0 B7R0.6 CC(=O)OCC(C)C SC-25600 [0,0,0,0,0,0|2,0,1]=3 1 B7R0.6 CC(=O)\C=C\C(=O)O SC-94119 [0,0,0,0,0,0|1,0,1]=2 2 B7R0.6 CC(=O)\C=C\N(C)C SC-92543 [0,0,0,0,0,0|2,0,0]=2 3 B7R0.6 CC(C)CCC(=O)O SC-57917 [0,0,0,0,0,0|0,0,2]=2 4 B7R0.6 CC(C)CC[N+](=O)[O-] SC-93989 [0,0,0,0,0,0|1,0,3]=4 5 B7R0.6 CC(C)CNC(N)=S SC-88305 [0,0,0,0,0,0|2,1,1]=4 6 B7R0.6 CC(C)OCC(=O)O SC-88240 [0,0,0,0,0,0|1,0,1]=2 7 B7R0.6 CC(Cl)CCC(=O)Cl SC-74180 [0,0,0,0,0,0|2,0,2]=4 8 B7R0.6 CN(C)CCC(=O)O SC-84721 [0,0,0,0,0,0|1,0,2]=3 9 B7R0.6 CN(C)CCC(=O)O SC-98010 [0,0,0,0,0,0|1,0,2]=3 10 B7R0.6 CN(C)CCC(N)=O SC-89196 [0,0,0,0,0,0|2,0,2]=4 11 B7R0.6 CN(C)\C=C\[N+](=O)[O-] SC-16745 [0,0,0,0,0,0|2,0,1]=3 12 B7R0.6 C[C@@H](O)COC(=O)O SC-01561 [0,0,0,0,0,0|2,0,1]=3 13 B6R0.4 CCCCC(=O)Cl SC-46867 [1,0,0,0,0,0|1,0,2]=4 14 B6R0.4 CC\C=C\C(=O)O SC-92876 [1,0,0,0,0,0|0,0,0]=1 15 B6R0.4 CN(C)CCC=O SC-12823 [1,0,0,0,0,0|1,0,2]=4 16 B6R0.4 CN(C)\C=C\C#N SC-53543 [1,0,0,0,0,0|2,0,1]=4 17 B6R0.4 CNCCC(=O)O SC-27492 [1,0,0,0,0,0|1,0,2]=4 18 B6R0.4 CNCCC(=O)O SC-52914 [1,0,0,0,0,0|1,0,2]=4 19 B6R0.4 COCCC(=O)O SC-50255 [1,0,0,0,0,0|1,0,2]=4 20 B6R0.4 CO\C=C\C(C)=O SC-71024 [1,0,0,0,0,0|2,0,0]=3 21 B6R0.4 CSCCC(=O)O SC-96567 [1,0,0,0,0,0|1,0,2]=4 22 B6R0.4 NCCCC(=O)O SC-10045 [1,0,0,0,0,0|1,0,2]=4 23 B6R0.4 O=C(O)C#CCO SC-89192 [1,0,0,0,0,0|1,0,2]=4 24 B6R0.4 O=C(O)CCCCl SC-89723 [1,0,0,0,0,0|1,0,2]=4 25 B6R0.4 O=C(O)\C=C\CBr SC-53654 [1,0,0,0,0,0|1,0,0]=2 26 B8R0.9 COC(=O)\C=C\C(=O)[O-] SC-65689 [0,1,0,0,0,0|1,0,2]=4 27 B8R0.23 C=C(CC(C)C)C(C)=O SC-A2921 [0,1,0,0,0,0|1,0,1]=3 28 B8R0.23 C=C(NC(C)=O)C(=O)O SC-48847 [0,1,0,0,0,0|2,0,1]=4 29 B8R0.23 CC(C)CC(Br)C(=O)O SC-A4035 [0,1,0,0,0,0|0,0,2]=3 30 B8R0.23 CC(C)CC(N)C(=O)O SC-09638 [0,1,0,0,0,0|0,0,2]=3 31 B8R0.23 CC(C)CC(N)C(=O)O SC-09639 [0,1,0,0,0,0|0,0,2]=3 32 B8R0.23 CC(C)C[C@@H](N)C(=O)O SC-09637 [0,1,0,0,0,0|0,0,2]=3 33 B8R0.23 CC(C)C[C@@H](O)C(=O)O SC-13459 [0,1,0,0,0,0|0,0,2]=3 34 B8R0.23 CC(C)C[C@H](N)C(N)=O SC-09656 [0,1,0,0,0,0|1,0,2]=4 35 B8R0.29 CC(C)(C)NCC(=O)O SC-82899 [0,1,0,0,0,0|1,0,1]=3 36 B8R0.29 CC(C)(C)OCC(=O)O SC-46034 [0,1,0,0,0,0|1,0,1]=3 37 B8R0.29 C[Si](C)(C)C#CC(=O)O SC-71681 [0,1,0,0,0,0|0,1,2]=4 38 B8R1.3 CC1=CC=C(O)N=N1 SC-21006 [0,0,0,1,0,0|2,0,1]=4 39 B8R1.3 CC1=CCC(=O)CC1 SC-25236 [0,0,0,1,0,0|1,0,2]=4 40 B8R1.3 CC1=CCC(=O)CC1 SC-83877 [0,0,0,1,0,0|1,0,2]=4 41 B8R1.3 CC1=CN=C(O)C=C1 SC-13580 [0,0,0,1,0,0|1,0,2]=4 42 B8R1.3 CC1=CN=C(O)C=C1 SC-90448 [0,0,0,1,0,0|1,0,2]=4 43 B8R1.3 CC1=NC=C(O)C=C1 SC-00370 [0,0,0,1,0,0|2,0,1]=4 44 B8R1.23 CC1CC(C(=O)O)C1 SC-73078 [0,0,0,1,0,0|0,0,2]=3 45 B8R1.23 CN1CC(C(=O)O)C1 SC-49053 [0,0,0,1,0,0|1,0,2]=4 46 B8R1.23 O=C(O)C1CC(F)C1 SC-26589 [0,0,0,1,0,0|1,0,2]=4 47 B8R1.35 O=C(O)CCC1CC1 SC-31428 [0,0,0,1,0,0|0,0,2]=3 48 B8R1.51 CC1(C)C=CC(=O)C1 SC-91103 [0,0,0,1,0,0|1,0,0]=2 49 B8R1.51 CC1(C)CCC(=O)O1 SC-21203 [0,0,0,1,0,0|0,0,2]=3 50 B8R1.51 CC1(C)CNC(=O)C1 SC-70558 [0,0,0,1,0,0|2,0,1]=4 51 B6R0.2 CC(=O)NC(C)C SC-A3057 [0,0,0,0,1,0|2,0,0]=3 52 B6R0.2 CC(=O)OC(C)C SC-25616 [0,0,0,0,1,0|2,0,0]=3 53 B6R0.2 CC(=O)\C=C(\C)N SC-89382 [0,0,0,0,1,0|2,0,1]=4 54 B6R0.2 CC(=O)\C=C(\C)O SC-20333 [0,0,0,0,1,0|2,0,1]=4 55 B6R0.2 CC(=O)\C=C(\C)O SC-67757 [0,0,0,0,1,0|2,0,1]=4 56 B6R0.2 CC(=O)\C=C(\C)[O-] SC-19412 [0,0,0,0,1,0|2,0,1]=4 57 B6R0.2 CC(C)=CC(=O)Cl SC-17934 [0,0,0,0,1,0|1,0,1]=3 58 B6R0.2 CC(C)=CC(=O)O SC-16257 [0,0,0,0,1,0|0,0,1]=2 59 B6R0.2 CC(C)CB(O)O SC-06923 [0,0,0,0,1,0|1,0,2]=4 60 B6R0.2 CC(Cl)OC(=O)Cl SC-13624 [0,0,0,0,1,0|3,0,0]=4 61 B6R0.2 CN(C)CC(N)=O SC-89197 [0,0,0,0,1,0|2,0,1]=4 62 B6R0.2 C[C@@H](N)CC(=O)O SC-10059 [0,0,0,0,1,0|1,0,1]=3 63 B6R0.2 C[C@@H](N)CC(=O)O SC-44142 [0,0,0,0,1,0|1,0,1]=3 64 B6R0.2 C[C@H](N)CC(=O)O SC-21979 [0,0,0,0,1,0|1,0,1]=3 65 B6R0.2 C[C@H](O)CC(=O)O SC-B3327 [0,0,0,0,1,0|1,0,1]=3 66 B6R0.2 C[S+](C)CC(=O)[O-] SC-72907 [0,0,0,0,1,0|1,0,2]=4 67 B8R0.28 CC(C)C\C=C\C(=O)O SC-96534 [0,0,0,0,0,1|0,0,0]=1 68 B8R0.28 CN(C)C\C=C\C(=O)O SC-20214 [0,0,0,0,0,1|1,0,0]=2 69 B8R0.28 CN(C)C\C=C\C(=O)O SC-82699 [0,0,0,0,0,1|1,0,0]=2 70 B8R0.28 O=C(O)\C=C\CC(=O)O SC-37894 [0,0,0,0,0,1|2,0,1]=4 71 B5R0.1 C=CCC(=O)O SC-49093 [2,0,0,0,0,0|0,0,2]=4 72 B5R0.1 CC#CC(=O)O SC-76460 [2,0,0,0,0,0|0,0,2]=4 73 B5R0.1 CC(C)=CC=O SC-00290 [2,0,0,0,0,0|0,0,1]=3 74 B5R0.1 CC(C)=CCO SC-77150 [2,0,0,0,0,0|0,0,2]=4 75 B5R0.1 CCCC(=O)Cl SC-18924 [2,0,0,0,0,0|1,0,1]=4 76 B5R0.1 CCCC(=O)[O-] SC-15718 [2,0,0,0,0,0|0,0,2]=4 77 B5R0.1 CCCC(N)=O SC-46377 [2,0,0,0,0,0|1,0,1]=4 78 B5R0.1 CCOC(N)=O SC-16133 [2,0,0,0,0,0|2,0,0]=4 79 B5R0.1 CN(C)CC=O SC-51643 [2,0,0,0,0,0|1,0,1]=4 80 B5R0.1 CNCC(=O)O SC-10425 [2,0,0,0,0,0|1,0,1]=4 81 B5R0.1 C\C=C/C(=O)O SC-25924 [2,0,0,0,0,0|0,0,0]=2 82 B5R0.1 C\C=C/C(C)=O SC-48085 [2,0,0,0,0,0|1,0,0]=3 83 B5R0.1 C\C=C\B(O)O SC-15014 [2,0,0,0,0,0|1,0,1]=4 84 B5R0.1 C\C=C\C(=O)Cl SC-16256 [2,0,0,0,0,0|1,0,0]=3 85 B5R0.1 NCCC(=O)O SC-10014 [2,0,0,0,0,0|1,0,1]=4 86 B5R0.1 O=C(O)CCBr SC-18441 [2,0,0,0,0,0|1,0,1]=4 87 B5R0.1 O=C(O)CCS SC-22642 [2,0,0,0,0,0|1,0,1]=4 88 B5R0.2 C\C=C\OCC SC-89361 [2,0,0,0,0,0|2,0,0]=4 89 B5R0.2 OC\C=C/CO SC-27134 [2,0,0,0,0,0|1,0,1]=4 90 B5R0.2 OC\C=C\CBr SC-36162 [2,0,0,0,0,0|1,0,1]=4 91 B5R0.2 OC\C=C\CO SC-82263 [2,0,0,0,0,0|1,0,1]=4 92 B7R0.2 C=CC(=O)NC(C)C SC-47047 [1,1,0,0,0,0|2,0,0]=4 93 B7R0.2 CCC(C)CC(=O)O SC-19132 [1,1,0,0,0,0|0,0,2]=4 94 B7R0.2 CCC(N)CC(=O)O SC-59260 [1,1,0,0,0,0|0,0,2]=4 95 B7R0.2 COC(=O)CC(=O)O SC-21351 [1,1,0,0,0,0|1,0,1]=4 96 B7R0.2 C\C(C=O)=C/N(C)C SC-93331 [1,1,0,0,0,0|1,0,0]=3 97 B7R0.3 COC(=O)\C=C\CBr SC-17676 [1,1,0,0,0,0|1,0,0]=3 98 B7R0.3 COC(=O)\C=C\CBr SC-49570 [1,1,0,0,0,0|1,0,0]=3 99 B7R0.3 CO\C=C\C(=O)OC SC-90792 [1,1,0,0,0,0|1,0,0]=3 100 B7R0.4 CCCC#CC(=O)O SC-96568 [1,1,0,0,0,0|0,0,2]=4 101 B7R0.4 CCCNCC(=O)O SC-97541 [1,1,0,0,0,0|0,0,2]=4 102 B7R0.4 CCCSCC(=O)O SC-45283 [1,1,0,0,0,0|0,0,2]=4 103 B7R0.4 CCC\C=C\C(C)=O SC-49007 [1,1,0,0,0,0|1,0,0]=3 104 B7R0.4 CCO\C=C\C(=O)Cl SC-50076 [1,1,0,0,0,0|1,0,0]=3 105 B7R0.4 CCO\C=C\C(=O)O SC-89061 [1,1,0,0,0,0|0,0,0]=2 106 B7R0.4 CNCCCC(=O)O SC-49793 [1,1,0,0,0,0|0,0,2]=4 107 B7R0.4 CNCCCC(=O)O SC-A2900 [1,1,0,0,0,0|0,0,2]=4 108 B7R0.4 COCCCC(=O)O SC-51378 [1,1,0,0,0,0|0,0,2]=4 109 B7R0.4 C\C=C\CCC(=O)O SC-21245 [1,1,0,0,0,0|0,0,2]=4 110 B7R0.4 NCCCCC(=O)O SC-10120 [1,1,0,0,0,0|0,0,2]=4 111 B7R0.4 NCCCCC(=O)O SC-92391 [1,1,0,0,0,0|0,0,2]=4 112 B7R0.4 NCCNCC(=O)O SC-21750 [1,1,0,0,0,0|1,0,1]=4 113 B7R0.4 O=C(O)CCCCBr SC-02338 [1,1,0,0,0,0|0,0,2]=4 114 B7R0.5 CCCC(Br)C(=O)O SC-27020 [1,1,0,0,0,0|0,0,2]=4 115 B7R0.5 CCC[C@H](N)C(=O)O SC-06139 [1,1,0,0,0,0|0,0,2]=4 116 B7R0.5 CCOC(=O)C(=O)Cl SC-26882 [1,1,0,0,0,0|2,0,0]=4 117 B7R0.5 CCOC(=O)C(=O)O SC-26569 [1,1,0,0,0,0|1,0,0]=3 118 B7R0.5 CCOC(=O)C(=O)[O-] SC-73549 [1,1,0,0,0,0|1,0,1]=4 119 B7R0.5 CCOC(=O)C(C)=O SC-15232 [1,1,0,0,0,0|2,0,0]=4 120 B7R0.8 C[Si](C)(C)\C=C\CO SC-86258 [1,1,0,0,0,0|0,1,1]=4 121 B7R0.9 CC(=O)CC(C)(C)S SC-82919 [0,1,0,0,1,0|1,0,1]=4 122 B7R0.9 CC(=O)OC(C)(C)C SC-22684 [0,1,0,0,1,0|2,0,0]=4 123 B7R0.9 CC(C)(C)OC(N)=O SC-44399 [0,1,0,0,1,0|2,0,0]=4 124 B7R0.9 CC(C)(N)CC(=O)O SC-43668 [0,1,0,0,1,0|0,0,1]=3 125 B7R0.9 CC(C)(O)CC(=O)[O-] SC-17999 [0,1,0,0,1,0|0,0,2]=4 126 B7R0.16 CC(C)C(=O)C(=O)O SC-27422 [0,1,0,0,1,0|0,0,0]=2 127 B7R0.16 CC(C)C(=O)C(=O)[O-] SC-13686 [0,1,0,0,1,0|0,0,1]=3 128 B7R0.16 CC(C)C(Br)C(=O)O SC-26681 [0,1,0,0,1,0|0,0,1]=3 129 B7R0.16 CC(C)C(N)C(=O)O SC-09983 [0,1,0,0,1,0|0,0,1]=3 130 B7R0.16 CC(C)C(N)C(=O)O SC-09984 [0,1,0,0,1,0|0,0,1]=3 131 B7R0.16 CC(C)C(N)C(=O)O SC-09985 [0,1,0,0,1,0|0,0,1]=3 132 B7R0.16 CC(C)C(O)C(=O)O SC-A2103 [0,1,0,0,1,0|0,0,1]=3 133 B7R0.16 CC(C)[C@@H](O)C(=O)O SC-01716 [0,1,0,0,1,0|0,0,1]=3 134 B7R0.16 CC(C)[C@H](N)C(N)=O SC-19666 [0,1,0,0,1,0|1,0,1]=4 135 B7R0.16 CC(O)C(N)C(=O)O SC-09869 [0,1,0,0,1,0|1,0,1]=4 136 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O SC-09868 [0,1,0,0,1,0|1,0,1]=4 137 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O SC-09866 [0,1,0,0,1,0|1,0,1]=4 138 B7R0.16 C[C@H](O)C(N)C(=O)O SC-46538 [0,1,0,0,1,0|1,0,1]=4 139 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O SC-09865 [0,1,0,0,1,0|1,0,1]=4 140 B9R0.7 CC(C)=CCC(N)C(=O)O SC-22867 [0,1,0,0,0,1|0,0,2]=4 141 B9R0.7 CC(C)CC[C@H](N)C(=O)O SC-93270 [0,1,0,0,0,1|0,0,2]=4 142 B9R0.7 CC(Cl)C(=O)NCC(=O)O SC-73815 [0,1,0,0,0,1|1,0,1]=4 143 B9R0.7 CC(S)C(=O)NCC(=O)O SC-26620 [0,1,0,0,0,1|1,0,1]=4 144 B9R0.53 CC(=O)CC(=O)OC(C)C SC-18510 [0,1,0,0,0,1|1,0,1]=4 145 B9R0.53 CC(C)C[C@H](N)CC(=O)O SC-26176 [0,1,0,0,0,1|0,0,2]=4 146 B9R0.21 COC(=O)\C=C\C(F)(F)F SC-90120 [0,2,0,0,0,0|2,0,0]=4 147 B9R0.42 COC(=O)CC(=O)C(C)C SC-27474 [0,2,0,0,0,0|0,0,1]=3 148 B9R0.48 CCOC(=O)\C=C\C(=O)O SC-17455 [0,2,0,0,0,0|1,0,1]=4 149 B9R0.48 CCOC(=O)\C=C\N(C)C SC-71571 [0,2,0,0,0,0|1,0,0]=3 150 B9R0.39 CC(=O)\C(C#N)=C\N(C)C SC-34249 [0,2,0,0,0,0|2,0,0]=4 151 B9R0.39 CN[C@@H](CC(C)C)C(=O)O SC-82208 [0,2,0,0,0,0|0,0,2]=4 152 B9R0.57 CC(C)(C)CC(N)C(=O)O SC-20148 [0,2,0,0,0,0|0,0,2]=4 153 B9R0.57 CC(C)(C)CC(N)C(=O)O SC-70362 [0,2,0,0,0,0|0,0,2]=4 154 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O SC-52818 [0,2,0,0,0,0|0,0,2]=4 155 B9R0.79 CC(C)C(O)C(N)C(=O)O SC-48909 [0,2,0,0,0,0|0,0,2]=4 156 B7R1.2 CC1=CC=C(Br)O1 SC-66940 [1,0,0,1,0,0|1,0,1]=4 157 B7R1.2 CC1CCC(=O)C1 SC-93748 [1,0,0,1,0,0|0,0,2]=4 158 B7R1.2 CC1CNC(=O)C1 SC-50248 [1,0,0,1,0,0|1,0,1]=4 159 B7R1.2 CC1COC(=O)C1 SC-60836 [1,0,0,1,0,0|1,0,1]=4 160 B7R1.2 CC1COC(=O)O1 SC-65189 [1,0,0,1,0,0|1,0,1]=4 161 B7R1.2 CN1C=CC(=O)N1 SC-98976 [1,0,0,1,0,0|2,0,0]=4 162 B7R1.2 C[C@H]1COC(=O)O1 SC-04943 [1,0,0,1,0,0|1,0,1]=4 163 B7R1.3 O=C1C=CCCN1 SC-25185 [1,0,0,1,0,0|1,0,0]=3 164 B7R1.3 O=C1C=CCCO1 SC-50374 [1,0,0,1,0,0|0,0,0]=2 165 B7R1.3 O=C1CCCCO1 SC-65111 [1,0,0,1,0,0|0,0,2]=4 166 B7R1.3 O=C1CNCCO1 SC-84883 [1,0,0,1,0,0|1,0,1]=4 167 B7R1.7 CC\C=C\[C@H]1CO1 SC-A2838 [1,0,0,1,0,0|1,0,1]=4 168 B7R1.18 O=C(O)C1CCC1 SC-17776 [1,0,0,1,0,0|0,0,2]=4 169 B7R1.18 O=C(O)C1CCO1 SC-22549 [1,0,0,1,0,0|1,0,1]=4 170 B7R1.18 O=C(O)[C@H]1CCN1 SC-24616 [1,0,0,1,0,0|1,0,1]=4 171 B7R1.20 O=C(O)CC1CC1 SC-13938 [1,0,0,1,0,0|0,0,2]=4 172 B9R1.35 CC(C)C1=CSC(N)=N1 SC-01191 [0,0,0,1,0,1|2,0,0]=4 173 B9R1.35 CC1=CC=C(C(=O)O)N1 SC-94836 [0,0,0,1,0,1|1,0,1]=4 174 B9R1.35 CC1=CC=C(C(=O)O)O1 SC-20513 [0,0,0,1,0,1|1,0,1]=4 175 B9R1.35 CC1=CNC(C(=O)O)=C1 SC-36204 [0,0,0,1,0,1|0,0,2]=4 176 B9R1.35 CC1=CSC(C(=O)O)=C1 SC-01072 [0,0,0,1,0,1|0,0,2]=4 177 B9R1.35 CC1=NC(C(=O)O)=CN1 SC-48423 [0,0,0,1,0,1|1,0,1]=4 178 B9R1.35 CC1=NC(C(=O)O)=CO1 SC-30359 [0,0,0,1,0,1|1,0,1]=4 179 B9R1.35 CC1=NC(C(=O)O)=CO1 SC-66016 [0,0,0,1,0,1|1,0,1]=4 180 B9R1.35 CC1=NC(C(=O)O)=CS1 SC-27449 [0,0,0,1,0,1|1,0,1]=4 181 B9R1.35 CC1=NC=C(C(=O)O)O1 SC-43630 [0,0,0,1,0,1|1,0,1]=4 182 B9R1.35 CC1=NC=C(C(=O)O)S1 SC-31817 [0,0,0,1,0,1|1,0,1]=4 183 B9R1.35 CN1C=C(C(=O)O)C=N1 SC-52446 [0,0,0,1,0,1|1,0,1]=4 184 B9R1.35 CN1C=CC(C(=O)O)=N1 SC-48405 [0,0,0,1,0,1|2,0,0]=4 185 B9R1.35 CN1C=NC(C(=O)O)=C1 SC-04384 [0,0,0,1,0,1|1,0,1]=4 186 B9R1.35 N[C@H]1C=C[C@@H](C(=O)O)C1 SC-95196 [0,0,0,1,0,1|1,0,0]=3 187 B9R1.10 CC1(C)C=CC(=O)CC1 SC-25845 [0,1,0,1,0,0|1,0,0]=3 188 B9R1.69 CC1=C(C)NC(=O)C=C1 SC-A4851 [0,1,0,1,0,0|1,0,1]=4 189 B9R1.84 O=C(O)CCC1CCC1 SC-30968 [0,1,0,1,0,0|0,0,2]=4 190 B9R1.84 O=C(O)CNC1CCC1 SC-53570 [0,1,0,1,0,0|1,0,1]=4 191 B9R1.95 COC1CC(C(=O)O)C1 SC-21516 [0,1,0,1,0,0|0,0,2]=4 192 B9R1.138 CC1(C)COC(=O)C1O SC-18425 [0,1,0,1,0,0|1,0,1]=4 193 B9R1.112 C[C@H](NC1CC1)C(=O)O SC-11116 [0,1,0,1,0,0|1,0,1]=4 194 B9R1.112 NC(CC1CC1)C(=O)O SC-60891 [0,1,0,1,0,0|0,0,2]=4 195 B9R1.137 NC(CC(=O)O)C1CC1 SC-89968 [0,1,0,1,0,0|0,0,2]=4 196 B5R0.5 CC(=O)C(=O)O SC-17382 [0,0,0,0,2,0|1,0,1]=4 197 B5R0.5 CC(=O)C(C)C SC-18478 [0,0,0,0,2,0|1,0,0]=3 198 B5R0.5 CC(=O)C(C)Cl SC-46981 [0,0,0,0,2,0|2,0,0]=4 199 B5R0.5 CC(=O)C(C)S SC-17208 [0,0,0,0,2,0|2,0,0]=4 200 B5R0.5 CC(=O)N(C)C SC-54108 [0,0,0,0,2,0|2,0,0]=4 201 B5R0.5 CC(Br)C(N)=O SC-97497 [0,0,0,0,2,0|2,0,0]=4 202 B5R0.5 CC(C)B(O)O SC-66620 [0,0,0,0,2,0|1,0,1]=4 203 B5R0.5 CC(C)C(=N)N SC-13079 [0,0,0,0,2,0|2,0,0]=4 204 B5R0.5 CC(F)C(=O)O SC-83429 [0,0,0,0,2,0|1,0,0]=3 205 B5R0.5 CC(N)C(=O)O SC-09271 [0,0,0,0,2,0|1,0,0]=3 206 B5R0.5 CC(N)C(N)=O SC-94219 [0,0,0,0,2,0|2,0,0]=4 207 B5R0.5 CC(O)C(=O)[O-] SC-19308 [0,0,0,0,2,0|1,0,1]=4 208 B5R0.5 CC(O)C(=O)[O-] SC-25623 [0,0,0,0,2,0|1,0,1]=4 209 B5R0.5 CC(O)C(=O)[O-] SC-75139 [0,0,0,0,2,0|1,0,1]=4 210 B5R0.5 CC(S)C(=O)O SC-74563 [0,0,0,0,2,0|1,0,0]=3 211 B5R0.5 CN(C)C(=O)Cl SC-15201 [0,0,0,0,2,0|2,0,0]=4 212 B5R0.5 C[C@@H](Br)C(=O)O SC-08843 [0,0,0,0,2,0|1,0,0]=3 213 B5R0.5 C[C@@H](Cl)C(=O)O SC-06610 [0,0,0,0,2,0|1,0,0]=3 214 B5R0.5 C[C@@H](N)C(=O)O SC-09270 [0,0,0,0,2,0|1,0,0]=3 215 B5R0.5 C[C@@H](N)C(N)=O SC-09289 [0,0,0,0,2,0|2,0,0]=4 216 B5R0.5 C[C@@H](O)C(N)=O SC-92873 [0,0,0,0,2,0|2,0,0]=4 217 B5R0.5 C[C@H](Cl)C(=O)O SC-03218 [0,0,0,0,2,0|1,0,0]=3 218 B5R0.5 C[C@H](N)C(=O)O SC-09272 [0,0,0,0,2,0|1,0,0]=3 219 B5R0.5 C[C@H](N)C(N)=O SC-03542 [0,0,0,0,2,0|2,0,0]=4 220 B5R0.5 C[C@H](O)C(N)=O SC-73228 [0,0,0,0,2,0|2,0,0]=4 221 B5R0.5 O=C(O)C(Cl)Cl SC-18205 [0,0,0,0,2,0|2,0,0]=4 222 B5R0.5 O=C(O)C(F)Br SC-49620 [0,0,0,0,2,0|2,0,0]=4 223 B5R0.5 O=C(O)C(F)F SC-25529 [0,0,0,0,2,0|2,0,0]=4 224 B5R0.5 [2H]C(=O)N(C)C SC-97589 [0,0,0,0,2,0|2,0,0]=4 225 B5R0.5 [C@@H](C)(Br)C(=O)O SC-03475 [0,0,0,0,2,0|1,0,0]=3