0 B4R0.1 C=CC(=O)O HY-W243303A [0,0,0,0,0,0|3,0,1]=4 1 B4R0.1 C=CC(=O)O HY-W243303C [0,0,0,0,0,0|3,0,1]=4 2 B4R0.1 C=CC(=O)O HY-W243303D [0,0,0,0,0,0|3,0,1]=4 3 B4R0.1 C=CC(=O)O HY-W243303E [0,0,0,0,0,0|3,0,1]=4 4 B4R0.1 C=CC(=O)O HY-W243303O [0,0,0,0,0,0|3,0,1]=4 5 B4R0.1 C=CC(N)=O HY-W115727 [0,0,0,0,0,0|3,0,1]=4 6 B4R0.1 C=CC(N)=O HY-W115727A [0,0,0,0,0,0|3,0,1]=4 7 B4R0.1 C=CC(N)=O HY-W115727B [0,0,0,0,0,0|3,0,1]=4 8 B4R0.1 CC(=O)C=O HY-W020014 [0,0,0,0,0,0|1,0,1]=2 9 B4R0.1 CC(=O)CO HY-Y1366 [0,0,0,0,0,0|1,0,3]=4 10 B4R0.1 CC(=O)NBr HY-131899 [0,0,0,0,0,0|3,0,1]=4 11 B4R0.1 CC(=O)NO HY-B1235 [0,0,0,0,0,0|2,0,2]=4 12 B4R0.1 CC(=O)O[K] HY-Y0319B [0,0,0,0,0,0|3,0,1]=4 13 B4R0.1 CC(=O)O[K] HY-Y0319B1 [0,0,0,0,0,0|3,0,1]=4 14 B4R0.1 CC(C)=NO HY-W008840 [0,0,0,0,0,0|1,0,2]=3 15 B4R0.1 CC(O)CN HY-W015969 [0,0,0,0,0,0|2,0,1]=3 16 B4R0.1 CC(O)CO HY-Y0921 [0,0,0,0,0,0|1,0,2]=3 17 B4R0.1 CC[C@@H](C)O HY-W087952 [0,0,0,0,0,0|2,0,1]=3 18 B4R0.1 C[C@@H](N)CO HY-W010646 [0,0,0,0,0,0|1,0,2]=3 19 B4R0.1 C[C@@H](O)CN HY-W002295 [0,0,0,0,0,0|2,0,1]=3 20 B4R0.1 C[C@@H](O)CO HY-Z0031 [0,0,0,0,0,0|1,0,2]=3 21 B4R0.1 O=BB(O)O HY-W129975 [0,0,0,0,0,0|4,0,0]=4 22 B4R0.1 O=CC(=O)O HY-79494 [0,0,0,0,0,0|2,0,1]=3 23 B4R0.1 O=C[Pb](=O)O HY-Y1877 [0,0,0,0,0,0|3,0,0]=3 24 B4R0.1 O=S=S(=O)=O HY-108775A [0,0,0,0,0,0|4,0,0]=4 25 B4R0.1 O=[AlH3][AlH3](O)O HY-Y0498 [0,0,0,0,0,0|4,0,0]=4 26 B3R0.1 C(=O)ON HY-Y0488A [1,0,0,0,0,0|2,0,0]=3 27 B3R0.1 CNNC HY-W460407 [1,0,0,0,0,0|3,0,0]=4 28 B3R0.1 CNOC HY-41074 [1,0,0,0,0,0|3,0,0]=4 29 B3R0.1 NCCO HY-W035903 [1,0,0,0,0,0|1,0,2]=4 30 B3R0.1 NCCS HY-77591 [1,0,0,0,0,0|1,1,1]=4 31 B3R0.1 O=[13CH]CO HY-146995S [1,0,0,0,0,0|1,0,0]=2 32 B3R0.1 OCCO HY-Y0338 [1,0,0,0,0,0|1,0,2]=4 33 B3R0.1 OCCO HY-Y0873A [1,0,0,0,0,0|1,0,2]=4 34 B3R0.1 OCCO HY-Y0873A1 [1,0,0,0,0,0|1,0,2]=4 35 B3R0.1 OCCO HY-Y0873B [1,0,0,0,0,0|1,0,2]=4 36 B3R0.1 OCCO HY-Y0873C [1,0,0,0,0,0|1,0,2]=4 37 B3R0.1 OCCO HY-Y0873E [1,0,0,0,0,0|1,0,2]=4 38 B3R0.1 OCCO HY-Y0873F [1,0,0,0,0,0|1,0,2]=4 39 B3R0.1 OCCO HY-Y0873G [1,0,0,0,0,0|1,0,2]=4 40 B3R0.1 OCCO HY-Y0873H [1,0,0,0,0,0|1,0,2]=4 41 B3R0.1 OCCO HY-Y0873I [1,0,0,0,0,0|1,0,2]=4 42 B3R0.1 OCCO HY-Y0873J [1,0,0,0,0,0|1,0,2]=4 43 B3R0.1 OCCO HY-Y0873K [1,0,0,0,0,0|1,0,2]=4 44 B3R0.1 OCCO HY-Y0873L [1,0,0,0,0,0|1,0,2]=4 45 B3R0.1 OCCO HY-Y0873M [1,0,0,0,0,0|1,0,2]=4 46 B3R0.1 OCCO HY-Y0873N [1,0,0,0,0,0|1,0,2]=4 47 B3R0.1 OCCO HY-Y0873O [1,0,0,0,0,0|1,0,2]=4 48 B3R0.1 OCCO HY-Y0873P [1,0,0,0,0,0|1,0,2]=4 49 B3R0.1 OCCO HY-Y0873Q [1,0,0,0,0,0|1,0,2]=4 50 B3R0.2 CB(O)O HY-34449 [1,0,0,0,0,0|2,0,1]=4 51 B3R0.2 CC(=O)O HY-13443A [1,0,0,0,0,0|1,0,1]=3 52 B3R0.2 CC(=O)O HY-75153 [1,0,0,0,0,0|1,0,1]=3 53 B3R0.2 CC(=O)O HY-P0052A [1,0,0,0,0,0|1,0,1]=3 54 B3R0.2 CC(=O)O HY-W094353 [1,0,0,0,0,0|1,0,1]=3 55 B3R0.2 CC(=O)O HY-Y0849C [1,0,0,0,0,0|1,0,1]=3 56 B3R0.2 CC(C)[O-] HY-133023 [1,0,0,0,0,0|0,0,1]=2 57 B3R0.2 CC(N)=O HY-Y0946 [1,0,0,0,0,0|1,0,1]=3 58 B3R0.2 CC(N)=S HY-Y0698 [1,0,0,0,0,0|1,1,1]=4 59 B3R0.2 CN(C)C HY-Y0504 [1,0,0,0,0,0|1,0,1]=3 60 B3R0.2 CN(C)C HY-Y0504R [1,0,0,0,0,0|1,0,1]=3 61 B3R0.2 CS(C)=O HY-Y0320R [1,0,0,0,0,0|1,0,0]=2 62 B3R0.2 C[13C](=O)O HY-W772341 [1,0,0,0,0,0|1,0,1]=3 63 B3R0.2 C[Cr](C)C HY-D1163 [1,0,0,0,0,0|1,0,1]=3 64 B3R0.2 NC(N)=O HY-Y0271 [1,0,0,0,0,0|2,0,1]=4 65 B3R0.2 NC(N)=O HY-Y0271R [1,0,0,0,0,0|2,0,1]=4 66 B3R0.2 N[13C](N)=O HY-118877 [1,0,0,0,0,0|2,0,1]=4 67 B3R0.2 O=[13C]([O-])O HY-Y0287AS [1,0,0,0,0,0|2,0,1]=4 68 B3R0.2 O=[N+]([O-])[Ag] HY-W034067 [1,0,0,0,0,0|3,0,0]=4 69 B3R0.2 O=[Si]([O-])[O-] HY-B2205 [1,0,0,0,0,0|2,1,0]=4 70 B3R0.2 [13CH3]N([13CH3])[13CH3] HY-W585905 [1,0,0,0,0,0|1,0,1]=3 71 B3R0.2 [15NH2]C([15NH2])=O HY-Y0271S [1,0,0,0,0,0|2,0,1]=4 72 B3R0.2 [15NH2][13C]([15NH2])=O HY-Y0271S2 [1,0,0,0,0,0|2,0,1]=4 73 B5R0.1 CC(C)=CC=O HY-34409 [0,1,0,0,0,0|0,0,1]=2 74 B5R0.1 CC(C)=CCO HY-W013035 [0,1,0,0,0,0|0,0,2]=3 75 B5R0.1 CC(N)CC#N HY-W018936 [0,1,0,0,0,0|2,0,1]=4 76 B5R0.1 CC(O)CCO HY-77490A [0,1,0,0,0,0|1,0,2]=4 77 B5R0.1 CN(C)CC=O HY-100061A [0,1,0,0,0,0|1,0,0]=2 78 B5R0.1 C[C@@H](O)CCO HY-77490 [0,1,0,0,0,0|1,0,2]=4 79 B5R0.3 CCC(C)C=O HY-W020678 [0,1,0,0,0,0|0,0,0]=1 80 B5R0.3 NCC(O)CO HY-W002040 [0,1,0,0,0,0|1,0,2]=4 81 B5R0.3 NC[C@@H](O)CCl HY-W108649 [0,1,0,0,0,0|2,0,1]=4 82 B5R0.3 O=CC(O)CO HY-128748 [0,1,0,0,0,0|1,0,0]=2 83 B5R0.3 O=C[C@@H](O)CO HY-W008504 [0,1,0,0,0,0|1,0,0]=2 84 B5R0.3 OC(CBr)CBr HY-W014092 [0,1,0,0,0,0|2,0,1]=4 85 B5R0.3 OCC(O)CO HY-B1659 [0,1,0,0,0,0|1,0,2]=4 86 B5R0.3 OCC(O)CO HY-B1659R [0,1,0,0,0,0|1,0,2]=4 87 B5R0.3 OCC(S)CS HY-B1285 [0,1,0,0,0,0|1,0,2]=4 88 B5R0.4 CC(C)(N)CO HY-W013027 [0,1,0,0,0,0|0,0,2]=3 89 B5R0.4 CC(C)(N)CO HY-W013027A [0,1,0,0,0,0|0,0,2]=3 90 B5R0.4 CC(C)(O)CN HY-33948 [0,1,0,0,0,0|1,0,1]=3 91 B5R0.4 CC[N+](C)(C)C HY-W101257 [0,1,0,0,0,0|2,0,1]=4 92 B5R0.4 CO[Si](C)(C)C HY-104035E [0,1,0,0,0,0|2,1,0]=4 93 B5R0.5 C=C(C)C(N)=O HY-W020027 [0,1,0,0,0,0|0,0,2]=3 94 B5R0.5 CC(=O)C(=O)O HY-Y0781 [0,1,0,0,0,0|1,0,1]=3 95 B5R0.5 CC(=O)C(=O)O HY-Y0781R [0,1,0,0,0,0|1,0,1]=3 96 B5R0.5 CC(=O)N(C)C HY-W042416 [0,1,0,0,0,0|1,0,0]=2 97 B5R0.5 CC(=O)[13C](=O)O HY-Y0781S1 [0,1,0,0,0,0|1,0,1]=3 98 B5R0.5 CC(N)C(=O)O HY-N2362 [0,1,0,0,0,0|1,0,0]=2 99 B5R0.5 CC(O)C(=O)O HY-B1530 [0,1,0,0,0,0|1,0,0]=2 100 B5R0.5 CC(O)C(=O)O HY-B2227 [0,1,0,0,0,0|1,0,0]=2 101 B5R0.5 CC(O)C(=O)O HY-B2227D [0,1,0,0,0,0|1,0,0]=2 102 B5R0.5 CC(O)C(=O)O HY-B2227R [0,1,0,0,0,0|1,0,0]=2 103 B5R0.5 CC(O)C(=O)O HY-W250313 [0,1,0,0,0,0|1,0,0]=2 104 B5R0.5 CC(O)C(=O)[O-] HY-B2227A [0,1,0,0,0,0|1,0,0]=2 105 B5R0.5 CC(O)C(=O)[O-] HY-B2227C [0,1,0,0,0,0|1,0,0]=2 106 B5R0.5 CC(O)C(C)O HY-128387 [0,1,0,0,0,0|1,0,2]=4 107 B5R0.5 CC(O)C(C)O HY-128387R [0,1,0,0,0,0|1,0,2]=4 108 B5R0.5 C[C@@H](O)[C@@H](C)O HY-W015954 [0,1,0,0,0,0|1,0,2]=4 109 B5R0.5 C[C@H](N)C(=O)O HY-N0229 [0,1,0,0,0,0|1,0,0]=2 110 B5R0.5 C[C@H](N)C(=O)O HY-N0229R [0,1,0,0,0,0|1,0,0]=2 111 B5R0.5 C[C@H](O)C(=O)O HY-Y0479 [0,1,0,0,0,0|1,0,0]=2 112 B5R0.5 NC(=O)C(=O)O HY-W013032 [0,1,0,0,0,0|2,0,1]=4 113 B5R0.5 NC(=O)C(Br)Br HY-133665 [0,1,0,0,0,0|2,0,0]=3 114 B5R0.5 O=C(O)C(=O)O HY-W041831 [0,1,0,0,0,0|2,0,1]=4 115 B5R0.5 O=C(O)C(=O)O HY-Y0262 [0,1,0,0,0,0|2,0,1]=4 116 B5R0.5 O=C(O)C(=O)O HY-Y0262A [0,1,0,0,0,0|2,0,1]=4 117 B5R0.5 O=C(O)C(=O)O HY-Y1297 [0,1,0,0,0,0|2,0,1]=4 118 B5R0.5 O=C(O)C(Br)Br HY-23399 [0,1,0,0,0,0|2,0,0]=3 119 B5R0.5 O=C(O)C(O)O HY-W019724 [0,1,0,0,0,0|2,0,0]=3 120 B5R0.5 [2H]C(=O)N([2H])[2H] HY-Y0842S1 [0,1,0,0,0,0|3,0,0]=4 121 B5R0.5 [2H]N(C)C(C)=O HY-W020018S1 [0,1,0,0,0,0|2,0,0]=3 122 B5R1.2 FC1CNC1 HY-W001606 [0,0,0,1,0,0|2,0,1]=4 123 B5R1.2 IC1COC1 HY-W016306 [0,0,0,1,0,0|1,0,2]=4 124 B5R1.2 OC1CCC1 HY-W013042 [0,0,0,1,0,0|2,0,1]=4 125 B5R1.2 OC1CNC1 HY-40144 [0,0,0,1,0,0|2,0,1]=4 126 B5R1.3 BrCC1CC1 HY-Y1100 [0,0,0,1,0,0|1,0,1]=3 127 B5R1.3 OCC1CO1 HY-Y1010 [0,0,0,1,0,0|1,0,2]=4 128 B2R0.1 C=CCl HY-W687022A [2,0,0,0,0,0|1,0,1]=4 129 B2R0.1 C=CO HY-Y0850 [2,0,0,0,0,0|0,0,2]=4 130 B2R0.1 C=CO HY-Y0850E [2,0,0,0,0,0|0,0,2]=4 131 B2R0.1 C=CO HY-Y0850H [2,0,0,0,0,0|0,0,2]=4 132 B2R0.1 C=CO HY-Y0850I [2,0,0,0,0,0|0,0,2]=4 133 B2R0.1 C=CO HY-Y0850J [2,0,0,0,0,0|0,0,2]=4 134 B2R0.1 C=CO HY-Y0850K [2,0,0,0,0,0|0,0,2]=4 135 B2R0.1 C=CO HY-Y0850N [2,0,0,0,0,0|0,0,2]=4 136 B2R0.1 C=CO HY-Y0850P [2,0,0,0,0,0|0,0,2]=4 137 B2R0.1 C=CO HY-Y0850U6 [2,0,0,0,0,0|0,0,2]=4 138 B2R0.1 CON HY-Y0958 [2,0,0,0,0,0|2,0,0]=4 139 B2R0.1 C[Cu]C HY-Y1102A [2,0,0,0,0,0|1,0,0]=3 140 B2R0.1 C[Pd]C HY-W002072 [2,0,0,0,0,0|1,0,0]=3 141 B2R0.1 C[Zn]C HY-B1817 [2,0,0,0,0,0|1,0,0]=3 142 B2R0.1 C[Zn]C HY-B1817A [2,0,0,0,0,0|1,0,0]=3 143 B2R0.1 NC=O HY-Y0842 [2,0,0,0,0,0|1,0,0]=3 144 B2R0.1 NC=O HY-Y0842B [2,0,0,0,0,0|1,0,0]=3 145 B2R0.1 O=[Ti]=O HY-W051271 [2,0,0,0,0,0|2,0,0]=4 146 B4R0.2 BrCCCBr HY-Y1806 [1,1,0,0,0,0|1,0,1]=4 147 B4R0.2 C#CCCO HY-W001947 [1,1,0,0,0,0|1,0,1]=4 148 B4R0.2 C=CCCN HY-W019321 [1,1,0,0,0,0|1,0,0]=3 149 B4R0.2 C=CCSC HY-128447 [1,1,0,0,0,0|1,0,0]=3 150 B4R0.2 CNCCO HY-Y1783 [1,1,0,0,0,0|0,0,2]=4 151 B4R0.2 COCCO HY-139415 [1,1,0,0,0,0|0,0,2]=4 152 B4R0.2 NCCCO HY-Y0139 [1,1,0,0,0,0|0,0,2]=4 153 B4R0.2 O=CCCO HY-N8461 [1,1,0,0,0,0|0,0,0]=2 154 B4R0.2 O=COO[K] HY-Y1220D [1,1,0,0,0,0|2,0,0]=4 155 B4R0.2 O=COO[K] HY-Y1220J [1,1,0,0,0,0|2,0,0]=4 156 B4R0.2 O=COO[Na] HY-ER013C [1,1,0,0,0,0|2,0,0]=4 157 B4R0.2 O=COO[Na] HY-W251598B [1,1,0,0,0,0|2,0,0]=4 158 B4R0.2 O=COO[Na] HY-W251598C [1,1,0,0,0,0|2,0,0]=4 159 B4R0.2 OCCCBr HY-W007337 [1,1,0,0,0,0|0,0,2]=4 160 B4R0.2 OCCCO HY-W017758 [1,1,0,0,0,0|0,0,2]=4 161 B4R0.2 OCCCS HY-W090210 [1,1,0,0,0,0|0,0,2]=4 162 B4R0.3 CN(C)(C)=O HY-116084 [1,1,0,0,0,0|1,0,0]=3 163 B4R0.3 CS(C)(=O)=O HY-Y1314 [1,1,0,0,0,0|1,0,0]=3 164 B4R0.3 CS(N)(=O)=O HY-Y0995 [1,1,0,0,0,0|2,0,0]=4 165 B4R0.3 C[N+](C)(C)C HY-W014861 [1,1,0,0,0,0|1,0,1]=4 166 B4R0.3 C[N+](C)(C)C HY-W040184 [1,1,0,0,0,0|1,0,1]=4 167 B4R0.3 C[N+](C)(C)C HY-W095635 [1,1,0,0,0,0|1,0,1]=4 168 B4R0.3 C[N+](C)(C)C HY-W127672 [1,1,0,0,0,0|1,0,1]=4 169 B4R0.3 C[N+](C)(C)C HY-W130431 [1,1,0,0,0,0|1,0,1]=4 170 B4R0.3 C[N+](C)(C)C HY-Y0658 [1,1,0,0,0,0|1,0,1]=4 171 B4R0.3 C[N+](C)(C)[O-] HY-108915 [1,1,0,0,0,0|1,0,1]=4 172 B4R0.3 C[Ti](C)(Cl)Cl HY-106782 [1,1,0,0,0,0|2,0,0]=4 173 B6R0.2 CC(=O)\C=C(\C)[O-] HY-W020952 [0,2,0,0,0,0|1,0,1]=4 174 B6R0.2 CC(C)CB(O)O HY-W000978 [0,2,0,0,0,0|0,0,2]=4 175 B6R0.2 CC(C)CC(=O)O HY-W012980 [0,2,0,0,0,0|0,0,0]=2 176 B6R0.2 CC(C)CC(N)=O HY-B1229 [0,2,0,0,0,0|0,0,0]=2 177 B6R0.2 CC(C)C[13C](=O)O HY-W012980S1 [0,2,0,0,0,0|0,0,0]=2 178 B6R0.2 CC(C)SC(=N)N HY-101304 [0,2,0,0,0,0|1,0,0]=3 179 B6R0.2 CC(N)CC(=O)O HY-W008833 [0,2,0,0,0,0|1,0,0]=3 180 B6R0.2 CC(O)CC(=O)O HY-113378 [0,2,0,0,0,0|1,0,0]=3 181 B6R0.2 CN(C)CC(=O)O HY-W001158 [0,2,0,0,0,0|1,0,0]=3 182 B6R0.2 CN(C)CC(=O)O HY-Y0511 [0,2,0,0,0,0|1,0,0]=3 183 B6R0.2 CN(C)CC(=O)O HY-Y0511R [0,2,0,0,0,0|1,0,0]=3 184 B6R0.2 C[C@@H](O)CC(=O)O HY-W051723 [0,2,0,0,0,0|1,0,0]=3 185 B6R0.2 C[C@H](N)CC(=O)O HY-W001210 [0,2,0,0,0,0|1,0,0]=3 186 B6R0.2 C[C@H](O)CC(=O)O HY-W050031 [0,2,0,0,0,0|1,0,0]=3 187 B6R0.3 C=C(C)C(=O)OC HY-W391506 [0,2,0,0,0,0|0,0,2]=4 188 B6R0.3 CC(=O)\C(C)=N\O HY-Y0413 [0,2,0,0,0,0|1,0,1]=4 189 B6R0.3 CC(C)[13C](=O)O[Na] HY-W021400S [0,2,0,0,0,0|0,0,0]=2 190 B6R0.3 CC(C)[C@H](N)CO HY-30167A [0,2,0,0,0,0|0,0,2]=4 191 B6R0.3 CC(CBr)C(=O)O HY-W015332 [0,2,0,0,0,0|0,0,0]=2 192 B6R0.3 CC(CN)C(=O)O HY-W012974 [0,2,0,0,0,0|0,0,0]=2 193 B6R0.3 CC(CN)C(=O)O HY-W012974R [0,2,0,0,0,0|0,0,0]=2 194 B6R0.3 CC(CO)C(=O)O HY-113126 [0,2,0,0,0,0|0,0,0]=2 195 B6R0.3 CC(O)C(=O)O[Na] HY-B2227B [0,2,0,0,0,0|1,0,0]=3 196 B6R0.3 CCC(=O)C(=O)O HY-W007926 [0,2,0,0,0,0|1,0,1]=4 197 B6R0.3 CCC(=O)C(=O)O HY-W007926R [0,2,0,0,0,0|1,0,1]=4 198 B6R0.3 CCC(=O)C(C)=O HY-W012998 [0,2,0,0,0,0|1,0,1]=4 199 B6R0.3 CCC(N)C(=O)O HY-W010590 [0,2,0,0,0,0|1,0,0]=3 200 B6R0.3 CCC(O)C(=O)O HY-113381 [0,2,0,0,0,0|1,0,0]=3 201 B6R0.3 CC[C@@H](N)C(=O)O HY-Y0127 [0,2,0,0,0,0|1,0,0]=3 202 B6R0.3 CC[C@H](N)C(N)=O HY-79491 [0,2,0,0,0,0|1,0,0]=3 203 B6R0.3 CC[C@H](O)C(=O)O HY-W018499 [0,2,0,0,0,0|1,0,0]=3 204 B6R0.3 COC(=O)C(C)N HY-W010324 [0,2,0,0,0,0|1,0,0]=3 205 B6R0.3 COC(=O)[C@H](C)N HY-I0519 [0,2,0,0,0,0|1,0,0]=3 206 B6R0.3 CON(C)C(C)=O HY-W001095 [0,2,0,0,0,0|1,0,0]=3 207 B6R0.3 C[C@@H](CN)C(=O)O HY-113380 [0,2,0,0,0,0|0,0,0]=2 208 B6R0.3 C[C@@H](CN)C(=O)O HY-W023323 [0,2,0,0,0,0|0,0,0]=2 209 B6R0.3 C[C@@H](O)C(=O)O[Na] HY-111095B [0,2,0,0,0,0|1,0,0]=3 210 B6R0.3 C[C@H](O)C(=O)O[Na] HY-W040233 [0,2,0,0,0,0|1,0,0]=3 211 B6R0.3 C[C@H](O)C(=O)O[Na] HY-W040233B [0,2,0,0,0,0|1,0,0]=3 212 B6R0.3 C[C@H](O)C(=O)O[Na] HY-W040233R [0,2,0,0,0,0|1,0,0]=3 213 B6R0.3 C\C=C(/C)C(=O)O HY-W012999 [0,2,0,0,0,0|0,0,1]=3 214 B6R0.3 NC(=O)[C@@H](N)CO HY-W008254 [0,2,0,0,0,0|1,0,0]=3 215 B6R0.3 NC(CO)C(=O)O HY-Y0507 [0,2,0,0,0,0|1,0,0]=3 216 B6R0.3 NC(CS)C(=O)O HY-W013651 [0,2,0,0,0,0|1,0,0]=3 217 B6R0.3 NC(CS)C(=O)O HY-W016716 [0,2,0,0,0,0|1,0,0]=3 218 B6R0.3 NCC(N)C(=O)O HY-W013674 [0,2,0,0,0,0|1,0,0]=3 219 B6R0.3 NC[C@@H](N)C(=O)O HY-W010312 [0,2,0,0,0,0|1,0,0]=3 220 B6R0.3 NC[C@H](N)C(=O)O HY-W013673 [0,2,0,0,0,0|1,0,0]=3 221 B6R0.3 N[13C@@H]([13CH2]O)[13C](=O)O HY-N0650S [0,2,0,0,0,0|1,0,0]=3 222 B6R0.3 N[C@@H](CCl)C(=O)O HY-107373 [0,2,0,0,0,0|1,0,0]=3 223 B6R0.3 N[C@@H](CO)C(=O)O HY-N0650 [0,2,0,0,0,0|1,0,0]=3 224 B6R0.3 N[C@@H](CO)C(=O)O HY-N0650R [0,2,0,0,0,0|1,0,0]=3 225 B6R0.3 N[C@@H](CO)[13C](=O)O HY-N0650S2 [0,2,0,0,0,0|1,0,0]=3 226 B6R0.3 N[C@@H](CS)C(=O)O HY-W016715 [0,2,0,0,0,0|1,0,0]=3 227 B6R0.3 N[C@@H](CS)C(=O)O HY-W016715R [0,2,0,0,0,0|1,0,0]=3 228 B6R0.3 N[C@@H](CS)C(=O)O HY-Y0337 [0,2,0,0,0,0|1,0,0]=3 229 B6R0.3 N[C@@H](CS)C(=O)O HY-Y0337A [0,2,0,0,0,0|1,0,0]=3 230 B6R0.3 N[C@@H](CS)C(=O)O HY-Y0337R [0,2,0,0,0,0|1,0,0]=3 231 B6R0.3 N[C@H](CCl)C(=O)O HY-W015457 [0,2,0,0,0,0|1,0,0]=3 232 B6R0.3 N[C@H](CO)C(=O)O HY-100808 [0,2,0,0,0,0|1,0,0]=3 233 B6R0.3 N[C@H](CS)C(=O)O HY-W002074 [0,2,0,0,0,0|1,0,0]=3 234 B6R0.3 N[C@H](CS)C(=O)O HY-W018555 [0,2,0,0,0,0|1,0,0]=3 235 B6R0.3 N[C@H](CS)C(=O)O HY-W055811 [0,2,0,0,0,0|1,0,0]=3 236 B6R0.3 O=C(CBr)C(Br)Br HY-133624 [0,2,0,0,0,0|2,0,0]=4 237 B6R0.3 O=C(O)C(=O)CBr HY-19992 [0,2,0,0,0,0|1,0,1]=4 238 B6R0.3 O=C(O)C(O)CO HY-W018035 [0,2,0,0,0,0|1,0,0]=3 239 B6R0.3 O=C(O[Na])C(Cl)Cl HY-Y0445A [0,2,0,0,0,0|2,0,0]=4 240 B6R0.3 [13CH3][C@H](O)C(=O)O[Na] HY-B2227BS3 [0,2,0,0,0,0|1,0,0]=3 241 B6R0.3 [C@@H](C)(NC)C(=O)O HY-W015926 [0,2,0,0,0,0|0,0,0]=2 242 B6R0.3 [C@H](C)(N)C(=O)OC HY-W007986 [0,2,0,0,0,0|1,0,0]=3 243 B6R0.3 [C@H](N)(CC)C(=O)O HY-W010589 [0,2,0,0,0,0|1,0,0]=3 244 B6R0.3 [C@H](O)(CN)C(=O)O HY-W012967 [0,2,0,0,0,0|1,0,0]=3 245 B6R0.3 [Li]OC(=O)C(C)O HY-W010625 [0,2,0,0,0,0|1,0,0]=3 246 B6R0.3 [Li]OC(=O)[C@H](C)O HY-D0884 [0,2,0,0,0,0|1,0,0]=3 247 B6R0.4 CC(C)CCCO HY-W007511 [0,2,0,0,0,0|0,0,2]=4 248 B6R0.5 C=CC[Si](C)(C)C HY-W019828 [0,2,0,0,0,0|1,1,0]=4 249 B6R0.5 CC(C)(C)CCO HY-W012977 [0,2,0,0,0,0|0,0,2]=4 250 B6R0.8 CC(N)(CO)CO HY-W017054 [0,2,0,0,0,0|0,0,2]=4 251 B6R0.9 CCN(CC)N=O HY-N7434 [0,2,0,0,0,0|2,0,0]=4 252 B6R0.7 CC(C)(C)S(N)=O HY-34480 [0,2,0,0,0,0|1,0,0]=3 253 B6R0.7 CC(C)(C)[S@@](N)=O HY-40229 [0,2,0,0,0,0|1,0,0]=3 254 B6R0.7 CC(C)(C)[S@](N)=O HY-40228 [0,2,0,0,0,0|1,0,0]=3 255 B6R0.7 CC(C)(N)C(=O)O HY-Y0124 [0,2,0,0,0,0|0,0,0]=2 256 B6R0.7 CC(C)(O)C(=O)O HY-W015924 [0,2,0,0,0,0|0,0,0]=2 257 B6R0.7 O=C(O)C(F)(F)F HY-W105853 [0,2,0,0,0,0|2,0,0]=4 258 B6R0.7 O=C([O-])C(F)(F)F HY-W007333 [0,2,0,0,0,0|2,0,0]=4 259 B6R0.7 [2H]C([2H])(O)C(=O)O HY-W015967S [0,2,0,0,0,0|2,0,0]=4 260 B6R0.7 [2H]C([2H])([2H])C(N)=O HY-W243217 [0,2,0,0,0,0|2,0,0]=4 261 B6R0.7 [2H][C@@]([13CH3])(N)C(=O)O HY-N0229S4 [0,2,0,0,0,0|1,0,0]=3 262 B4R1.1 C1CNC1 HY-W010628 [1,0,0,1,0,0|1,0,1]=4 263 B6R1.10 CC1(O)CNC1 HY-59333 [0,1,0,1,0,0|1,0,1]=4 264 B6R1.11 NC(=O)C1CO1 HY-119329 [0,1,0,1,0,0|1,0,0]=3 265 B6R1.11 O=C(O)C1CC1 HY-Y0001 [0,1,0,1,0,0|0,0,0]=2 266 B6R1.11 OB(O)C1CC1 HY-59219 [0,1,0,1,0,0|1,0,1]=4 267 B6R1.6 OCC1CNC1 HY-21336 [0,1,0,1,0,0|0,0,2]=4 268 B6R1.6 OCC1COC1 HY-W004925 [0,1,0,1,0,0|0,0,2]=4