 NC(=N)NC(=O)N Amb17610487 [0,0,0,0,1,0|1,0,1]=3 391 B6R0.2 NC(=N)NC(=S)N Amb16205360 [0,0,0,0,1,0|1,1,1]=4 392 B6R0.2 NC(=N)NC(N)=O Amb22351794 [0,0,0,0,1,0|1,0,1]=3 393 B6R0.2 NC(=N)NC(N)=O Amb22730112 [0,0,0,0,1,0|1,0,1]=3 394 B6R0.2 NC(=NC(=N)N)N Amb16232104 [0,0,0,0,1,0|2,0,0]=3 395 B6R0.2 NC(=NC(=O)N)N Amb17614858 [0,0,0,0,1,0|1,0,0]=2 396 B6R0.2 NC(=O)C=C(Cl)Cl Amb25728096 [0,0,0,0,1,0|3,0,0]=4 397 B6R0.2 NC(=O)CC(=N)[NH3+] Amb2439350 [0,0,0,0,1,0|2,0,1]=4 398 B6R0.2 NC(=O)CC(=O)N Amb1971463 [0,0,0,0,1,0|1,0,0]=2 399 B6R0.2 NC(=O)CC(=S)N Amb1155422 [0,0,0,0,1,0|1,1,0]=3 400 B6R0.2 NC(=O)CC([O-])=O Amb22263088 [0,0,0,0,1,0|2,0,0]=3 401 B6R0.2 NC(=O)NC(N)=N Amb22167718 [0,0,0,0,1,0|1,0,1]=3 402 B6R0.2 NC(=O)N[N+]([O-])=O Amb17672280 [0,0,0,0,1,0|2,0,1]=4 403 B6R0.2 NC(=O)[CH-]C(N)=O Amb24591184 [0,0,0,0,1,0|1,0,0]=2 404 B6R0.2 NC(=S)CC(=S)N Amb1981072 [0,0,0,0,1,0|1,2,0]=4 405 B6R0.2 NC(=S)NC(N)=N Amb22347477 [0,0,0,0,1,0|1,1,1]=4 406 B6R0.2 N[13C](=O)N[13C](N)=O Amb22367408 [0,0,0,0,1,0|0,0,1]=2 407 B6R0.2 N[13C](=O)[13CH2][13C](=O)N Amb17616663 [0,0,0,0,1,0|1,0,0]=2 408 B6R0.2 OC(=O)CC(=S)N Amb17465742 [0,0,0,0,1,0|2,1,0]=4 409 B6R0.2 OC(=O)CC(O)=O Amb21935659 [0,0,0,0,1,0|3,0,0]=4 410 B6R0.2 OC(=O)CC(O)=O Amb22230690 [0,0,0,0,1,0|3,0,0]=4 411 B6R0.2 OC(=O)CC(O)=O Amb22230927 [0,0,0,0,1,0|3,0,0]=4 412 B6R0.2 OC(=O)[13CH2]C(O)=O Amb22337806 [0,0,0,0,1,0|3,0,0]=4 413 B6R0.2 O[13C](=O)C[13C](O)=O Amb22353218 [0,0,0,0,1,0|3,0,0]=4 414 B6R0.2 O[13C](=O)[13CH2][13C](O)=O Amb22363192 [0,0,0,0,1,0|3,0,0]=4 415 B6R0.2 O[14C](=O)O[14C](O)=O Amb22362831 [0,0,0,0,1,0|3,0,0]=4 416 B6R0.2 [13CH3]C(=O)OC([13CH3])=O Amb22336728 [0,0,0,0,1,0|3,0,0]=4 417 B6R0.2 [13CH3][13C](=O)O[13C]([13CH3])=O Amb22338759 [0,0,0,0,1,0|3,0,0]=4 418 B6R0.2 [15NH2]C(=O)[15NH]C([15NH2])=O Amb22367466 [0,0,0,0,1,0|0,0,1]=2 419 B6R0.2 [15NH2]C(=[15N]C(=O)C)[15NH2] Amb17614859 [0,0,0,0,1,0|2,0,0]=3 420 B6R0.2 [O-]C(=O)CC(=O)[O-] Amb10070428 [0,0,0,0,1,0|3,0,0]=4 421 B6R0.2 [O-]C(=O)CC([O-])=O Amb22730396 [0,0,0,0,1,0|3,0,0]=4 422 B6R0.2 [O-][N+](=O)CC(=O)N Amb10069145 [0,0,0,0,1,0|3,0,0]=4 423 B6R0.2 [O-][N+](=O)CC(=O)N Amb1101925 [0,0,0,0,1,0|3,0,0]=4 424 B8R0.28 C=C(Br)\C=N\NC(N)=O Amb24480077 [0,0,0,0,0,1|2,0,1]=4 425 B8R0.28 CC(=C)C=NNC(N)=O Amb25146148 [0,0,0,0,0,1|2,0,1]=4 426 B8R0.28 CC(=O)C=NNC(N)=O Amb24561654 [0,0,0,0,0,1|1,0,1]=3 427 B8R0.28 CC(=O)C=NNC(N)=S Amb24514807 [0,0,0,0,0,1|1,1,1]=4 428 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [0,0,0,0,0,1|3,0,0]=4 429 B8R0.28 CC(=O)COCC(N)=O Amb24070191 [0,0,0,0,0,1|3,0,0]=4 430 B8R0.28 CC(=O)N=C=CC(C)=O Amb24072229 [0,0,0,0,0,1|3,0,0]=4 431 B8R0.28 CC(=O)N=CNC(C)=O Amb24541273 [0,0,0,0,0,1|2,0,1]=4 432 B8R0.28 CC(=O)N\C=C\C(N)=O Amb24477760 [0,0,0,0,0,1|2,0,1]=4 433 B8R0.28 CC(=O)O\N=C\C(C)=O Amb25043999 [0,0,0,0,0,1|3,0,0]=4 434 B8R0.28 CC(=O)SCCC(N)=O Amb24552735 [0,0,0,0,0,1|3,0,0]=4 435 B8R0.28 CC(=O)\C=N/CC(O)=O Amb25347610 [0,0,0,0,0,1|3,0,0]=4 436 B8R0.28 CC(N)=NN=CC(O)=O Amb24455612 [0,0,0,0,0,1|2,0,0]=3 437 B8R0.28 CC(N)\C=N\NC(N)=O Amb24529121 [0,0,0,0,0,1|1,0,2]=4 438 B8R0.28 C[C@H](N)C=NNC(N)=O Amb25125646 [0,0,0,0,0,1|1,0,2]=4 439 B8R0.28 NC(=O)CCCC(N)=N Amb25173064 [0,0,0,0,0,1|3,0,0]=4 440 B8R0.28 NC(=O)CCCC(N)=O Amb24098550 [0,0,0,0,0,1|2,0,0]=3 441 B8R0.28 NC(=O)CSCC(=O)Cl Amb25288065 [0,0,0,0,0,1|3,0,0]=4 442 B8R0.28 NC(=O)CSCC(=O)O Amb1128074 [0,0,0,0,0,1|3,0,0]=4 443 B8R0.28 NC(=O)CSCC(N)=N Amb23313355 [0,0,0,0,0,1|3,0,0]=4 444 B8R0.28 NC(=O)NCCC(N)=N Amb25102435 [0,0,0,0,0,1|2,0,1]=4 445 B8R0.28 NC(=O)NCNC(N)=O Amb24105508 [0,0,0,0,0,1|0,0,2]=3 446 B8R0.28 NC(=O)NN=CC(N)=O Amb24579018 [0,0,0,0,0,1|0,0,1]=2 447 B8R0.28 NC(=O)NN=CC(O)=O Amb24616453 [0,0,0,0,0,1|1,0,1]=3 448 B8R0.28 NC(=O)N\N=C\C(=O)O Amb10552378 [0,0,0,0,0,1|1,0,1]=3 449 B8R0.28 NC(=O)\C=C\CC(N)=O Amb24721870 [0,0,0,0,0,1|2,0,0]=3 450 B8R0.28 NC(=O)\N=C\NC(N)=O Amb24685196 [0,0,0,0,0,1|0,0,1]=2 451 B8R0.28 NC(=S)CCOC(N)=O Amb25104739 [0,0,0,0,0,1|2,1,0]=4 452 B8R0.28 NC(=S)N\N=C\C(=O)O Amb1396751 [0,0,0,0,0,1|1,1,1]=4 453 B8R0.28 NC(=S)SCCC(N)=O Amb24691673 [0,0,0,0,0,1|2,1,0]=4 454 B8R0.28 NC(N)=NCCC(=O)Cl Amb24524091 [0,0,0,0,0,1|3,0,0]=4 455 B8R0.28 OC(=O)\C=N\N=C(/S)\N Amb2567022 [0,0,0,0,0,1|1,1,0]=3 456 B5R0.1 C=CNC(N)=O Amb25082241 [2,0,0,0,0,0|1,0,1]=4 457 B5R0.1 C=NNC(N)=N Amb25210024 [2,0,0,0,0,0|1,0,1]=4 458 B5R0.1 C=NNC(N)=O Amb24567354 [2,0,0,0,0,0|0,0,1]=3 459 B5R0.1 CC(=O)CC=O Amb17666764 [2,0,0,0,0,0|2,0,0]=4 460 B5R0.1 CC(=O)CN=O Amb24645582 [2,0,0,0,0,0|2,0,0]=4 461 B5R0.1 CC(=O)OC=O Amb25283525 [2,0,0,0,0,0|2,0,0]=4 462 B5R0.1 CC(=O)\C=C/N Amb25147403 [2,0,0,0,0,0|2,0,0]=4 463 B5R0.1 CN=NC(N)=S Amb24383049 [2,0,0,0,0,0|0,1,1]=4 464 B5R0.1 C\C(\N)=N\C=C Amb24448988 [2,0,0,0,0,0|2,0,0]=4 465 B5R0.1 C\C=N\C(N)=S Amb25744557 [2,0,0,0,0,0|1,1,0]=4 466 B5R0.1 NC(=N)NN=O Amb22231326 [2,0,0,0,0,0|1,0,1]=4 467 B5R0.1 NC(=O)C=NO Amb25147466 [2,0,0,0,0,0|1,0,1]=4 468 B5R0.1 NC(=O)CC=C Amb17610156 [2,0,0,0,0,0|2,0,0]=4 469 B5R0.1 NC(=O)CC=O Amb25777522 [2,0,0,0,0,0|1,0,0]=3 470 B5R0.1 NC(=O)OC=C Amb17621270 [2,0,0,0,0,0|2,0,0]=4 471 B5R0.1 NC(=O)\C=C/Br Amb25715916 [2,0,0,0,0,0|2,0,0]=4 472 B5R0.1 NC(=O)\C=C\Cl Amb10552376 [2,0,0,0,0,0|2,0,0]=4 473 B5R0.1 NC(=S)CN=C Amb1982355 [2,0,0,0,0,0|1,1,0]=4 474 B5R0.1 NCCC(=O)N Amb1137251 [2,0,0,0,0,0|1,0,1]=4 475 B5R0.1 NOCC(N)=O Amb22059481 [2,0,0,0,0,0|2,0,0]=4 476 B5R0.1 N\C=C/C(N)=O Amb22489591 [2,0,0,0,0,0|1,0,0]=3 477 B5R0.1 N\N=C\C(O)=O Amb25703365 [2,0,0,0,0,0|2,0,0]=4 478 B5R0.1 O=C=NC(=O)C Amb17231800 [2,0,0,0,0,0|1,0,1]=4 479 B5R0.1 O=C=NC(=O)Cl Amb22348016 [2,0,0,0,0,0|1,0,1]=4 480 B5R0.1 OC(=O)CC=O Amb22169407 [2,0,0,0,0,0|2,0,0]=4 481 B5R0.2 N\C=C\CC=O Amb24706738 [2,0,0,0,0,0|2,0,0]=4 482 B5R0.2 N\C=N\N=C\N Amb24764244 [2,0,0,0,0,0|0,0,0]=2 483 B5R0.2 O=CC#CC=O Amb25714016 [2,0,0,0,0,0|2,0,0]=4 484 B5R0.2 O=CCCC=O Amb22231966 [2,0,0,0,0,0|2,0,0]=4 485 B5R0.2 O=C\C=C\C=O Amb17593019 [2,0,0,0,0,0|2,0,0]=4 486 B7R0.2 NC(CC(N)=O)C=O Amb24482471 [1,1,0,0,0,0|2,0,0]=4 487 B7R0.2 N[C@@H](CC(N)=O)C=O Amb24446454 [1,1,0,0,0,0|2,0,0]=4 488 B7R0.3 CC=NN=C(N)SC Amb24548619 [1,1,0,0,0,0|1,1,0]=4 489 B7R0.3 CNC(=O)CN=C=O Amb25340772 [1,1,0,0,0,0|1,0,1]=4 490 B7R0.3 CNC(=O)CNC=O Amb25789179 [1,1,0,0,0,0|1,0,1]=4 491 B7R0.3 C\C=N\N=C(/N)\SC Amb24507840 [1,1,0,0,0,0|1,1,0]=4 492 B7R0.4 C#C\C=N\NC(N)=O Amb24481393 [1,1,0,0,0,0|1,0,1]=4 493 B7R0.4 NC(=O)CCNC=O Amb24630476 [1,1,0,0,0,0|1,0,1]=4 494 B7R0.4 NC(=O)CONC=O Amb25783022 [1,1,0,0,0,0|1,0,1]=4 495 B7R0.4 NC(=O)CSCC=O Amb25806671 [1,1,0,0,0,0|2,0,0]=4 496 B7R0.4 NC(=O)N=NC=NO Amb24697760 [1,1,0,0,0,0|0,0,1]=3 497 B7R0.4 NC(N)=NCCC=O Amb25265924 [1,1,0,0,0,0|2,0,0]=4 498 B7R0.5 CC(=CC=O)C(N)=O Amb24548847 [1,1,0,0,0,0|2,0,0]=4 499 B7R0.5 CC(N)=C(C)N=CN Amb25213221 [1,1,0,0,0,0|2,0,0]=4 500 B7R0.5 CC(NC=O)C(N)=O Amb24533730 [1,1,0,0,0,0|1,0,1]=4 501 B7R0.9 NC(=O)CS(N)(=O)=O Amb25081925 [0,1,0,0,1,0|2,0,0]=4 502 B7R0.16 CC(=O)C(Br)C(N)=O Amb24483263 [0,1,0,0,1,0|2,0,0]=4 503 B7R0.16 CC(=O)C(Cl)C(N)=O Amb24056422 [0,1,0,0,1,0|2,0,0]=4 504 B7R0.16 CC(=O)N(C)C(N)=O Amb24621834 [0,1,0,0,1,0|1,0,1]=4 505 B7R0.16 CC(=O)N(Cl)C(N)=O Amb24481411 [0,1,0,0,1,0|1,0,1]=4 506 B7R0.16 CC(C(=O)N)C(=O)C Amb10552518 [0,1,0,0,1,0|2,0,0]=4 507 B7R0.16 CC(C(N)=O)C(N)=S Amb22229181 [0,1,0,0,1,0|1,1,0]=4 508 B7R0.16 CC(N)=C(C)C(N)=O Amb24568296 [0,1,0,0,1,0|2,0,0]=4 509 B7R0.16 CC(N)=C(Cl)C(N)=O Amb24760958 [0,1,0,0,1,0|2,0,0]=4 510 B7R0.16 CN(C(N)=N)C(N)=O Amb25836892 [0,1,0,0,1,0|1,0,1]=4 511 B7R0.16 CN(C(N)=O)C(N)=S Amb24383546 [0,1,0,0,1,0|0,1,1]=4 512 B7R0.16 C\C(\N)=C(\C)/C(N)=O Amb25293132 [0,1,0,0,1,0|2,0,0]=4 513 B7R0.16 NC(=O)C(=O)C(O)=O Amb25344375 [0,1,0,0,1,0|2,0,0]=4 514 B7R0.16 NC(=O)C(Br)C(N)=O Amb23504430 [0,1,0,0,1,0|1,0,0]=3 515 B7R0.16 NC(=O)C(Cl)C(O)=O Amb25756168 [0,1,0,0,1,0|2,0,0]=4 516 B7R0.16 NC(=O)C(F)C(O)=O Amb25376646 [0,1,0,0,1,0|2,0,0]=4 517 B7R0.16 NC(=O)C(N)C(O)=O Amb24552728 [0,1,0,0,1,0|2,0,0]=4 518 B7R0.16 NC(=O)C(O)C(O)=O Amb24548669 [0,1,0,0,1,0|2,0,0]=4 519 B7R0.16 NC(N)=C(N)C(N)=O Amb24426784 [0,1,0,0,1,0|2,0,0]=4 520 B9R0.1 CCC(=O)\C=N\NC(N)=O Amb25147626 [0,1,0,0,0,1|1,0,1]=4 521 B9R0.1 CNC(=O)CCCC(N)=O Amb24746424 [0,1,0,0,0,1|2,0,0]=4 522 B9R0.1 CNC(=O)CCNC(N)=O Amb24361117 [0,1,0,0,0,1|1,0,1]=4 523 B9R0.1 CNC(=O)NCCC(N)=O Amb24421939 [0,1,0,0,0,1|1,0,1]=4 524 B9R0.1 NC(=O)CCNC(=O)CN Amb21929344 [0,1,0,0,0,1|1,0,1]=4 525 B9R0.1 NC(=O)CCSC(=O)CN Amb25824263 [0,1,0,0,0,1|2,0,0]=4 526 B9R0.1 NC(=O)CSCC(=O)NN Amb24632664 [0,1,0,0,0,1|2,0,0]=4 527 B9R0.1 NC(=O)NCCC(=O)NO Amb25796572 [0,1,0,0,0,1|1,0,1]=4 528 B9R0.1 NC(=O)SCCC(=O)NN Amb24707302 [0,1,0,0,0,1|2,0,0]=4 529 B9R0.7 CC(=NN=C(C)N)C(O)=O Amb25216201 [0,1,0,0,0,1|2,0,0]=4 530 B9R0.7 CC(=NN=C(N)N)C(O)=O Amb24093604 [0,1,0,0,0,1|2,0,0]=4 531 B9R0.7 CC(=NNC(N)=O)C(O)=O Amb24516860 [0,1,0,0,0,1|1,0,1]=4 532 B9R0.7 CC(=N\N=C(\N)/S)C(O)=O Amb24558320 [0,1,0,0,0,1|1,1,0]=4 533 B9R0.7 CC(=O)C(C)C=NC(N)=O Amb24695370 [0,1,0,0,0,1|2,0,0]=4 534 B9R0.7 CC(=O)C(C)\C=N\C(N)=O Amb25789488 [0,1,0,0,0,1|2,0,0]=4 535 B9R0.7 CC(=O)NN=C(N)C(N)=O Amb24505105 [0,1,0,0,0,1|1,0,1]=4 536 B9R0.7 CC(=O)ON=C(N)C(N)=O Amb24759594 [0,1,0,0,0,1|2,0,0]=4 537 B9R0.7 CC(=O)\C(\C)=N/NC(N)=O Amb24723966 [0,1,0,0,0,1|1,0,1]=4 538 B9R0.7 CC(OCC(N)=O)C(N)=O Amb25727276 [0,1,0,0,0,1|2,0,0]=4 539 B9R0.7 CC(ONC(N)=O)C(N)=O Amb25845986 [0,1,0,0,0,1|1,0,1]=4 540 B9R0.7 CN(N=CC(O)=O)C(N)=O Amb25737345 [0,1,0,0,0,1|1,0,1]=4 541 B9R0.7 C\C(=N/NC(N)=O)\C(N)=O Amb24760259 [0,1,0,0,0,1|0,0,1]=3 542 B9R0.7 NC(=O)C(N)=NNC(N)=O Amb25080819 [0,1,0,0,0,1|0,0,1]=3 543 B9R0.7 NC(=O)CC[C@@H](N)C(N)=O Amb22748708 [0,1,0,0,0,1|2,0,0]=4 544 B9R0.7 NC(=O)CC[C@H](N)C(N)=O Amb24426852 [0,1,0,0,0,1|2,0,0]=4 545 B9R0.7 NC(=O)CC[C@H](O)C(N)=O Amb24480731 [0,1,0,0,0,1|2,0,0]=4 546 B9R0.7 NC(=O)NNC(=S)C(N)=O Amb25097183 [0,1,0,0,0,1|0,0,2]=4 547 B9R0.7 NC(=O)[C@@H](N)CNC(N)=O Amb25147441 [0,1,0,0,0,1|1,0,1]=4 548 B9R0.7 NC(=O)[C@H](N)CNC(N)=O Amb24548243 [0,1,0,0,0,1|1,0,1]=4 549 B9R0.53 CC(CC(N)=O)NC(N)=O Amb25365692 [0,1,0,0,0,1|1,0,1]=4 550 B9R0.53 NC(=O)CS(=O)CC(N)=O Amb24740763 [0,1,0,0,0,1|2,0,0]=4 551 B9R0.23 CC(C(=O)NC)CC(=O)N Amb17334220 [0,2,0,0,0,0|2,0,0]=4 552 B9R0.23 CC(NC(N)=O)C(=O)NO Amb24705421 [0,2,0,0,0,0|1,0,1]=4 553 B9R0.23 CNC(=O)C(N)CC(N)=O Amb18968977 [0,2,0,0,0,0|2,0,0]=4 554 B9R0.23 CNC(=O)N(C)CC(N)=O Amb25733533 [0,2,0,0,0,0|1,0,1]=4 555 B9R0.23 CNC(=O)[C@H](C)NC(N)=O Amb25846014 [0,2,0,0,0,0|1,0,1]=4 556 B9R0.23 NC(=O)NC(=O)C(=O)NN Amb25703108 [0,2,0,0,0,0|1,0,1]=4 557 B9R0.24 CNC(=O)N=NC(=O)NC Amb25738647 [0,2,0,0,0,0|0,0,0]=2 558 B9R0.24 CNC(=O)NOC(=O)NC Amb25266923 [0,2,0,0,0,0|1,0,1]=4 559 B9R0.24 CNC(O)=NN=C(O)NC Amb24639965 [0,2,0,0,0,0|0,0,2]=4 560 B9R0.24 COC(=O)N=NC(=O)OC Amb10807402 [0,2,0,0,0,0|2,0,0]=4 561 B9R0.24 NC(CCC(N)=S=O)=S=O Amb25774371 [0,2,0,0,0,0|2,0,0]=4 562 B9R0.24 NCC(=O)NCC(=O)NO Amb24418745 [0,2,0,0,0,0|1,0,1]=4 563 B9R0.24 NCC(=O)NNC(=O)CN Amb25231570 [0,2,0,0,0,0|0,0,2]=4 564 B9R0.24 NNC(=O)CNC(=O)NN Amb25339412 [0,2,0,0,0,0|1,0,1]=4 565 B9R0.24 NNC(=O)\C=C\C(=O)NN Amb22040083 [0,2,0,0,0,0|2,0,0]=4 566 B9R0.42 CC(C(=O)N)CC(=O)NC Amb17334219 [0,2,0,0,0,0|2,0,0]=4 567 B9R0.42 CNC(=O)CC(N)C(N)=O Amb25284709 [0,2,0,0,0,0|2,0,0]=4 568 B9R0.42 CNC(=O)NN(C)C(N)=O Amb25084182 [0,2,0,0,0,0|0,0,2]=4 569 B9R0.42 CNC(=O)N[C@H](C)C(N)=O Amb24734187 [0,2,0,0,0,0|1,0,1]=4 570 B9R0.42 C[C@@H](NC(=O)CN)C(N)=O Amb22799926 [0,2,0,0,0,0|1,0,1]=4 571 B9R0.42 C[C@H](NC(=O)CN)C(N)=O Amb19929924 [0,2,0,0,0,0|1,0,1]=4 572 B9R0.42 C[C@H](NC(=O)CN)C(N)=O Amb24761022 [0,2,0,0,0,0|1,0,1]=4 573 B9R0.43 CCC(C=O)=NNC(N)=O Amb24587481 [0,2,0,0,0,0|1,0,1]=4 574 B9R0.43 NC(=N)\N=N\C(\NCl)=N\Cl Amb24074100 [0,2,0,0,0,0|2,0,0]=4 575 B9R0.43 NC(=O)NN=C(CO)CN Amb24478869 [0,2,0,0,0,0|0,0,2]=4 576 B9R0.48 CC(CCN)=NNC(N)=O Amb24579267 [0,2,0,0,0,0|1,0,1]=4 577 B9R0.48 CCNC(=O)CCC(=O)N Amb17142864 [0,2,0,0,0,0|2,0,0]=4 578 B9R0.48 CCNC(=O)NCC(N)=O Amb24632867 [0,2,0,0,0,0|1,0,1]=4 579 B9R0.48 CCNC(=O)NNC(N)=O Amb25063732 [0,2,0,0,0,0|0,0,2]=4 580 B9R0.48 CONC(=O)NNC(N)=O Amb24397807 [0,2,0,0,0,0|0,0,2]=4 581 B9R0.48 NCCC(=O)NCC(=O)N Amb1135256 [0,2,0,0,0,0|1,0,1]=4 582 B9R0.11 CC(C)(NC(N)=O)C(N)=O Amb25249590 [0,2,0,0,0,0|1,0,1]=4 583 B9R0.11 CC(C)(OC(N)=O)C(N)=O Amb25147280 [0,2,0,0,0,0|2,0,0]=4 584 B9R0.11 CC(N)(CC(N)=O)C(N)=O Amb24436628 [0,2,0,0,0,0|2,0,0]=4 585 B9R0.39 CCC(=CC(N)=O)C(N)=O Amb24514933 [0,2,0,0,0,0|2,0,0]=4 586 B9R0.39 CC[C@@H](NC(N)=O)C(N)=O Amb25177334 [0,2,0,0,0,0|1,0,1]=4 587 B9R0.39 CNC(CC(N)=O)C(N)=O Amb25680930 [0,2,0,0,0,0|2,0,0]=4 588 B9R0.39 COC(CC(N)=O)C(N)=O Amb24685112 [0,2,0,0,0,0|2,0,0]=4 589 B9R0.39 CO[C@@H](CC(N)=O)C(N)=O Amb25268728 [0,2,0,0,0,0|2,0,0]=4 590 B9R0.39 CO\C(=C\C(N)=O)\C(N)=O Amb25147503 [0,2,0,0,0,0|2,0,0]=4 591 B9R0.39 N#CC(C(=O)N)NC(=O)N Amb17593581 [0,2,0,0,0,0|1,0,1]=4 592 B9R0.39 NC(=O)C(CC(N)=O)C#N Amb25147452 [0,2,0,0,0,0|2,0,0]=4 593 B9R0.79 C=C(C(N)=O)C(=C)C(N)=O Amb25147392 [0,2,0,0,0,0|2,0,0]=4 594 B9R0.79 CC(C(N)=O)N(C)C(N)=O Amb25147563 [0,2,0,0,0,0|1,0,1]=4 595 B9R0.79 CN(C(N)=O)N(C)C(N)=O Amb25703131 [0,2,0,0,0,0|0,0,2]=4 596 B9R0.79 C[C@H]([C@H](C)C(N)=O)C(N)=O Amb25091711 [0,2,0,0,0,0|2,0,0]=4 597 B9R0.79 C\C(\C(N)=O)=C(/C)\C(N)=O Amb24584917 [0,2,0,0,0,0|2,0,0]=4 598 B9R0.79 NC(=O)C(Br)C(Br)C(N)=O Amb25243175 [0,2,0,0,0,0|2,0,0]=4 599 B9R0.79 NC(=O)C(Cl)=C(Cl)C(N)=O Amb25216977 [0,2,0,0,0,0|2,0,0]=4 600 B9R0.79 NC(=O)C(F)=C(F)C(N)=O Amb25708495 [0,2,0,0,0,0|2,0,0]=4 601 B9R0.79 NC(=O)C(O)C(F)C(N)=O Amb24710117 [0,2,0,0,0,0|2,0,0]=4 602 B9R0.79 NC(=O)C(S)C(S)C(N)=O Amb25804691 [0,2,0,0,0,0|2,0,0]=4 603 B9R0.79 NC(=O)[C@@H](O)[C@@H](O)C(N)=O Amb25738404 [0,2,0,0,0,0|2,0,0]=4 604 B9R0.79 NC(=O)[C@H](O)[C@@H](O)C(N)=O Amb24385859 [0,2,0,0,0,0|2,0,0]=4 605 B9R0.79 NC(=O)\C(\Br)=C(/Br)\C(N)=O Amb25837516 [0,2,0,0,0,0|2,0,0]=4 606 B9R0.79 NC(C(O)C(N)=O)C(N)=O Amb25733436 [0,2,0,0,0,0|2,0,0]=4 607 B9R0.79 N[C@H]([C@H](O)C(N)=O)C(N)=O Amb24359322 [0,2,0,0,0,0|2,0,0]=4 608 B7R1.2 CC1=CC(=O)N=N1 Amb20621717 [1,0,0,1,0,0|2,0,0]=4 609 B7R1.2 Cc1[nH]c(N)[n][n]1 Amb17659111 [1,0,0,1,0,0|1,0,0]=3 610 B7R1.2 Cc1[nH]c(N)[n][n]1 Amb21884798 [1,0,0,1,0,0|1,0,0]=3 611 B7R1.2 Cc1[nH]c(N)[n][n]1 Amb22728927 [1,0,0,1,0,0|1,0,0]=3 612 B7R1.2 Cc1[nH]c(N)c[n]1 Amb18673420 [1,0,0,1,0,0|2,0,0]=4 613 B7R1.2 Cc1[nH]c(N)c[n]1 Amb23401008 [1,0,0,1,0,0|2,0,0]=4 614 B7R1.2 Cc1c[n]c(N)[nH]1 Amb22001596 [1,0,0,1,0,0|2,0,0]=4 615 B7R1.2 Cc1c[n]c(N)[nH]1 Amb22002611 [1,0,0,1,0,0|2,0,0]=4 616 B7R1.2 Cc1nnc([nH]1)C Amb1019541 [1,0,0,1,0,0|2,0,0]=4 617 B7R1.2 Cc1nnc([nH]1)Cl Amb10236776 [1,0,0,1,0,0|2,0,0]=4 618 B7R1.2 Cc1nnc([nH]1)N Amb1159813 [1,0,0,1,0,0|1,0,0]=3 619 B7R1.2 Cc1nnc(o1)N Amb1107346 [1,0,0,1,0,0|1,0,1]=4 620 B7R1.2 Cc1nnc(s1)N Amb16225736 [1,0,0,1,0,0|1,1,0]=4 621 B7R1.2 NC1=CCC(=O)N1 Amb25757914 [1,0,0,1,0,0|2,0,0]=4 622 B7R1.2 NC1=NC(=O)C=N1 Amb22015342 [1,0,0,1,0,0|1,0,1]=4 623 B7R1.2 NC1=NCC(=O)O1 Amb24061087 [1,0,0,1,0,0|1,0,1]=4 624 B7R1.2 NC1=NCC(=O)S1 Amb25810910 [1,0,0,1,0,0|1,1,0]=4 625 B7R1.2 NC1=NNC(=O)S1 Amb20248715 [1,0,0,1,0,0|0,1,1]=4 626 B7R1.2 NC=1NC(=O)CN1 Amb21964674 [1,0,0,1,0,0|1,0,0]=3 627 B7R1.2 NC=1NC(=S)NN1 Amb19115709 [1,0,0,1,0,0|0,1,1]=4 628 B7R1.2 Nc1[nH]c(I)c[n]1 Amb25103897 [1,0,0,1,0,0|2,0,0]=4 629 B7R1.2 Nc1[nH]c(S)[n][n]1 Amb17659125 [1,0,0,1,0,0|0,1,0]=3 630 B7R1.2 Nc1[n][nH]c(N)[n]1 Amb21964362 [1,0,0,1,0,0|1,0,1]=4 631 B7R1.2 Nc1[n][n]c(Cl)[s]1 Amb19374207 [1,0,0,1,0,0|1,1,0]=4 632 B7R1.2 Nc1[n][n]c(Cl)[s]1 Amb23401911 [1,0,0,1,0,0|1,1,0]=4 633 B7R1.2 Nc1[n][n]c(I)[s]1 Amb23400701 [1,0,0,1,0,0|1,1,0]=4 634 B7R1.2 Nc1[n][n]c(O)[s]1 Amb18123743 [1,0,0,1,0,0|0,1,1]=4 635 B7R1.2 Nc1[n][n]c(O)o1 Amb20248810 [1,0,0,1,0,0|0,0,2]=4 636 B7R1.2 Nc1[n][n]c([S-])[s]1 Amb24179710 [1,0,0,1,0,0|0,2,0]=4 637 B7R1.2 Nc1[n]cc(N)[s]1 Amb18202823 [1,0,0,1,0,0|1,1,0]=4 638 B7R1.2 Nc1c[n](N)[n][n]1 Amb24611799 [1,0,0,1,0,0|2,0,0]=4 639 B7R1.2 Nc1cc(N)[nH][n]1 Amb18276057 [1,0,0,1,0,0|1,0,1]=4 640 B7R1.2 Nc1cc(N)[nH][n]1 Amb22001423 [1,0,0,1,0,0|1,0,1]=4 641 B7R1.2 Nc1n[nH]c(=O)[nH]1 Amb10565929 [1,0,0,1,0,0|0,0,1]=3 642 B7R1.2 Nc1nnc(s1)Br Amb1086033 [1,0,0,1,0,0|1,1,0]=4 643 B7R1.2 Nc1nnc(s1)N Amb16204870 [1,0,0,1,0,0|0,1,0]=3 644 B7R1.2 Nc1nnc(s1)S Amb1153002 [1,0,0,1,0,0|0,2,0]=4 645 B7R1.2 Nc1onc(c1)N Amb13951830 [1,0,0,1,0,0|2,0,0]=4 646 B7R1.2 Nc1onc(c1)N Amb17622003 [1,0,0,1,0,0|2,0,0]=4 647 B7R1.2 Nc1snc(n1)N Amb1195983 [1,0,0,1,0,0|2,0,0]=4 648 B7R1.2 O=C1C=CC(=O)N1 Amb1235242 [1,0,0,1,0,0|2,0,0]=4 649 B7R1.2 O=C1CCC(=O)[15NH]1 Amb22338306 [1,0,0,1,0,0|2,0,0]=4 650 B7R1.2 O=C1CN=C(S)N1 Amb22058713 [1,0,0,1,0,0|1,1,0]=4 651 B7R1.2 O=C1NC(=O)C=S1 Amb25780722 [1,0,0,1,0,0|2,0,0]=4 652 B7R1.2 O=C1NC(=O)NN1 Amb20660475 [1,0,0,1,0,0|0,0,2]=4 653 B7R1.2 O=C1NC(Cl)=NN1 Amb19516644 [1,0,0,1,0,0|1,0,1]=4 654 B7R1.2 O=C1NOC(=O)N1 Amb22002584 [1,0,0,1,0,0|1,0,1]=4 655 B7R1.2 O=C1OCC(=O)N1 Amb1625991 [1,0,0,1,0,0|2,0,0]=4 656 B7R1.2 O=C1SCC(=O)N1 Amb1853667 [1,0,0,1,0,0|2,0,0]=4 657 B7R1.2 O=C1[15NH][13CH2]C(=O)N1 Amb17615001 [1,0,0,1,0,0|1,0,1]=4 658 B7R1.2 O=C1[15NH][13CH2][13C](=O)N1 Amb17615000 [1,0,0,1,0,0|1,0,1]=4 659 B7R1.2 Oc1nnc([nH]1)S Amb16231356 [1,0,0,1,0,0|0,1,1]=4 660 B7R1.2 Sc1[nH]c(S)[n][n]1 Amb22551854 [1,0,0,1,0,0|0,2,0]=4 661 B7R1.3 NC1=NNC=NN1 Amb17760306 [1,0,0,1,0,0|1,0,1]=4 662 B7R1.3 Nc1c[n]c[n][n]1 Amb18200315 [1,0,0,1,0,0|1,0,1]=4 663 B7R1.3 Nc1ccc[n][n]1 Amb22489517 [1,0,0,1,0,0|2,0,0]=4 664 B7R1.3 Nc1cccnn1 Amb2455972 [1,0,0,1,0,0|2,0,0]=4 665 B7R1.3 O=C1C=NC=CN1 Amb22406482 [1,0,0,1,0,0|2,0,0]=4 666 B7R1.3 O=C1NC=CC=N1 Amb19261228 [1,0,0,1,0,0|2,0,0]=4 667 B7R1.3 O=C1NC=CC=N1 Amb20241236 [1,0,0,1,0,0|2,0,0]=4 668 B7R1.3 O=C1NC=CC=N1 Amb22489504 [1,0,0,1,0,0|2,0,0]=4 669 B7R1.3 O=C1NCC=NN1 Amb25806617 [1,0,0,1,0,0|1,0,1]=4 670 B7R1.3 S=C1NNC=NN1 Amb21967556 [1,0,0,1,0,0|0,1,1]=4 671 B7R1.10 O=CC1CC(=O)N1 Amb24479772 [1,0,0,1,0,0|2,0,0]=4 672 B9R1.35 CC(=O)C=1NC(=O)NN1 Amb24600059 [0,0,0,1,0,1|1,0,1]=4 673 B9R1.35 CC(=O)c1[n][n]c(N)[s]1 Amb24635848 [0,0,0,1,0,1|1,1,0]=4 674 B9R1.35 CC(=O)c1[n][n]c(N)o1 Amb18124317 [0,0,0,1,0,1|1,0,1]=4 675 B9R1.35 Cc1[nH]c(c[n]1)C(N)=O Amb24340093 [0,0,0,1,0,1|2,0,0]=4 676 B9R1.35 Cc1c[n]c([nH]1)C(N)=O Amb24520095 [0,0,0,1,0,1|2,0,0]=4 677 B9R1.35 NC(=O)C1=NNC(=O)S1 Amb25142003 [0,0,0,1,0,1|1,0,1]=4 678 B9R1.35 NC(=O)C1CNC(=O)N1 Amb25380692 [0,0,0,1,0,1|1,0,1]=4 679 B9R1.35 NC(=O)C1COC(=O)N1 Amb24683685 [0,0,0,1,0,1|2,0,0]=4 680 B9R1.35 NC(=O)C=1CC(=O)NN1 Amb25306804 [0,0,0,1,0,1|1,0,1]=4 681 B9R1.35 NC(=O)N1CC(=O)N=N1 Amb24760563 [0,0,0,1,0,1|1,0,0]=3 682 B9R1.35 NC(=O)[C@@H]1CNC(=O)N1 Amb25740143 [0,0,0,1,0,1|1,0,1]=4 683 B9R1.35 NC(=O)c1[nH]c(S)[n][n]1 Amb25338283 [0,0,0,1,0,1|0,1,0]=3 684 B9R1.35 NC(=O)c1[n][n]c(Br)[s]1 Amb23437052 [0,0,0,1,0,1|1,1,0]=4 685 B9R1.35 NC(=O)c1[n][n]c(Cl)[s]1 Amb22498923 [0,0,0,1,0,1|1,1,0]=4 686 B9R1.35 NC(=O)c1[n][n]c(S)o1 Amb25340487 [0,0,0,1,0,1|1,0,1]=4 687 B9R1.35 NC(=O)c1n[nH]c(c1)N Amb15701310 [0,0,0,1,0,1|1,0,1]=4 688 B9R1.35 Nc1[nH]c(c[n]1)C(N)=O Amb24623709 [0,0,0,1,0,1|2,0,0]=4 689 B9R1.35 Nc1[n][n]c([s]1)C(N)=O Amb22490508 [0,0,0,1,0,1|0,1,0]=3 690 B9R1.35 Nc1[n][n]c([s]1)C(O)=O Amb22275932 [0,0,0,1,0,1|1,1,0]=4 691 B9R1.35 Nc1[n][n]c([s]1)C(O)=O Amb22899432 [0,0,0,1,0,1|1,1,0]=4 692 B9R1.35 Nc1[n][n]c(o1)C(O)=O Amb18832581 [0,0,0,1,0,1|1,0,1]=4 693 B9R1.35 Nc1[n]c[n]([n]1)C(N)=O Amb25083953 [0,0,0,1,0,1|1,0,1]=4 694 B9R1.35 Nc1[n]cc(o1)C(N)=O Amb23400984 [0,0,0,1,0,1|1,0,1]=4 695 B9R1.35 Nc1c[n][n](c1)C(N)=O Amb24636856 [0,0,0,1,0,1|1,0,1]=4 696 B9R1.35 Nc1c[n]c([s]1)C(N)=O Amb22489884 [0,0,0,1,0,1|1,1,0]=4 697 B9R1.35 Nc1cc([n][nH]1)C(N)=O Amb22587265 [0,0,0,1,0,1|1,0,1]=4 698 B9R1.35 Nc1cc([n]o1)C(N)=O Amb25858665 [0,0,0,1,0,1|2,0,0]=4 699 B9R1.35 Nc1nnc([nH]1)C(=O)O Amb1914515 [0,0,0,1,0,1|2,0,0]=4 700 B9R1.35 Nc1nnc(o1)C(=N)N Amb16187044 [0,0,0,1,0,1|1,0,1]=4 701 B9R1.35 Nc1nnc(o1)C(=O)N Amb1063100 [0,0,0,1,0,1|0,0,1]=3 702 B9R1.35 O=C1CCC(N1)C(=O)N Amb17142856 [0,0,0,1,0,1|2,0,0]=4 703 B9R1.35 OC(=O)C=1NC(=O)CN1 Amb24387402 [0,0,0,1,0,1|2,0,0]=4 704 B9R1.35 OC(=O)C=1NC(=O)NN1 Amb19205315 [0,0,0,1,0,1|1,0,1]=4 705 B9R1.35 OC(=O)C=1NC(=O)NN1 Amb21955579 [0,0,0,1,0,1|1,0,1]=4 706 B9R1.35 [O-]C(=O)C=1NC(=O)NN1 Amb22408706 [0,0,0,1,0,1|1,0,1]=4 707 B9R1.35 [O-]C(=O)C=1NC(=O)NN1 Amb22757735 [0,0,0,1,0,1|1,0,1]=4 708 B9R1.35 [O-]C(=O)c1[nH]c(O)[n][n]1 Amb22582148 [0,0,0,1,0,1|1,0,1]=4 709 B9R1.35 [O-]C(=O)c1[nH]c(O)[n][n]1 Amb22827018 [0,0,0,1,0,1|1,0,1]=4 710 B9R1.161 NC(=O)[C@@H]1C[C@H]1C(N)=O Amb25273795 [0,0,0,1,0,1|2,0,0]=4 711 B9R1.161 NC(=O)[C@H]1C[C@@H]1C(N)=O Amb24760759 [0,0,0,1,0,1|2,0,0]=4 712 B9R1.161 NC(=O)[C@H]1C[C@H]1C(N)=O Amb24671257 [0,0,0,1,0,1|2,0,0]=4 713 B9R1.1 CNC1=CNC(=O)C=N1 Amb25306731 [0,1,0,1,0,0|2,0,0]=4 714 B9R1.1 CNc1ccc(N)[n][n]1 Amb24543854 [0,1,0,1,0,0|2,0,0]=4 715 B9R1.1 NCC1=CNC(=O)C=N1 Amb18251091 [0,1,0,1,0,0|2,0,0]=4 716 B9R1.1 N\N=C/1\C=CC(=O)N=N1 Amb24595513 [0,1,0,1,0,0|2,0,0]=4 717 B9R1.1 N\N=C\1/C=CC(=O)N=N1 Amb22496175 [0,1,0,1,0,0|2,0,0]=4 718 B9R1.1 Nc1[n][n]c(CN)c[n]1 Amb24117108 [0,1,0,1,0,0|2,0,0]=4 719 B9R1.1 Nc1[n]cc(C=O)[n][n]1 Amb24621544 [0,1,0,1,0,0|2,0,0]=4 720 B9R1.1 Nc1ccc(CN)[n][n]1 Amb25297900 [0,1,0,1,0,0|2,0,0]=4 721 B9R1.1 O=C1C=NC(=CN1)C=O Amb25195744 [0,1,0,1,0,0|2,0,0]=4 722 B9R1.1 O=C1NC=C(C=N1)C=O Amb24063042 [0,1,0,1,0,0|2,0,0]=4 723 B9R1.69 Brc1n[nH]c(=O)[nH]c1=O Amb1351684 [0,1,0,1,0,0|1,0,1]=4 724 B9R1.69 CC1=CC(=O)N=NC1=O Amb21963753 [0,1,0,1,0,0|2,0,0]=4 725 B9R1.69 CC1=CC(=O)NNC1=O Amb19657930 [0,1,0,1,0,0|2,0,0]=4 726 B9R1.69 CC1=CN=C(N)C(=O)N1 Amb22498349 [0,1,0,1,0,0|2,0,0]=4 727 B9R1.69 CC1=NN=C(C)NC1=O Amb19517093 [0,1,0,1,0,0|2,0,0]=4 728 B9R1.69 CC1=NN=C(N)NC1=O Amb18369917 [0,1,0,1,0,0|2,0,0]=4 729 B9R1.69 CC1=NN=C(S)NC1=O Amb19389086 [0,1,0,1,0,0|1,1,0]=4 730 B9R1.69 CC1=NNC(=O)NC1=O Amb19650730 [0,1,0,1,0,0|1,0,1]=4 731 B9R1.69 CC1=NNC(=O)NC1=O Amb22902390 [0,1,0,1,0,0|1,0,1]=4 732 B9R1.69 CC1N=C(N)CNC1=O Amb25800752 [0,1,0,1,0,0|2,0,0]=4 733 B9R1.69 CC1NC(=O)NNC1=O Amb25789519 [0,1,0,1,0,0|1,0,1]=4 734 B9R1.69 CC=1C=NC(=O)NC1N Amb19133104 [0,1,0,1,0,0|2,0,0]=4 735 B9R1.69 CN1C=C(N)C=NC1=O Amb18034186 [0,1,0,1,0,0|2,0,0]=4 736 B9R1.69 CN1NC(=O)C=CC1=O Amb18372843 [0,1,0,1,0,0|2,0,0]=4 737 B9R1.69 C[C@@H]1N=C(N)CNC1=O Amb25031882 [0,1,0,1,0,0|2,0,0]=4 738 B9R1.69 Cc1[n][n]c(N)[n]c1N Amb25190285 [0,1,0,1,0,0|2,0,0]=4 739 B9R1.69 Clc1cc(=O)[nH][nH]c1=O Amb17943118 [0,1,0,1,0,0|2,0,0]=4 740 B9R1.69 NC1=CN=C(S)NC1=O Amb24669194 [0,1,0,1,0,0|1,1,0]=4 741 B9R1.69 NC1=CNC(=O)NC1=O Amb19113982 [0,1,0,1,0,0|1,0,1]=4 742 B9R1.69 NC1=NC(=O)NC=C1N Amb18124310 [0,1,0,1,0,0|2,0,0]=4 743 B9R1.69 NC1=NC(=O)NCC1=O Amb21963698 [0,1,0,1,0,0|2,0,0]=4 744 B9R1.69 NC1=NC=C(Br)NC1=O Amb22494189 [0,1,0,1,0,0|2,0,0]=4 745 B9R1.69 NC1=NN=C(N)NC1=O Amb24579785 [0,1,0,1,0,0|1,0,0]=3 746 B9R1.69 NC1=NNC(=O)N=C1N Amb18642488 [0,1,0,1,0,0|2,0,0]=4 747 B9R1.69 NC1=NNC(=O)NC1=O Amb18277981 [0,1,0,1,0,0|0,0,1]=3 748 B9R1.69 NC1=NNC(=O)NC1=S Amb24681805 [0,1,0,1,0,0|0,1,1]=4 749 B9R1.69 NC1C=NC(=O)NC1=O Amb22015183 [0,1,0,1,0,0|1,0,1]=4 750 B9R1.69 NC=1NC(=O)C(N)=CN1 Amb22753487 [0,1,0,1,0,0|2,0,0]=4 751 B9R1.69 NC=1NC(=O)N=CC1Br Amb20239424 [0,1,0,1,0,0|2,0,0]=4 752 B9R1.69 NC=1NC(=O)N=CC1F Amb20243378 [0,1,0,1,0,0|2,0,0]=4 753 B9R1.69 NC=1NC(=O)N=CC1I Amb19958313 [0,1,0,1,0,0|2,0,0]=4 754 B9R1.69 NN1C=NC(=O)NC1=O Amb25301286 [0,1,0,1,0,0|2,0,0]=4 755 B9R1.69 Nc1[n][n+]([O-])c(N)[n][n]1 Amb23481589 [0,1,0,1,0,0|1,0,1]=4 756 B9R1.69 Nc1[n][n]c(N)cc1O Amb24476929 [0,1,0,1,0,0|1,0,1]=4 757 B9R1.69 Nc1[n]c(N)c(Br)[n][n]1 Amb24063187 [0,1,0,1,0,0|2,0,0]=4 758 B9R1.69 Nc1c[nH]c(=O)[nH]c1=O Amb1278694 [0,1,0,1,0,0|1,0,1]=4 759 B9R1.69 O=C1NN=C(Br)C(=O)N1 Amb18011132 [0,1,0,1,0,0|1,0,1]=4 760 B9R1.69 O=C1NN=C(F)C(=O)N1 Amb19772798 [0,1,0,1,0,0|1,0,1]=4 761 B9R1.69 O=C1NN=C(I)C(=O)N1 Amb21867724 [0,1,0,1,0,0|1,0,1]=4 762 B9R1.69 O=C1NN=C(S)C(=O)N1 Amb22263089 [0,1,0,1,0,0|1,0,1]=4 763 B9R1.69 O=C1NN=C([S-])C(=O)N1 Amb18184126 [0,1,0,1,0,0|1,0,1]=4 764 B9R1.69 O=C1NN=C([S-])C(=O)N1 Amb19853606 [0,1,0,1,0,0|1,0,1]=4 765 B9R1.69 O=C1NNC(=O)C=C1Br Amb22371447 [0,1,0,1,0,0|2,0,0]=4 766 B9R1.69 O=C1NNC(=O)C=C1Cl Amb20239453 [0,1,0,1,0,0|2,0,0]=4 767 B9R1.69 O=C1NNC(=O)C=C1F Amb24518623 [0,1,0,1,0,0|2,0,0]=4 768 B9R1.69 [13CH3]C=1C=[15N]C(=O)[15NH]C1N Amb19133105 [0,1,0,1,0,0|2,0,0]=4 769 B5R0.5 BrC(=C)C(=O)N Amb16233793 [0,0,0,0,2,0|2,0,0]=4 770 B5R0.5 C=C(F)C(N)=O Amb25312034 [0,0,0,0,2,0|2,0,0]=4 771 B5R0.5 C=C(I)C(N)=O Amb24650953 [0,0,0,0,2,0|2,0,0]=4 772 B5R0.5 CC(=O)C(=O)[13CH3] Amb10072163 [0,0,0,0,2,0|2,0,0]=4 773 B5R0.5 CC(=O)C(N)=N Amb24409561 [0,0,0,0,2,0|2,0,0]=4 774 B5R0.5 CC(=O)C(N)=S Amb24581132 [0,0,0,0,2,0|1,1,0]=4 775 B5R0.5 CC(=O)C([O-])=O Amb22043412 [0,0,0,0,2,0|2,0,0]=4 776 B5R0.5 CC(=O)C([O-])=O Amb22053857 [0,0,0,0,2,0|2,0,0]=4 777 B5R0.5 CC(=O)C([O-])=O Amb22167358 [0,0,0,0,2,0|2,0,0]=4 778 B5R0.5 CC(=O)C([O-])=O Amb22733838 [0,0,0,0,2,0|2,0,0]=4 779 B5R0.5 CC(=O)[13C]([O-])=O Amb22351546 [0,0,0,0,2,0|2,0,0]=4 780 B5R0.5 CC(N)C(N)=O Amb21958673 [0,0,0,0,2,0|1,0,1]=4 781 B5R0.5 C[13C](=O)C([O-])=O Amb22056112 [0,0,0,0,2,0|2,0,0]=4 782 B5R0.5 C[13C](=O)[13C](=O)C Amb17610135 [0,0,0,0,2,0|2,0,0]=4 783 B5R0.5 C[C@@H](N)C(N)=O Amb22746786 [0,0,0,0,2,0|1,0,1]=4 784 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [0,0,0,0,2,0|1,0,1]=4 785 B5R0.5 ClC(=O)C(=O)C Amb17593107 [0,0,0,0,2,0|2,0,0]=4 786 B5R0.5 FC(=O)C(=O)F Amb10840380 [0,0,0,0,2,0|2,0,0]=4 787 B5R0.5 NC(=N)C(=O)O Amb10549353 [0,0,0,0,2,0|2,0,0]=4 788 B5R0.5 NC(=N)C(N)=N Amb25082972 [0,0,0,0,2,0|2,0,0]=4 789 B5R0.5 NC(=O)C(=O)C Amb17593028 [0,0,0,0,2,0|1,0,0]=3 790 B5R0.5 NC(=O)C(=O)Cl Amb24377962 [0,0,0,0,2,0|1,0,0]=3 791 B5R0.5 NC(=O)C(N)C Amb1156937 [0,0,0,0,2,0|1,0,1]=4 792 B5R0.5 NC(=O)C([O-])=O Amb22053860 [0,0,0,0,2,0|1,0,0]=3 793 B5R0.5 NC(=O)C([O-])=O Amb22351608 [0,0,0,0,2,0|1,0,0]=3 794 B5R0.5 NC(=O)C([O-])=O Amb22730546 [0,0,0,0,2,0|1,0,0]=3 795 B5R0.5 NC(=O)C([O-])=S Amb24402142 [0,0,0,0,2,0|1,0,1]=4 796 B5R0.5 NC(=O)[C@@H](N)C Amb2371522 [0,0,0,0,2,0|1,0,1]=4 797 B5R0.5 NC(=O)[C@H](N)C Amb2371905 [0,0,0,0,2,0|1,0,1]=4 798 B5R0.5 NC(=S)C(=S)N Amb1211951 [0,0,0,0,2,0|0,2,0]=4 799 B5R0.5 NC(=S)C(=S)N Amb16224790 [0,0,0,0,2,0|0,2,0]=4 800 B5R0.5 NC(O)C(N)=O Amb24478450 [0,0,0,0,2,0|0,0,2]=4 801 B5R0.5 N[C@@H](O)C(N)=O Amb25338621 [0,0,0,0,2,0|0,0,2]=4 802 B5R0.5 O=C([S-])C(=O)[S-] Amb22730472 [0,0,0,0,2,0|2,0,0]=4 803 B5R0.5 O=[13C](Cl)[13C](=O)Cl Amb22353781 [0,0,0,0,2,0|2,0,0]=4 804 B5R0.5 OC(=O)C(=O)O Amb10608980 [0,0,0,0,2,0|2,0,0]=4 805 B5R0.5 OC(=O)C(=O)O Amb19134307 [0,0,0,0,2,0|2,0,0]=4 806 B5R0.5 OC(=O)C(=O)S Amb25375340 [0,0,0,0,2,0|2,0,0]=4 807 B5R0.5 OC(=O)C(O)=O Amb19374136 [0,0,0,0,2,0|2,0,0]=4 808 B5R0.5 OC(=O)C(O)=O Amb22002537 [0,0,0,0,2,0|2,0,0]=4 809 B5R0.5 OC(=O)C(O)=O Amb22231343 [0,0,0,0,2,0|2,0,0]=4 810 B5R0.5 OC(=O)C(O)=O Amb22352057 [0,0,0,0,2,0|2,0,0]=4 811 B5R0.5 OC(=O)C(O)=O Amb22353291 [0,0,0,0,2,0|2,0,0]=4 812 B5R0.5 OC(=O)C(O)=O Amb22360650 [0,0,0,0,2,0|2,0,0]=4 813 B5R0.5 OC(=O)C(O)=O Amb22360667 [0,0,0,0,2,0|2,0,0]=4 814 B5R0.5 OC(=O)C(O)=O Amb22363275 [0,0,0,0,2,0|2,0,0]=4 815 B5R0.5 OC(=O)C(O)=O Amb22363302 [0,0,0,0,2,0|2,0,0]=4 816 B5R0.5 OC(=O)C(O)=O Amb22394874 [0,0,0,0,2,0|2,0,0]=4 817 B5R0.5 OC(=O)C(O)=O Amb22436461 [0,0,0,0,2,0|2,0,0]=4 818 B5R0.5 OC(=O)C(O)=O Amb22731645 [0,0,0,0,2,0|2,0,0]=4 819 B5R0.5 OC(=O)C(O)=O Amb22731888 [0,0,0,0,2,0|2,0,0]=4 820 B5R0.5 OC(=O)C(O)=O Amb22897045 [0,0,0,0,2,0|2,0,0]=4 821 B5R0.5 OC(=O)C(O)=O Amb23412252 [0,0,0,0,2,0|2,0,0]=4 822 B5R0.5 O[13C](=O)[13C](O)=O Amb22369747 [0,0,0,0,2,0|2,0,0]=4 823 B5R0.5 O[14C](=O)[14C](O)=O Amb22349945 [0,0,0,0,2,0|2,0,0]=4 824 B5R0.5 [13CH3]C(=O)C([O-])=O Amb22353396 [0,0,0,0,2,0|2,0,0]=4 825 B5R0.5 [O-]C(=O)C(O)=O Amb20246604 [0,0,0,0,2,0|2,0,0]=4 826 B5R0.5 [O-]C(=O)C(O)=O Amb22055985 [0,0,0,0,2,0|2,0,0]=4 827 B5R0.5 [O-]C(=O)C(O)=O Amb22167952 [0,0,0,0,2,0|2,0,0]=4 828 B5R0.5 [O-]C(=O)C(O)=O Amb22231328 [0,0,0,0,2,0|2,0,0]=4 829 B5R0.5 [O-]C(=O)C([O-])=O Amb17678768 [0,0,0,0,2,0|2,0,0]=4 830 B5R0.5 [O-]C(=O)C([O-])=O Amb17943075 [0,0,0,0,2,0|2,0,0]=4 831 B5R0.5 [O-]C(=O)C([O-])=O Amb17943080 [0,0,0,0,2,0|2,0,0]=4 832 B5R0.5 [O-]C(=O)C([O-])=O Amb19516140 [0,0,0,0,2,0|2,0,0]=4 833 B5R0.5 [O-]C(=O)C([O-])=O Amb20246439 [0,0,0,0,2,0|2,0,0]=4 834 B5R0.5 [O-]C(=O)C([O-])=O Amb20246440 [0,0,0,0,2,0|2,0,0]=4 835 B5R0.5 [O-]C(=O)C([O-])=O Amb20246449 [0,0,0,0,2,0|2,0,0]=4 836 B5R0.5 [O-]C(=O)C([O-])=O Amb20246450 [0,0,0,0,2,0|2,0,0]=4 837 B5R0.5 [O-]C(=O)C([O-])=O Amb20246484 [0,0,0,0,2,0|2,0,0]=4 838 B5R0.5 [O-]C(=O)C([O-])=O Amb20246489 [0,0,0,0,2,0|2,0,0]=4 839 B5R0.5 [O-]C(=O)C([O-])=O Amb21963194 [0,0,0,0,2,0|2,0,0]=4 840 B5R0.5 [O-]C(=O)C([O-])=O Amb22002099 [0,0,0,0,2,0|2,0,0]=4 841 B5R0.5 [O-]C(=O)C([O-])=O Amb22008847 [0,0,0,0,2,0|2,0,0]=4 842 B5R0.5 [O-]C(=O)C([O-])=O Amb22008848 [0,0,0,0,2,0|2,0,0]=4 843 B5R0.5 [O-]C(=O)C([O-])=O Amb22045372 [0,0,0,0,2,0|2,0,0]=4 844 B5R0.5 [O-]C(=O)C([O-])=O Amb22045383 [0,0,0,0,2,0|2,0,0]=4 845 B5R0.5 [O-]C(=O)C([O-])=O Amb22045394 [0,0,0,0,2,0|2,0,0]=4 846 B5R0.5 [O-]C(=O)C([O-])=O Amb22045421 [0,0,0,0,2,0|2,0,0]=4 847 B5R0.5 [O-]C(=O)C([O-])=O Amb22045450 [0,0,0,0,2,0|2,0,0]=4 848 B5R0.5 [O-]C(=O)C([O-])=O Amb22045454 [0,0,0,0,2,0|2,0,0]=4 849 B5R0.5 [O-]C(=O)C([O-])=O Amb22045456 [0,0,0,0,2,0|2,0,0]=4 850 B5R0.5 [O-]C(=O)C([O-])=O Amb22045460 [0,0,0,0,2,0|2,0,0]=4 851 B5R0.5 [O-]C(=O)C([O-])=O Amb22045466 [0,0,0,0,2,0|2,0,0]=4 852 B5R0.5 [O-]C(=O)C([O-])=O Amb22045574 [0,0,0,0,2,0|2,0,0]=4 853 B5R0.5 [O-]C(=O)C([O-])=O Amb22045860 [0,0,0,0,2,0|2,0,0]=4 854 B5R0.5 [O-]C(=O)C([O-])=O Amb22045877 [0,0,0,0,2,0|2,0,0]=4 855 B5R0.5 [O-]C(=O)C([O-])=O Amb22052446 [0,0,0,0,2,0|2,0,0]=4 856 B5R0.5 [O-]C(=O)C([O-])=O Amb22052448 [0,0,0,0,2,0|2,0,0]=4 857 B5R0.5 [O-]C(=O)C([O-])=O Amb22052474 [0,0,0,0,2,0|2,0,0]=4 858 B5R0.5 [O-]C(=O)C([O-])=O Amb22053405 [0,0,0,0,2,0|2,0,0]=4 859 B5R0.5 [O-]C(=O)C([O-])=O Amb22053543 [0,0,0,0,2,0|2,0,0]=4 860 B5R0.5 [O-]C(=O)C([O-])=O Amb22053546 [0,0,0,0,2,0|2,0,0]=4 861 B5R0.5 [O-]C(=O)C([O-])=O Amb22053547 [0,0,0,0,2,0|2,0,0]=4 862 B5R0.5 [O-]C(=O)C([O-])=O Amb22053562 [0,0,0,0,2,0|2,0,0]=4 863 B5R0.5 [O-]C(=O)C([O-])=O Amb22053601 [0,0,0,0,2,0|2,0,0]=4 864 B5R0.5 [O-]C(=O)C([O-])=O Amb22231460 [0,0,0,0,2,0|2,0,0]=4 865 B5R0.5 [O-]C(=O)C([O-])=O Amb22264699 [0,0,0,0,2,0|2,0,0]=4 866 B5R0.5 [O-]C(=O)C([O-])=O Amb22338348 [0,0,0,0,2,0|2,0,0]=4 867 B5R0.5 [O-]C(=O)C([O-])=O Amb22338401 [0,0,0,0,2,0|2,0,0]=4 868 B5R0.5 [O-]C(=O)C([O-])=O Amb22338445 [0,0,0,0,2,0|2,0,0]=4 869 B5R0.5 [O-]C(=O)C([O-])=O Amb22363119 [0,0,0,0,2,0|2,0,0]=4 870 B5R0.5 [O-]C(=O)C([O-])=O Amb22432231 [0,0,0,0,2,0|2,0,0]=4 871 B5R0.5 [O-]C(=O)C([O-])=O Amb22730020 [0,0,0,0,2,0|2,0,0]=4 872 B5R0.5 [O-]C(=O)C([O-])=O Amb22730044 [0,0,0,0,2,0|2,0,0]=4 873 B5R0.5 [O-]C(=O)C([O-])=O Amb22732203 [0,0,0,0,2,0|2,0,0]=4 874 B5R0.5 [O-]C(=O)C([O-])=O Amb22732260 [0,0,0,0,2,0|2,0,0]=4 875 B5R0.5 [O-]C(=O)C([O-])=O Amb22732351 [0,0,0,0,2,0|2,0,0]=4 876 B5R0.5 [O-]C(=O)C([O-])=O Amb22732671 [0,0,0,0,2,0|2,0,0]=4 877 B5R0.5 [O-]C(=O)C([O-])=O Amb22732891 [0,0,0,0,2,0|2,0,0]=4 878 B5R0.5 [O-]C(=O)C([O-])=O Amb22733764 [0,0,0,0,2,0|2,0,0]=4 879 B5R0.5 [O-]C(=O)C([O-])=O Amb22734003 [0,0,0,0,2,0|2,0,0]=4 880 B5R0.5 [O-][13C](=O)[13C]([O-])=O Amb22337921 [0,0,0,0,2,0|2,0,0]=4 881 B9R0.55 NC(=O)C=NN=CC(N)=O Amb25376938 [0,0,0,0,0,2|0,0,0]=2 882 B9R0.55 NC(=O)CCCNC(N)=O Amb24705966 [0,0,0,0,0,2|1,0,1]=4 883 B9R0.55 NC(=O)CC\C=C\C(N)=O Amb25111607 [0,0,0,0,0,2|2,0,0]=4 884 B9R0.55 NC(=O)COCCC(N)=O Amb25063003 [0,0,0,0,0,2|2,0,0]=4 885 B9R0.55 NC(=O)C\C=C\CC(N)=O Amb25856677 [0,0,0,0,0,2|2,0,0]=4 886 B9R0.55 NC(=O)NCCNC(=O)N Amb1146040 [0,0,0,0,0,2|0,0,2]=4 887 B9R0.55 NC(=O)N\C=C\NC(N)=O Amb25174416 [0,0,0,0,0,2|0,0,2]=4 888 B9R0.55 NC(=O)OCCNC(N)=O Amb25775544 [0,0,0,0,0,2|1,0,1]=4 889 B9R0.55 NC(=O)\C=C\C=C\C(N)=O Amb24736439 [0,0,0,0,0,2|2,0,0]=4 890 B9R0.55 NC(=O)\C=N\N=C\C(N)=O Amb25703514 [0,0,0,0,0,2|0,0,0]=2 891 B9R0.55 NC(=O)\C=N\OCC(N)=O Amb24479072 [0,0,0,0,0,2|1,0,0]=3