0 B7R0.3 C#CCNC(=O)CC CS-0225175 [0,0,0,0,0,0|3,0,1]=4 1 B7R0.3 C#CCNC(=O)OC CS-0262100 [0,0,0,0,0,0|2,0,1]=3 2 B7R0.3 C#CCOC(=O)CC CS-0464619 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.3 C=CC(=O)NCCC CS-0167916 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.3 C=CC(=O)NCOC CS-0168572 [0,0,0,0,0,0|2,1,1]=4 5 B7R0.3 C=CC(=O)OCCC CS-0870996 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.3 C=CCCC(=O)CC CS-0253493 [0,0,0,0,0,0|2,0,1]=3 7 B7R0.3 C=CCCC(=O)NC CS-0666768 [0,0,0,0,0,0|2,0,1]=3 8 B7R0.3 CCC(=O)NCCN CS-0697791 [0,0,0,0,0,0|4,0,0]=4 9 B7R0.3 CCC(=O)NCCO CS-0449194 [0,0,0,0,0,0|4,0,0]=4 10 B7R0.3 CCCCC(Br)CC CS-0333705 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.3 CCCCC(O)CC CS-0137777 [0,0,0,0,0,0|2,0,2]=4 12 B7R0.3 CCCNC(=O)CBr CS-0240203 [0,0,0,0,0,0|4,0,0]=4 13 B7R0.3 CCCNC(=O)CN CS-0454285 [0,0,0,0,0,0|4,0,0]=4 14 B7R0.3 CCCOC(=O)CN CS-0727430 [0,0,0,0,0,0|4,0,0]=4 15 B7R0.3 CCNCC(=O)OC CS-0342279 [0,0,0,0,0,0|2,0,0]=2 16 B7R0.3 CCOCC(=O)NN CS-0259344 [0,0,0,0,0,0|4,0,0]=4 17 B7R0.3 CCOCC(=O)OC CS-0260436 [0,0,0,0,0,0|2,0,0]=2 18 B7R0.3 CC\C=C\C(=O)OC CS-0161339 [0,0,0,0,0,0|1,0,2]=3 19 B7R0.3 CC\C=C\C(=O)OC CS-0784965 [0,0,0,0,0,0|1,0,2]=3 20 B7R0.3 CNC(=O)CCCCl CS-0249742 [0,0,0,0,0,0|3,0,0]=3 21 B7R0.3 CNC(=O)CCCN CS-0207685 [0,0,0,0,0,0|3,0,0]=3 22 B7R0.3 CNC(=O)OCCO CS-0075093 [0,0,0,0,0,0|4,0,0]=4 23 B7R0.3 CNCCC(=O)NC CS-0217040 [0,0,0,0,0,0|2,0,0]=2 24 B7R0.3 CNCCC(=O)OC CS-0454555 [0,0,0,0,0,0|1,0,0]=1 25 B7R0.3 COC(=N)CCCCl CS-0309147 [0,0,0,0,0,0|3,0,0]=3 26 B7R0.3 COCCC(=O)NN CS-0318297 [0,0,0,0,0,0|2,1,0]=3 27 B7R0.3 CSCC[C@@H](N)CO CS-0088128 [0,0,0,0,0,0|3,0,1]=4 28 B7R0.3 C\C=C\CC(=O)OC CS-0185645 [0,0,0,0,0,0|1,0,1]=2 29 B7R0.3 NNC(=O)CCCO CS-0206368 [0,0,0,0,0,0|4,0,0]=4 30 B6R0.1 C(C)=CC(=O)CC CS-W013723 [1,0,0,0,0,0|1,0,2]=4 31 B6R0.1 CCCC(=O)CCl CS-0252325 [1,0,0,0,0,0|2,0,0]=3 32 B6R0.1 CCCC(=O)NO CS-0179704 [1,0,0,0,0,0|2,0,0]=3 33 B6R0.1 CCNC(=O)CC CS-0205055 [1,0,0,0,0,0|2,0,0]=3 34 B6R0.1 CCNC(=O)CCl CS-0037573 [1,0,0,0,0,0|3,0,0]=4 35 B6R0.1 CCNC(=O)CI CS-0258404 [1,0,0,0,0,0|3,0,0]=4 36 B6R0.1 CCNC(=O)CN CS-0464992 [1,0,0,0,0,0|3,0,0]=4 37 B6R0.1 CCNC(=O)CO CS-0239967 [1,0,0,0,0,0|3,0,0]=4 38 B6R0.1 CCOC(=N)CC CS-0047019 [1,0,0,0,0,0|3,0,0]=4 39 B6R0.1 CCOC(=O)NO CS-0235105 [1,0,0,0,0,0|3,0,0]=4 40 B6R0.1 CCS(=O)CCCl CS-0697603 [1,0,0,0,0,0|3,0,0]=4 41 B6R0.1 CCSC(=O)CC CS-0313626 [1,0,0,0,0,0|2,0,0]=3 42 B6R0.1 CNC(=O)CCN CS-0665982 [1,0,0,0,0,0|2,0,0]=3 43 B6R0.1 CNC(=O)COC CS-0243458 [1,0,0,0,0,0|1,1,0]=3 44 B6R0.1 CNCC(=O)NC CS-0039124 [1,0,0,0,0,0|2,0,0]=3 45 B6R0.1 CNCC(=O)NC CS-0213249 [1,0,0,0,0,0|2,0,0]=3 46 B6R0.1 CNCC(C)OC CS-0239344 [1,0,0,0,0,0|2,0,1]=4 47 B6R0.1 COC(=O)\C=C/Br CS-0668651 [1,0,0,0,0,0|1,0,2]=4 48 B6R0.1 COC(=O)\C=C\Br CS-0694059 [1,0,0,0,0,0|1,0,2]=4 49 B6R0.1 COC(C)CCN CS-0074740 [1,0,0,0,0,0|2,0,1]=4 50 B6R0.1 CONC(=O)OC CS-0160296 [1,0,0,0,0,0|1,1,0]=3 51 B6R0.1 CSCC(=N)NO CS-0212758 [1,0,0,0,0,0|3,0,0]=4 52 B6R0.1 CSCC(=O)NN CS-0224650 [1,0,0,0,0,0|2,0,0]=3 53 B6R0.1 C\N=C(/O)CCN CS-W007299 [1,0,0,0,0,0|2,0,1]=4 54 B6R0.4 C=C(C)CNCC CS-0119901 [1,0,0,0,0,0|3,0,0]=4 55 B6R0.4 CC(=O)CCCBr CS-0103669 [1,0,0,0,0,0|2,0,0]=3 56 B6R0.4 CC(=O)CSC#N CS-0239749 [1,0,0,0,0,0|3,0,0]=4 57 B6R0.4 CC(=O)NCC#N CS-0514945 [1,0,0,0,0,0|3,0,0]=4 58 B6R0.4 CC(=O)NCCN CS-W013694 [1,0,0,0,0,0|3,0,0]=4 59 B6R0.4 CC(=O)OCC#N CS-0248523 [1,0,0,0,0,0|3,0,0]=4 60 B6R0.4 CC(=O)SCCN CS-0256575 [1,0,0,0,0,0|3,0,0]=4 61 B6R0.4 CC(=O)SCCN CS-0680538 [1,0,0,0,0,0|3,0,0]=4 62 B6R0.4 CCCCC(=O)Br CS-0185634 [1,0,0,0,0,0|2,0,0]=3 63 B6R0.4 CCCCC(C)Br CS-0206476 [1,0,0,0,0,0|2,0,1]=4 64 B6R0.4 CCCCC(C)Cl CS-0102663 [1,0,0,0,0,0|2,0,1]=4 65 B6R0.4 CCCCC(N)=O CS-0206049 [1,0,0,0,0,0|2,0,0]=3 66 B6R0.4 CCCNC(N)=O CS-0207277 [1,0,0,0,0,0|3,0,0]=4 67 B6R0.4 CCNCC(=O)O CS-0250575 [1,0,0,0,0,0|2,0,0]=3 68 B6R0.4 CCONC(C)=O CS-0017501 [1,0,0,0,0,0|3,0,0]=4 69 B6R0.4 CC\C=C\C(C)=O CS-0782888 [1,0,0,0,0,0|1,0,2]=4 70 B6R0.4 CNCCC(C)C CS-W018343 [1,0,0,0,0,0|2,0,1]=4 71 B6R0.4 COCCC(=N)N CS-0046979 [1,0,0,0,0,0|2,1,0]=4 72 B6R0.4 COCCC(=N)N CS-0261114 [1,0,0,0,0,0|2,1,0]=4 73 B6R0.4 COCCC(N)=O CS-0251977 [1,0,0,0,0,0|1,1,0]=3 74 B6R0.4 COCCC(N)=S CS-0355835 [1,0,0,0,0,0|1,2,0]=4 75 B6R0.4 COCCS(=O)O CS-0902763 [1,0,0,0,0,0|1,1,0]=3 76 B6R0.4 CO\N=C\C(=O)O CS-0232698 [1,0,0,0,0,0|1,1,1]=4 77 B6R0.4 CSCCC(=N)N CS-0259328 [1,0,0,0,0,0|2,0,0]=3 78 B6R0.4 CSCCC(C)N CS-0262000 [1,0,0,0,0,0|1,0,1]=3 79 B6R0.4 CSCOC(C)=O CS-0316444 [1,0,0,0,0,0|1,0,0]=2 80 B6R0.4 NC(=O)CCCCl CS-0660671 [1,0,0,0,0,0|3,0,0]=4 81 B6R0.4 NC(=O)CCCO CS-0678691 [1,0,0,0,0,0|3,0,0]=4 82 B6R0.4 NCCCC(=O)O CS-0259736 [1,0,0,0,0,0|2,0,0]=3 83 B6R0.4 O=C(O)CCCI CS-0045052 [1,0,0,0,0,0|2,0,0]=3 84 B6R0.6 CC#CCCCC CS-0204679 [1,0,0,0,0,0|2,0,1]=4 85 B6R0.6 CCCCSCC CS-0206090 [1,0,0,0,0,0|3,0,0]=4 86 B6R0.6 CNCCCSC CS-0238668 [1,0,0,0,0,0|1,0,1]=3 87 B6R0.6 COCCCC#N CS-0139387 [1,0,0,0,0,0|2,0,1]=4 88 B6R0.6 COCCCCN CS-0139373 [1,0,0,0,0,0|2,0,1]=4 89 B6R0.6 COCCCNN CS-0458223 [1,0,0,0,0,0|2,0,1]=4 90 B6R0.6 COCCCOC CS-0696948 [1,0,0,0,0,0|0,1,1]=3 91 B6R0.6 COCOCOC CS-0744407 [1,0,0,0,0,0|1,1,1]=4 92 B6R0.6 CSCCCC#N CS-0240117 [1,0,0,0,0,0|2,0,1]=4 93 B6R0.6 C\C=C/CCCO CS-0185820 [1,0,0,0,0,0|3,0,0]=4 94 B6R0.6 C\C=C\CCCO CS-0163135 [1,0,0,0,0,0|3,0,0]=4 95 B6R0.6 C\C=C\CCCO CS-0311846 [1,0,0,0,0,0|3,0,0]=4 96 B8R0.1 CCCNC(=O)CCN CS-0250637 [0,1,0,0,0,0|3,0,0]=4 97 B8R0.1 CCCNC(=O)CNC CS-0246714 [0,1,0,0,0,0|3,0,0]=4 98 B8R0.1 CCCOC(=O)CCN CS-0258841 [0,1,0,0,0,0|3,0,0]=4 99 B8R0.1 CCCOC(=O)OCCl CS-0164395 [0,1,0,0,0,0|2,0,0]=3 100 B8R0.1 CCOC(=N)CCCBr CS-0124515 [0,1,0,0,0,0|3,0,0]=4 101 B8R0.1 CCOC(=O)CCOC CS-0217247 [0,1,0,0,0,0|0,1,0]=2 102 B8R0.1 CCOC(=O)CSCC CS-0151560 [0,1,0,0,0,0|2,0,0]=3 103 B8R0.1 CCOC(=O)NCCCl CS-0151524 [0,1,0,0,0,0|3,0,0]=4 104 B8R0.1 CCOC(=O)NCCO CS-0719448 [0,1,0,0,0,0|3,0,0]=4 105 B8R0.1 CC\C=C\C(=O)OCC CS-0361328 [0,1,0,0,0,0|1,0,2]=4 106 B8R0.1 COCCC(=O)CC#N CS-0150184 [0,1,0,0,0,0|1,1,1]=4 107 B8R0.1 C\C=C\C(=O)CCCC CS-0504757 [0,1,0,0,0,0|2,0,0]=3 108 B8R0.3 C=CC[C@@H](N)C(=O)OC CS-0342153 [0,1,0,0,0,0|1,0,1]=3 109 B8R0.3 C=CC[C@H](N)C(=O)OC CS-0342517 [0,1,0,0,0,0|1,0,1]=3 110 B8R0.3 CCCC(=O)C(=O)OC CS-0185771 [0,1,0,0,0,0|1,0,1]=3 111 B8R0.3 CCC[C@@H](N)C(=O)OC CS-M2701 [0,1,0,0,0,0|1,0,0]=2 112 B8R0.3 CCNC(C)C(=O)OC CS-0258863 [0,1,0,0,0,0|2,0,0]=3 113 B8R0.3 COC(=O)C(N)CSC CS-0248302 [0,1,0,0,0,0|0,0,0]=1 114 B8R0.3 COC(=O)[C@@H](N)CCN CS-1005937 [0,1,0,0,0,0|2,0,0]=3 115 B8R0.3 COC(=O)[C@H](C)NC=O CS-0333027 [0,1,0,0,0,0|3,0,0]=4 116 B8R0.3 COCC(N)C(=O)OC CS-0458507 [0,1,0,0,0,0|0,1,0]=2 117 B8R0.3 CO\C=C(/I)C(=O)OC CS-0217368 [0,1,0,0,0,0|0,1,2]=4 118 B8R0.6 C=CC(=O)OCCOC CS-0167409 [0,1,0,0,0,0|1,1,1]=4 119 B8R0.6 CCCCNC(=O)CBr CS-0573211 [0,1,0,0,0,0|3,0,0]=4 120 B8R0.6 CCCCNC(=O)CC CS-0465067 [0,1,0,0,0,0|2,0,0]=3 121 B8R0.6 CCCCOC(=O)CF CS-0451760 [0,1,0,0,0,0|3,0,0]=4 122 B8R0.6 CCCNCC(=O)NC CS-0250593 [0,1,0,0,0,0|2,0,0]=3 123 B8R0.6 CCC\C=C\C(=O)OC CS-0166790 [0,1,0,0,0,0|1,0,1]=3 124 B8R0.6 COC(=O)CCCSC CS-0327058 [0,1,0,0,0,0|0,0,0]=1 125 B8R0.6 COC(=O)CSCCN CS-0258526 [0,1,0,0,0,0|2,0,0]=3 126 B8R0.6 COCCNC(=O)CCl CS-0076569 [0,1,0,0,0,0|2,1,0]=4 127 B8R0.6 COCCNC(=O)CN CS-0260223 [0,1,0,0,0,0|2,1,0]=4 128 B8R0.6 COCCNC(=O)NN CS-0251719 [0,1,0,0,0,0|2,1,0]=4 129 B8R0.6 COCCOC(=O)CCl CS-0321021 [0,1,0,0,0,0|2,1,0]=4 130 B8R0.6 N#CCSCC(=O)O[K] CS-0497767 [0,1,0,0,0,0|3,0,0]=4 131 B8R0.8 CCCCC(=O)C(C)=O CS-0329990 [0,1,0,0,0,0|2,0,0]=3 132 B8R0.8 CCCCC(=O)[C@H](C)N CS-0152397 [0,1,0,0,0,0|2,0,0]=3 133 B8R0.8 CCCNC(=O)C(C)Cl CS-0241506 [0,1,0,0,0,0|3,0,0]=4 134 B8R0.8 CCCNC(=O)C(C)N CS-0231050 [0,1,0,0,0,0|3,0,0]=4 135 B8R0.8 CCCOC(=O)C(C)Cl CS-0263294 [0,1,0,0,0,0|3,0,0]=4 136 B8R0.8 CCCOC(=O)[C@H](C)N CS-0538737 [0,1,0,0,0,0|3,0,0]=4 137 B8R0.8 CCCOC(=O)[C@H](C)O CS-0238611 [0,1,0,0,0,0|3,0,0]=4 138 B8R0.8 COCCC(=O)C(C)C CS-0261562 [0,1,0,0,0,0|1,1,0]=3 139 B8R0.8 COCCC(=O)N(C)C CS-0210107 [0,1,0,0,0,0|1,1,0]=3 140 B8R0.9 CCC(=O)NCC(C)C CS-0152594 [0,1,0,0,0,0|3,0,0]=4 141 B8R0.9 CNC(=O)CCC(=O)O CS-0231377 [0,1,0,0,0,0|3,0,0]=4 142 B8R0.9 COC(=O)CCC(F)F CS-0759817 [0,1,0,0,0,0|2,0,0]=3 143 B8R0.9 COC(=O)CCN(C)C CS-0204362 [0,1,0,0,0,0|1,0,0]=2 144 B8R0.9 COC(=O)COC(C)C CS-0239634 [0,1,0,0,0,0|2,0,0]=3 145 B8R0.9 COC(=O)\C=C\C(C)=O CS-0504754 [0,1,0,0,0,0|1,0,2]=4 146 B8R0.9 COC(=O)\C=C\C(C)C CS-0113137 [0,1,0,0,0,0|1,0,2]=4 147 B8R0.9 COC(=O)\N=C\N(C)C CS-0665962 [0,1,0,0,0,0|2,0,1]=4 148 B8R0.19 CNC(=O)CC(=O)NC CS-0772436 [0,1,0,0,0,0|2,0,1]=4 149 B8R0.19 COC(=O)CC(O)CCl CS-0440270 [0,1,0,0,0,0|2,0,0]=3 150 B8R0.19 COC(=O)CC(O)CN CS-0813801 [0,1,0,0,0,0|2,0,0]=3 151 B8R0.19 COC(=O)C[C@@H](O)CCl CS-0259583 [0,1,0,0,0,0|2,0,0]=3 152 B8R0.19 COC(=O)\C=C(/C)OC CS-0452646 [0,1,0,0,0,0|0,1,2]=4 153 B8R0.19 [C@H](O)(CC)CC(=O)OC CS-W013416 [0,1,0,0,0,0|1,0,0]=2 154 B8R1.1 CCC1CCC(=O)C1 CS-0206422 [0,0,0,1,0,0|2,0,0]=3 155 B8R1.1 CNC1=CC(=O)OC1 CS-0902604 [0,0,0,1,0,0|1,0,2]=4 156 B8R1.1 CSC1CCC(N)C1 CS-0264140 [0,0,0,1,0,0|2,0,1]=4 157 B8R1.1 N#CC1CCC(=O)C1 CS-0035459 [0,0,0,1,0,0|3,0,0]=4 158 B8R1.1 O=C1CC(CBr)CN1 CS-0070174 [0,0,0,1,0,0|3,0,0]=4 159 B8R1.1 O=C1C[C@@H](CO)CN1 CS-0471469 [0,0,0,1,0,0|3,0,0]=4 160 B8R1.2 CNC1CCSCC1 CS-0301424 [0,0,0,1,0,0|2,0,1]=4 161 B8R1.2 COC1=CCC=CC1 CS-0204293 [0,0,0,1,0,0|2,0,1]=4 162 B8R1.2 COC1CCCCC1 CS-0361650 [0,0,0,1,0,0|2,0,1]=4 163 B8R1.3 C=C1CCC(=O)CC1 CS-0465068 [0,0,0,1,0,0|2,0,1]=4 164 B8R1.3 CC1=NNC(=O)CC1 CS-1055591 [0,0,0,1,0,0|3,0,0]=4 165 B8R1.3 CC1C=CC(=O)CC1 CS-0051212 [0,0,0,1,0,0|2,0,1]=4 166 B8R1.3 CC1CNC(=O)CN1 CS-0050431 [0,0,0,1,0,0|3,0,0]=4 167 B8R1.3 CN1CC=C(Br)CC1 CS-0696146 [0,0,0,1,0,0|3,0,0]=4 168 B8R1.3 C[C@H]1CNC(=O)CN1 CS-0053133 [0,0,0,1,0,0|3,0,0]=4 169 B8R1.3 O=C1CCC(=O)NC1 CS-0009359 [0,0,0,1,0,0|3,0,0]=4 170 B8R1.3 O=C1CCC(Br)CC1 CS-0139183 [0,0,0,1,0,0|3,0,0]=4 171 B8R1.3 O=C1CC[C@@H](O)CN1 CS-D0041 [0,0,0,1,0,0|3,0,0]=4 172 B8R1.5 CC1=CCCCC1=O CS-0206231 [0,0,0,1,0,0|2,0,1]=4 173 B8R1.5 CC1CCCOC1=O CS-0440412 [0,0,0,1,0,0|3,0,0]=4 174 B8R1.5 CC1CSCCC1=O CS-0152667 [0,0,0,1,0,0|1,0,0]=2 175 B8R1.5 CN1CCCCC1=O CS-0222604 [0,0,0,1,0,0|2,0,0]=3 176 B8R1.5 NN1CCCCC1=O CS-0252905 [0,0,0,1,0,0|3,0,0]=4 177 B8R1.5 O=C1CCCCC1F CS-0040502 [0,0,0,1,0,0|3,0,0]=4 178 B8R1.13 O=C1CCC1CCCl CS-0474223 [0,0,0,1,0,0|3,0,0]=4 179 B8R1.22 O=C1CCOCCO1 CS-0205374 [0,0,0,1,0,0|0,1,0]=2 180 B8R1.22 O=C1CNCCCN1 CS-0067156 [0,0,0,1,0,0|3,0,0]=4 181 B8R1.22 O=C1CNCCCN1 CS-W003914 [0,0,0,1,0,0|3,0,0]=4 182 B8R1.22 S=C1CCCCCN1 CS-W016412 [0,0,0,1,0,0|2,1,0]=4 183 B8R1.38 COC(=O)C1CCN1 CS-W018690 [0,0,0,1,0,0|2,0,0]=3 184 B8R1.38 COC(=O)[C@@H]1CCN1 CS-0049286 [0,0,0,1,0,0|2,0,0]=3 185 B8R1.38 COC(=O)[C@H]1CCN1 CS-0049295 [0,0,0,1,0,0|2,0,0]=3 186 B8R1.38 NNC(=O)C1CCC1 CS-0055183 [0,0,0,1,0,0|3,0,0]=4 187 B8R1.38 O=C(CBr)C1CCC1 CS-0210596 [0,0,0,1,0,0|3,0,0]=4 188 B8R1.38 O=C(NO)C1CCC1 CS-0481540 [0,0,0,1,0,0|3,0,0]=4 189 B8R1.40 NNC(=O)CC1CC1 CS-0251865 [0,0,0,1,0,0|3,0,0]=4 190 B8R1.47 CN[C@H]1C[C@H](OC)C1 CS-0858576 [0,0,0,1,0,0|2,0,1]=4 191 B8R1.50 CC1=C(Br)C(=O)CC1 CS-0757581 [0,0,0,1,0,0|3,0,0]=4 192 B8R1.50 CC1=C(C)C(=O)CC1 CS-0253128 [0,0,0,1,0,0|2,0,0]=3 193 B8R1.50 CC1=C(O)C(=O)CC1 CS-W013661 [0,0,0,1,0,0|3,0,0]=4 194 B8R1.50 CC1CCC(=O)N1C CS-0747014 [0,0,0,1,0,0|2,0,0]=3 195 B8R1.50 CN1C(=O)CCC1O CS-W000536 [0,0,0,1,0,0|3,0,0]=4 196 B8R1.83 CC1CC1C(=O)NN CS-0259005 [0,0,0,1,0,0|3,0,0]=4 197 B8R1.83 COC(=O)C1CC1C CS-0253074 [0,0,0,1,0,0|1,0,0]=2 198 B5R0.1 C=C(C)CNC CS-0162572 [2,0,0,0,0,0|2,0,0]=4 199 B5R0.1 CCCC(=O)[O-] CS-0188375 [2,0,0,0,0,0|0,0,1]=3 200 B5R0.1 CCCC(C)N CS-0216448 [2,0,0,0,0,0|1,0,1]=4 201 B5R0.1 CCCS(=O)[O-] CS-0298073 [2,0,0,0,0,0|1,0,1]=4 202 B5R0.1 CCOC(C)=S CS-0265613 [2,0,0,0,0,0|1,1,0]=4 203 B5R0.1 CC\N=C(\C)O CS-W011352 [2,0,0,0,0,0|1,0,1]=4 204 B5R0.1 CNCC(C)=O CS-0656412 [2,0,0,0,0,0|1,0,0]=3 205 B5R0.1 CNOC(C)=O CS-0449138 [2,0,0,0,0,0|2,0,0]=4 206 B5R0.1 COCC(N)=O CS-0186655 [2,0,0,0,0,0|1,1,0]=4 207 B5R0.1 CONC(C)=O CS-0235532 [2,0,0,0,0,0|1,1,0]=4 208 B5R0.1 CS(=O)CCN CS-0217217 [2,0,0,0,0,0|2,0,0]=4 209 B5R0.1 CSCC(C)=O CS-0206376 [2,0,0,0,0,0|0,0,0]=2 210 B5R0.1 NCCC(=O)[O-] CS-0771386 [2,0,0,0,0,0|1,0,1]=4 211 B5R0.1 NNCC(=O)O CS-0697279 [2,0,0,0,0,0|2,0,0]=4 212 B5R0.2 C=CCSSC CS-0204953 [2,0,0,0,0,0|1,0,1]=4 213 B5R0.2 CCCCO[Ti] CS-0111516 [2,0,0,0,0,0|1,0,1]=4 214 B5R0.2 CNCCOC CS-0250483 [2,0,0,0,0,0|1,0,0]=3 215 B5R0.2 COCCCI CS-0236599 [2,0,0,0,0,0|1,0,1]=4 216 B5R0.2 COCCCN CS-0162830 [2,0,0,0,0,0|1,0,1]=4 217 B5R0.2 COCCNN CS-0035845 [2,0,0,0,0,0|2,0,0]=4 218 B5R0.2 COCCOC CS-0835969 [2,0,0,0,0,0|0,1,0]=3 219 B5R0.2 CSCCC#N CS-0205364 [2,0,0,0,0,0|1,0,1]=4 220 B5R0.2 CSCCCN CS-0204914 [2,0,0,0,0,0|1,0,1]=4 221 B5R0.2 CSCCCN CS-0516616 [2,0,0,0,0,0|1,0,1]=4 222 B5R0.3 C#CC(=O)CC CS-0262502 [2,0,0,0,0,0|1,0,1]=4 223 B5R0.3 CCC(=O)SC CS-0511804 [2,0,0,0,0,0|0,1,0]=3 224 B5R0.3 CNC(=N)SC CS-0204572 [2,0,0,0,0,0|2,0,0]=4 225 B5R0.3 CNC(=O)CO CS-0205237 [2,0,0,0,0,0|1,1,0]=4 226 B5R0.3 CNC(=O)OC CS-0211316 [2,0,0,0,0,0|1,0,0]=3 227 B7R0.2 CNC(=O)CC(C)=O CS-0214968 [1,1,0,0,0,0|1,0,1]=4 228 B7R0.2 COC(=O)CC(C)N CS-0147335 [1,1,0,0,0,0|0,0,0]=2 229 B7R0.2 COC(=O)CC(C)O CS-0161084 [1,1,0,0,0,0|0,0,0]=2 230 B7R0.2 COC(=O)CC(N)=S CS-0246007 [1,1,0,0,0,0|0,0,2]=4 231 B7R0.2 COC(=O)CN(C)C CS-0201680 [1,1,0,0,0,0|1,0,0]=3 232 B7R0.2 COC(=O)CN(C)C CS-0361918 [1,1,0,0,0,0|1,0,0]=3 233 B7R0.2 COC(=O)CS(C)=O CS-0231490 [1,1,0,0,0,0|0,0,1]=3 234 B7R0.5 CCNC(=O)C(C)Br CS-0666950 [1,1,0,0,0,0|2,0,0]=4 235 B7R0.5 CCNC(=O)C(C)N CS-0245127 [1,1,0,0,0,0|2,0,0]=4 236 B7R0.5 CCOC(=O)C(C)I CS-0187740 [1,1,0,0,0,0|2,0,0]=4 237 B7R0.5 CCOC(=O)N(C)C CS-0112757 [1,1,0,0,0,0|2,0,0]=4 238 B7R0.5 CCOC(=O)N(C)N CS-0671499 [1,1,0,0,0,0|2,0,0]=4 239 B7R0.5 CCOC(=O)[C@@H](C)F CS-0523947 [1,1,0,0,0,0|2,0,0]=4 240 B7R0.5 CCOC(=O)[C@@H](C)N CS-W018066 [1,1,0,0,0,0|2,0,0]=4 241 B7R0.5 CN(C)C(=O)CCCl CS-0063172 [1,1,0,0,0,0|2,0,0]=4 242 B7R0.5 CN(C)C(=O)CCN CS-0051534 [1,1,0,0,0,0|2,0,0]=4 243 B7R0.5 CN(C)C(=O)CCN CS-0205808 [1,1,0,0,0,0|2,0,0]=4 244 B7R0.5 CN(C)C(=O)CCO CS-0661881 [1,1,0,0,0,0|1,1,0]=4 245 B7R0.5 CNCC(=O)N(C)C CS-0058618 [1,1,0,0,0,0|2,0,0]=4 246 B7R0.5 CNCC(=O)N(C)C CS-0058620 [1,1,0,0,0,0|2,0,0]=4 247 B7R0.7 CCCC(=O)OCCl CS-0199093 [1,1,0,0,0,0|0,0,0]=2 248 B7R0.7 CCOC(=N)CCCl CS-0681393 [1,1,0,0,0,0|2,0,0]=4 249 B7R0.7 CCOC(=S)SCC CS-0238225 [1,1,0,0,0,0|1,1,0]=4 250 B7R0.7 CCOS(=O)OCC CS-0204569 [1,1,0,0,0,0|2,0,0]=4 251 B7R0.10 C=C(CCl)C(=O)OC CS-0208489 [1,1,0,0,0,0|1,0,1]=4 252 B7R0.10 CCC(=O)C(=O)OC CS-W013615 [1,1,0,0,0,0|0,0,1]=3 253 B7R0.10 CCC(=O)C(O)CC CS-W011231 [1,1,0,0,0,0|1,0,0]=3 254 B7R0.10 CCC(=O)N(C)CC CS-0535260 [1,1,0,0,0,0|2,0,0]=4 255 B7R0.10 CCC(Cl)C(=O)OC CS-0250039 [1,1,0,0,0,0|0,0,0]=2 256 B7R0.10 CCC(N)C(=O)NC CS-0966086 [1,1,0,0,0,0|1,0,0]=3 257 B7R0.10 CC[C@H](N)C(=O)OC CS-W021182 [1,1,0,0,0,0|0,0,0]=2 258 B7R0.10 CNC(=O)C(=O)OC CS-0667092 [1,1,0,0,0,0|1,0,1]=4 259 B7R0.10 CNC(=O)C(C)CN CS-0727683 [1,1,0,0,0,0|2,0,0]=4 260 B7R0.10 CNC(C)C(=O)OC CS-0433213 [1,1,0,0,0,0|1,0,0]=3 261 B7R0.10 CN[C@H](C)C(=O)OC CS-0212747 [1,1,0,0,0,0|1,0,0]=3 262 B7R0.10 COC(=O)C(C)C#N CS-0232751 [1,1,0,0,0,0|1,0,1]=4 263 B7R0.10 COC(=O)C(C)CBr CS-0565366 [1,1,0,0,0,0|1,0,0]=3 264 B7R0.10 COC(=O)C(C)OC CS-0207198 [1,1,0,0,0,0|0,1,0]=3 265 B7R0.10 COC(=O)C(C)SC CS-0272270 [1,1,0,0,0,0|0,0,0]=2 266 B7R0.10 COC(=O)C(O)CCl CS-0662697 [1,1,0,0,0,0|1,0,0]=3 267 B7R0.10 COC(=O)N(C)CCl CS-0968514 [1,1,0,0,0,0|2,0,0]=4 268 B7R0.10 COC(=O)N(C)OC CS-W001820 [1,1,0,0,0,0|1,1,0]=4 269 B7R0.10 COC(=O)[C@@H](N)CN CS-0162081 [1,1,0,0,0,0|1,0,0]=3 270 B7R0.10 C\C=C(/C)C(=O)OC CS-0257038 [1,1,0,0,0,0|0,0,2]=4 271 B7R0.10 C\C=C(\C)C(=O)OC CS-0207690 [1,1,0,0,0,0|0,0,2]=4 272 B7R0.12 COC(CSC)OC CS-0186106 [1,1,0,0,0,0|0,0,2]=4 273 B7R0.4 C#CCCOC(C)=O CS-0242576 [1,1,0,0,0,0|1,0,1]=4 274 B7R0.4 C#CCNCC(=O)O CS-0343178 [1,1,0,0,0,0|1,0,1]=4 275 B7R0.4 C=CCCOC(C)=O CS-0206024 [1,1,0,0,0,0|1,0,1]=4 276 B7R0.4 C=CCNCC(=O)O CS-0170873 [1,1,0,0,0,0|1,0,1]=4 277 B7R0.4 C=CCSCC(=O)O CS-0216467 [1,1,0,0,0,0|1,0,1]=4 278 B7R0.4 CC(=O)CCCC#N CS-0446855 [1,1,0,0,0,0|1,0,1]=4 279 B7R0.4 CC(=O)NCCCCl CS-0223153 [1,1,0,0,0,0|2,0,0]=4 280 B7R0.4 CC(=O)NCCCN CS-0200175 [1,1,0,0,0,0|2,0,0]=4 281 B7R0.4 CC(=O)NCCCN CS-0208169 [1,1,0,0,0,0|2,0,0]=4 282 B7R0.4 CC(=O)NCCCO CS-0037159 [1,1,0,0,0,0|2,0,0]=4 283 B7R0.4 CC(=O)OCCCBr CS-0130245 [1,1,0,0,0,0|2,0,0]=4 284 B7R0.4 CC(=O)SCCCCl CS-0232562 [1,1,0,0,0,0|2,0,0]=4 285 B7R0.4 CC(=O)SCCCO CS-0570855 [1,1,0,0,0,0|2,0,0]=4 286 B7R0.4 CCCCOC(N)=O CS-0152093 [1,1,0,0,0,0|2,0,0]=4 287 B7R0.4 CCOCCC(=O)O CS-0216898 [1,1,0,0,0,0|0,1,0]=3 288 B7R0.4 CCSCCC(=O)O CS-0249654 [1,1,0,0,0,0|0,0,0]=2 289 B7R0.4 CNCCNC(C)=O CS-0234928 [1,1,0,0,0,0|1,0,0]=3 290 B7R0.4 COCCNC(N)=O CS-0213036 [1,1,0,0,0,0|1,1,0]=4 291 B7R0.4 COC\C=C\C(=O)O CS-0782179 [1,1,0,0,0,0|0,1,1]=4 292 B7R0.4 CSCCCC(=O)O CS-0261815 [1,1,0,0,0,0|0,0,0]=2 293 B7R0.4 CSCCCC(C)=O CS-0459306 [1,1,0,0,0,0|0,0,0]=2 294 B7R0.4 CSCCNC(N)=O CS-0244833 [1,1,0,0,0,0|1,0,0]=3 295 B7R0.4 NC(=O)CCCCO CS-0236568 [1,1,0,0,0,0|2,0,0]=4 296 B7R0.4 NCCCCC(=O)O CS-0214159 [1,1,0,0,0,0|1,0,0]=3 297 B7R0.4 NCCCCC(N)=O CS-0112084 [1,1,0,0,0,0|2,0,0]=4 298 B7R0.4 NCCOCC(=O)O CS-0162340 [1,1,0,0,0,0|2,0,0]=4 299 B7R0.4 O=CNCCC(=O)O CS-0512115 [1,1,0,0,0,0|1,0,1]=4 300 B7R0.6 C=C(C)COC(C)=O CS-0187450 [1,1,0,0,0,0|2,0,0]=4 301 B7R0.6 CC(=O)CCC(=O)[O-] CS-0187336 [1,1,0,0,0,0|1,0,1]=4 302 B7R0.6 CC(=O)CCC(=O)[O-] CS-0526568 [1,1,0,0,0,0|1,0,1]=4 303 B7R0.6 CC(C)NCC(=O)O CS-0246606 [1,1,0,0,0,0|2,0,0]=4 304 B7R0.6 CC(N)CCC(=O)O CS-0262263 [1,1,0,0,0,0|1,0,0]=3 305 B7R0.6 CN(C)CCC(=O)O CS-0098123 [1,1,0,0,0,0|1,0,0]=3 306 B7R0.6 CN(C)CCC(N)=O CS-0231943 [1,1,0,0,0,0|2,0,0]=4 307 B7R0.6 C[C@H](N)CCC(=O)O CS-0526945 [1,1,0,0,0,0|1,0,0]=3 308 B7R0.6 C[S+](C)CCC(=O)[O-] CS-0449826 [1,1,0,0,0,0|0,0,2]=4 309 B7R0.6 NC(=O)CCC(=O)O CS-0094544 [1,1,0,0,0,0|2,0,0]=4 310 B7R0.6 O=C(O)CCC(=O)O CS-0504137 [1,1,0,0,0,0|2,0,0]=4 311 B7R0.8 CCCCP(=O)(O)O CS-0451169 [1,1,0,0,0,0|2,0,0]=4 312 B7R0.8 CNCCS(C)(=O)=O CS-0199514 [1,1,0,0,0,0|2,0,0]=4 313 B7R0.1 CCSCCSCC CS-0236098 [1,1,0,0,0,0|2,0,0]=4 314 B7R0.1 COCCCCCN CS-0252365 [1,1,0,0,0,0|1,0,1]=4 315 B7R0.1 COCCCCOC CS-0699044 [1,1,0,0,0,0|0,1,1]=4 316 B7R0.1 C\C=C/CCCCC CS-0205053 [1,1,0,0,0,0|2,0,0]=4 317 B9R0.4 CCCCC(=O)CC(C)=O CS-0186016 [0,2,0,0,0,0|2,0,0]=4 318 B9R0.4 COCCC(=O)NC(C)C CS-0259215 [0,2,0,0,0,0|1,1,0]=4 319 B9R0.5 C=COC(=O)CCCCC CS-0167850 [0,2,0,0,0,0|1,0,1]=4 320 B9R0.5 CCCCCC(=O)CCC CS-0362557 [0,2,0,0,0,0|2,0,0]=4 321 B9R0.5 CCCCNC(=O)CNC CS-0713545 [0,2,0,0,0,0|2,0,0]=4 322 B9R0.5 CCOC(=O)CCCCI CS-0581246 [0,2,0,0,0,0|1,0,0]=3 323 B9R0.5 CCOC(=O)CCN=[N+]=[N-] CS-0693915 [0,2,0,0,0,0|2,0,0]=4 324 B9R0.5 CCOC(=O)CNCCN CS-0140651 [0,2,0,0,0,0|2,0,0]=4 325 B9R0.5 CCOC(=O)COCCI CS-0510728 [0,2,0,0,0,0|2,0,0]=4 326 B9R0.5 CNCC(=O)NCCOC CS-0731911 [0,2,0,0,0,0|1,1,0]=4 327 B9R0.8 CCNCC(C)C(=O)OC CS-0256915 [0,2,0,0,0,0|1,0,0]=3 328 B9R0.8 COCCC(=O)N(C)OC CS-0239020 [0,2,0,0,0,0|0,1,0]=3 329 B9R0.34 C=CC(O)CC(=O)OCC CS-0215503 [0,2,0,0,0,0|1,0,1]=4 330 B9R0.34 CCC(=O)OC(C)COC CS-0512278 [0,2,0,0,0,0|1,1,0]=4 331 B9R0.34 CCOC(=O)CC(C)CC CS-W016385 [0,2,0,0,0,0|1,0,0]=3 332 B9R0.34 CCOC(=O)CC(O)CI CS-0464084 [0,2,0,0,0,0|2,0,0]=4 333 B9R0.35 C=CCC(C)C(=O)OCC CS-0197267 [0,2,0,0,0,0|1,0,1]=4 334 B9R0.35 CCCC(=O)C(=O)OCC CS-W022665 [0,2,0,0,0,0|1,0,1]=4 335 B9R0.35 CCCC(=O)C(O)CCC CS-W016384 [0,2,0,0,0,0|2,0,0]=4 336 B9R0.35 CCOC(=O)C(C)OCC CS-0234133 [0,2,0,0,0,0|2,0,0]=4 337 B9R0.48 CCOC(=O)CNC(C)C CS-0309297 [0,2,0,0,0,0|2,0,0]=4 338 B9R0.48 CCOC(=O)COC(C)=O CS-0699051 [0,2,0,0,0,0|2,0,0]=4 339 B9R0.23 CCC(=O)C(C)CN(C)C CS-0002395 [0,2,0,0,0,0|2,0,0]=4 340 B9R0.23 CNC(=O)[C@@H](N)CC(C)C CS-0209116 [0,2,0,0,0,0|2,0,0]=4 341 B9R0.23 COC(=O)C(=O)CC(C)C CS-0003854 [0,2,0,0,0,0|1,0,1]=4 342 B9R0.23 COC(=O)C(C)CC(C)=O CS-0233831 [0,2,0,0,0,0|1,0,0]=3 343 B9R0.23 COC(=O)C(C)OC(C)=O CS-0161286 [0,2,0,0,0,0|2,0,0]=4 344 B9R0.23 COC(=O)C(N)CC(N)=O CS-0258925 [0,2,0,0,0,0|2,0,0]=4 345 B9R0.23 COC(=O)[C@H](C)OC(C)=O CS-0161605 [0,2,0,0,0,0|2,0,0]=4 346 B9R0.27 CCC(=O)C(C)C(=O)OC CS-0207412 [0,2,0,0,0,0|1,0,1]=4 347 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC CS-0173664 [0,2,0,0,0,0|1,0,0]=3 348 B9R0.60 CCCC(C)(N)C(=O)OC CS-0245931 [0,2,0,0,0,0|1,0,0]=3 349 B9R0.60 CCNC(C)(C)C(=O)OC CS-0258491 [0,2,0,0,0,0|2,0,0]=4 350 B9R0.60 COCC(C)(C)C(=O)OC CS-0246171 [0,2,0,0,0,0|0,1,0]=3 351 B9R0.1 C=C(C)CCCC(=O)OC CS-0160700 [0,2,0,0,0,0|1,0,0]=3 352 B9R0.1 CCC(=O)CCCC(C)C CS-0238563 [0,2,0,0,0,0|2,0,0]=4 353 B9R0.1 COC(=O)CCNC(C)=O CS-0662351 [0,2,0,0,0,0|1,0,0]=3 354 B9R0.1 COC(=O)CSCC(=O)O CS-0161691 [0,2,0,0,0,0|2,0,0]=4 355 B9R0.1 COC(=O)\C=C\CC(C)C CS-0062486 [0,2,0,0,0,0|1,0,1]=4 356 B9R0.1 COC(=O)\C=C\CN(C)C CS-0166767 [0,2,0,0,0,0|1,0,1]=4 357 B9R0.24 CCC(=O)CCC(=O)OC CS-0504000 [0,2,0,0,0,0|1,0,0]=3 358 B9R0.24 CCC(O)CCC(=O)O[Na] CS-0620476 [0,2,0,0,0,0|2,0,0]=4 359 B9R0.24 COC(=O)CNC(=O)CCl CS-0181085 [0,2,0,0,0,0|2,0,0]=4 360 B9R0.46 C=CCNCCC(=O)OC CS-0256457 [0,2,0,0,0,0|1,0,0]=3 361 B9R0.46 CCNCCCC(=O)OC CS-0039669 [0,2,0,0,0,0|1,0,0]=3 362 B9R0.46 COC(=O)CCCCCI CS-0651600 [0,2,0,0,0,0|1,0,0]=3 363 B9R0.46 COC(=O)CCCSC#N CS-0208578 [0,2,0,0,0,0|0,0,1]=3 364 B9R0.46 COC(=O)CCSCCN CS-0222932 [0,2,0,0,0,0|0,0,0]=2 365 B9R0.46 COC(=O)COCCCBr CS-0503739 [0,2,0,0,0,0|1,0,0]=3 366 B9R0.46 COC(=O)CSCCC#N CS-0253564 [0,2,0,0,0,0|1,0,1]=4 367 B9R0.47 C=C(C)C(=O)NCCCC CS-0188272 [0,2,0,0,0,0|2,0,0]=4 368 B9R0.47 CCCCNC(=O)C(C)Cl CS-0244485 [0,2,0,0,0,0|2,0,0]=4 369 B9R0.47 CCCCOC(=O)C(C)Cl CS-0262940 [0,2,0,0,0,0|2,0,0]=4 370 B9R0.47 CCCCOC(=O)C(C)O CS-W018230 [0,2,0,0,0,0|2,0,0]=4 371 B9R0.47 COCCNC(=O)C(C)Cl CS-0241475 [0,2,0,0,0,0|1,1,0]=4 372 B9R0.47 COCCNC(=O)C(C)O CS-0238616 [0,2,0,0,0,0|1,1,0]=4 373 B9R0.42 COC(=O)CC(=O)C(C)F CS-0902580 [0,2,0,0,0,0|1,0,1]=4 374 B9R0.42 COC(=O)CC(=O)N(C)C CS-0759851 [0,2,0,0,0,0|1,0,1]=4 375 B9R0.42 COC(=O)CC(C)C(=O)O CS-0517436 [0,2,0,0,0,0|2,0,0]=4 376 B9R0.21 COC(=O)CCC(Cl)(Cl)Cl CS-0187499 [0,2,0,0,0,0|2,0,0]=4 377 B9R0.21 COC(=O)CCC(F)(F)F CS-0121469 [0,2,0,0,0,0|2,0,0]=4 378 B9R0.21 COC(=O)CCS(N)(=O)=O CS-0093812 [0,2,0,0,0,0|1,0,1]=4 379 B9R0.21 COC(=O)CSC(C)(C)C CS-0230561 [0,2,0,0,0,0|2,0,0]=4 380 B7R1.2 CC1=CC(=O)OC1 CS-0205200 [1,0,0,1,0,0|0,0,2]=4 381 B7R1.2 CC1CC(=O)NN1 CS-0242958 [1,0,0,1,0,0|2,0,0]=4 382 B7R1.2 CC1CCC(=O)N1 CS-0046659 [1,0,0,1,0,0|2,0,0]=4 383 B7R1.2 CC1CNC(=O)N1 CS-0040666 [1,0,0,1,0,0|2,0,0]=4 384 B7R1.2 CC1CNC(=O)O1 CS-0308136 [1,0,0,1,0,0|2,0,0]=4 385 B7R1.2 CC1COS(=O)O1 CS-W013556 [1,0,0,1,0,0|2,0,0]=4 386 B7R1.2 CN1CCC(=O)C1 CS-0043579 [1,0,0,1,0,0|2,0,0]=4 387 B7R1.2 C[C@@H]1CCC(=O)O1 CS-0063958 [1,0,0,1,0,0|2,0,0]=4 388 B7R1.2 NC1CNC(=O)C1 CS-0051034 [1,0,0,1,0,0|2,0,0]=4 389 B7R1.2 O=C1CC(O)CO1 CS-W013700 [1,0,0,1,0,0|0,1,0]=3 390 B7R1.3 BrC1=CCSCC1 CS-0693505 [1,0,0,1,0,0|2,0,0]=4 391 B7R1.3 NC1=NCCCC1 CS-0021164 [1,0,0,1,0,0|2,0,0]=4 392 B7R1.3 O=C1CNCCN1 CS-0183828 [1,0,0,1,0,0|2,0,0]=4 393 B7R1.3 S=C1CCCCN1 CS-0265032 [1,0,0,1,0,0|1,1,0]=4 394 B7R1.4 O=C1CCCC1=O CS-0072875 [1,0,0,1,0,0|2,0,0]=4 395 B7R1.8 O=C1CCC1CO CS-0045469 [1,0,0,1,0,0|1,1,0]=4 396 B7R1.22 CCC(=O)C1CC1 CS-0052572 [1,0,0,1,0,0|1,0,0]=3 397 B7R1.22 CNC(=O)C1CC1 CS-0106601 [1,0,0,1,0,0|1,0,0]=3 398 B7R1.22 COC(=O)C1CN1 CS-W016648 [1,0,0,1,0,0|1,0,0]=3 399 B7R1.22 O=C(O[K])C1CO1 CS-0199501 [1,0,0,1,0,0|1,1,0]=4 400 B7R1.18 CC(=O)C1COC1 CS-0056978 [1,0,0,1,0,0|0,1,0]=3 401 B7R1.18 NC(=O)C1CNC1 CS-0053755 [1,0,0,1,0,0|2,0,0]=4 402 B7R1.18 NC(=O)C1CNC1 CS-0247363 [1,0,0,1,0,0|2,0,0]=4 403 B7R1.18 NC(=O)C1CNC1 CS-W000790 [1,0,0,1,0,0|2,0,0]=4 404 B7R1.18 [C@H]1(C(=O)O)CCN1 CS-0044037 [1,0,0,1,0,0|2,0,0]=4 405 B7R1.20 CC(=O)CC1CC1 CS-0342620 [1,0,0,1,0,0|1,0,0]=3 406 B7R1.20 NC(=O)CC1CC1 CS-0055986 [1,0,0,1,0,0|2,0,0]=4 407 B7R1.24 C1CNCCSC1 CS-0271950 [1,0,0,1,0,0|1,0,1]=4 408 B9R1.2 CCC1CCCC(=O)C1 CS-0261625 [0,1,0,1,0,0|2,0,0]=4 409 B9R1.2 CCC1COCC(=O)N1 CS-0146685 [0,1,0,1,0,0|2,0,0]=4 410 B9R1.2 COC1=CCCN(C)C1 CS-0256416 [0,1,0,1,0,0|2,0,0]=4 411 B9R1.7 CCCC1CCC(=O)O1 CS-0152400 [0,1,0,1,0,0|2,0,0]=4 412 B9R1.7 CCCC1COC(=O)C1 CS-0168922 [0,1,0,1,0,0|1,0,0]=3 413 B9R1.7 CCC[C@H]1COC(=O)C1 CS-0090076 [0,1,0,1,0,0|1,0,0]=3 414 B9R1.8 COC=C1CCSCC1 CS-0571491 [0,1,0,1,0,0|1,0,0]=3 415 B9R1.15 COC1=CCCCC1=O CS-0340779 [0,1,0,1,0,0|1,0,1]=4 416 B9R1.15 COC1CCCNC1=O CS-0197082 [0,1,0,1,0,0|2,0,0]=4 417 B9R1.15 CSC1CCCCC1=O CS-0348680 [0,1,0,1,0,0|1,1,0]=4 418 B9R1.15 O=C1CCCCN1CCl CS-0261283 [0,1,0,1,0,0|2,0,0]=4 419 B9R1.33 CCCC1CCCC1=O CS-0238047 [0,1,0,1,0,0|2,0,0]=4 420 B9R1.33 O=C1OCCC1CCBr CS-0230403 [0,1,0,1,0,0|2,0,0]=4 421 B9R1.49 CC1CCNC(=O)CC1 CS-0742035 [0,1,0,1,0,0|2,0,0]=4 422 B9R1.49 CN1CCCC(=O)CC1 CS-0343108 [0,1,0,1,0,0|2,0,0]=4 423 B9R1.49 CN1CCNC(=O)CC1 CS-0151102 [0,1,0,1,0,0|2,0,0]=4 424 B9R1.69 CC1CCC(=O)N(C)C1 CS-0358054 [0,1,0,1,0,0|2,0,0]=4 425 B9R1.69 CC1CCC(C)C(=O)C1 CS-0262524 [0,1,0,1,0,0|2,0,0]=4 426 B9R1.69 CN1CC(N)CCC1=O CS-0050692 [0,1,0,1,0,0|2,0,0]=4 427 B9R1.69 CN1CCC(N)CC1=O CS-0051055 [0,1,0,1,0,0|2,0,0]=4 428 B9R1.73 CCCC(=O)C1CCC1 CS-0482832 [0,1,0,1,0,0|2,0,0]=4 429 B9R1.73 CCOC(=O)C1CCN1 CS-0434026 [0,1,0,1,0,0|2,0,0]=4 430 B9R1.183 CCOC(=O)C1OC1C CS-0612588 [0,1,0,1,0,0|2,0,0]=4 431 B9R1.5 CN1CCCNCC1=O CS-0019243 [0,1,0,1,0,0|2,0,0]=4 432 B9R1.5 CN1CCNCCC1=O CS-0151065 [0,1,0,1,0,0|2,0,0]=4 433 B9R1.5 CN1CCNCCC1=O CS-W019138 [0,1,0,1,0,0|2,0,0]=4 434 B9R1.5 NC1CCCCNC1=O CS-M1433 [0,1,0,1,0,0|2,0,0]=4 435 B9R1.5 N[C@@H]1CCCCNC1=O CS-M3615 [0,1,0,1,0,0|2,0,0]=4 436 B9R1.5 O=C1CCCCCC1Br CS-0031643 [0,1,0,1,0,0|2,0,0]=4 437 B9R1.5 O=C1CCCCCC1Cl CS-0455523 [0,1,0,1,0,0|2,0,0]=4 438 B9R1.5 O=C1CCCCCC1O CS-0965256 [0,1,0,1,0,0|2,0,0]=4 439 B9R1.11 CNC(=O)C1CCCN1 CS-0777637 [0,1,0,1,0,0|2,0,0]=4 440 B9R1.11 CNC(=O)C1CCNC1 CS-0207589 [0,1,0,1,0,0|2,0,0]=4 441 B9R1.11 CNC(=O)[C@@H]1CCCN1 CS-0260781 [0,1,0,1,0,0|2,0,0]=4 442 B9R1.11 COC(=O)C1=CCSC1 CS-0454791 [0,1,0,1,0,0|0,0,1]=3 443 B9R1.11 COC(=O)C1C=CCN1 CS-0201829 [0,1,0,1,0,0|1,0,1]=4 444 B9R1.11 COC(=O)C1CSCN1 CS-0079604 [0,1,0,1,0,0|0,0,0]=2 445 B9R1.11 COC(=O)C1NCCS1 CS-0236265 [0,1,0,1,0,0|2,0,0]=4 446 B9R1.11 COC(=O)N1CCCC1 CS-0667547 [0,1,0,1,0,0|1,0,0]=3 447 B9R1.11 COC(=O)[C@@H]1CCCN1 CS-0197089 [0,1,0,1,0,0|1,0,0]=3 448 B9R1.11 COC(=O)[C@H]1CCNC1 CS-0049275 [0,1,0,1,0,0|1,0,0]=3 449 B9R1.11 COC(=O)[C@H]1CCNC1 CS-0053780 [0,1,0,1,0,0|1,0,0]=3 450 B9R1.82 CNC(=O)C1CC(O)C1 CS-0325289 [0,1,0,1,0,0|2,0,0]=4 451 B9R1.82 COC(=O)C1CC(Cl)C1 CS-0043992 [0,1,0,1,0,0|1,0,0]=3 452 B9R1.82 COC(=O)C1CC(I)C1 CS-0623123 [0,1,0,1,0,0|1,0,0]=3 453 B9R1.82 COC(=O)N1CC(O)C1 CS-0049088 [0,1,0,1,0,0|2,0,0]=4 454 B9R1.88 COC(=O)C1CC1CO CS-0078743 [0,1,0,1,0,0|1,0,0]=3 455 B9R1.101 COC(=O)C(Br)C1CC1 CS-0891347 [0,1,0,1,0,0|1,0,0]=3 456 B9R1.132 CN1C(=O)CCC1CBr CS-0073988 [0,1,0,1,0,0|2,0,0]=4 457 B9R1.186 COC(=O)C1(C)COC1 CS-0045514 [0,1,0,1,0,0|0,1,0]=3 458 B9R1.186 COC(=O)C1(N)COC1 CS-0049126 [0,1,0,1,0,0|0,1,0]=3 459 B9R1.1 NCC1CCC(=O)CC1 CS-0142280 [0,1,0,1,0,0|2,0,0]=4 460 B9R1.79 COC(=O)C=C1CCC1 CS-0217922 [0,1,0,1,0,0|1,0,1]=4 461 B9R1.79 COC(=O)C=C1CSC1 CS-0505126 [0,1,0,1,0,0|0,0,1]=3 462 B9R1.79 COC(=O)CC1CCC1 CS-0302081 [0,1,0,1,0,0|1,0,0]=3 463 B9R1.79 COC(=O)CC1CNC1 CS-0099123 [0,1,0,1,0,0|1,0,0]=3 464 B9R1.80 COC(=O)C#CC1CC1 CS-0243634 [0,1,0,1,0,0|1,0,1]=4 465 B9R1.80 COC(=O)CNC1CC1 CS-0073911 [0,1,0,1,0,0|1,0,0]=3 466 B9R1.80 COC(=O)\C=C\C1CC1 CS-0380159 [0,1,0,1,0,0|1,0,1]=4 467 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N CS-0172853 [0,1,0,1,0,0|1,0,0]=3 468 B9R1.89 COC1=NCCCCC1 CS-W019476 [0,1,0,1,0,0|2,0,0]=4 469 B9R1.40 CC1(C)COCCC1=O CS-0051615 [0,1,0,1,0,0|1,1,0]=4 470 B9R1.110 CN(C)C(=O)C1CCC1 CS-0242630 [0,1,0,1,0,0|2,0,0]=4 471 B9R1.110 CN(C)C(=O)C1CNC1 CS-1214546 [0,1,0,1,0,0|2,0,0]=4 472 B9R1.10 CC1(C)COC(=O)OC1 CS-0206961 [0,1,0,1,0,0|2,0,0]=4 473 B9R1.10 C[N+]1(C)CCC(=O)CC1 CS-0309093 [0,1,0,1,0,0|2,0,0]=4 474 B9R2.139 O=C1CC2(CC2)CO1 CS-0050415 [0,0,0,2,0,0|1,0,0]=3