0 B6R0.6 C#CCCCCI CS-0088557 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.6 C#CCCCCN CS-0059697 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.6 C#CCCCCN CS-0106594 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.6 C#CCNCCBr CS-0069298 [0,0,0,0,0,0|2,0,1]=3 4 B5R0.2 C#CCCCI CS-0088561 [1,0,0,0,0,0|2,0,1]=4 5 B5R0.2 C#CCCCN CS-0038434 [1,0,0,0,0,0|2,0,1]=4 6 B5R0.2 CCCCON CS-0106180 [1,0,0,0,0,0|3,0,0]=4 7 B5R0.2 NCCCNN CS-0037551 [1,0,0,0,0,0|3,0,0]=4 8 B7R0.1 C#CCCCCCN CS-0104826 [0,1,0,0,0,0|3,0,0]=4 9 B7R0.1 C#CCOCCOC CS-0038923 [0,1,0,0,0,0|2,0,1]=4 10 B7R0.3 C#CCC[C@H](N)CO CS-0089531 [0,1,0,0,0,0|2,0,1]=4 11 B7R0.3 C=CCCC(N)CO CS-0091350 [0,1,0,0,0,0|2,0,1]=4 12 B7R0.3 CCCCC(N)CO CS-0091368 [0,1,0,0,0,0|2,0,0]=3 13 B7R0.3 CCCC[C@@H](N)CO CS-0089933 [0,1,0,0,0,0|2,0,0]=3 14 B7R0.3 CCCC[C@H](N)CO CS-0089877 [0,1,0,0,0,0|2,0,0]=3 15 B7R0.3 COCCC(N)CO CS-0106481 [0,1,0,0,0,0|3,0,0]=4 16 B7R0.3 CSCCC(N)CO CS-0091223 [0,1,0,0,0,0|3,0,0]=4 17 B7R0.3 CSCC[C@@H](N)CO CS-0088128 [0,1,0,0,0,0|3,0,0]=4 18 B7R0.4 C=CCNCC(F)F CS-0059708 [0,1,0,0,0,0|2,0,1]=4 19 B7R0.7 CCCC(Br)CCC CS-0106173 [0,1,0,0,0,0|3,0,0]=4 20 B7R0.7 O=C(CCBr)CCBr CS-W007197 [0,1,0,0,0,0|3,0,0]=4 21 B7R1.1 BrCC1CCCO1 CS-0052243 [0,0,0,1,0,0|2,0,0]=3 22 B7R1.1 C#CC1CCCN1 CS-0051909 [0,0,0,1,0,0|2,0,1]=4 23 B7R1.1 ClCC1CCCN1 CS-0106573 [0,0,0,1,0,0|2,0,0]=3 24 B7R1.1 ClC[C@@H]1CCCN1 CS-0106569 [0,0,0,1,0,0|2,0,0]=3 25 B7R1.1 ClC[C@H]1CCCN1 CS-0104825 [0,0,0,1,0,0|2,0,0]=3 26 B7R1.1 FC[C@@H]1CCCN1 CS-0053450 [0,0,0,1,0,0|2,0,0]=3 27 B7R1.1 FC[C@H]1CCCN1 CS-0053502 [0,0,0,1,0,0|2,0,0]=3 28 B7R1.1 N#CC1CCCN1 CS-0048722 [0,0,0,1,0,0|2,0,1]=4 29 B7R1.1 N#C[C@@H]1CCCN1 CS-0053430 [0,0,0,1,0,0|2,0,1]=4 30 B7R1.1 N#C[C@H]1CCCN1 CS-0102312 [0,0,0,1,0,0|2,0,1]=4 31 B7R1.1 NCC1OCCO1 CS-D0489 [0,0,0,1,0,0|2,0,0]=3 32 B7R1.1 OCC1CCNC1 CS-0048724 [0,0,0,1,0,0|3,0,0]=4 33 B7R1.1 OCC1OCCO1 CS-W019186 [0,0,0,1,0,0|1,0,0]=2 34 B7R1.1 OC[C@@H]1CCOC1 CS-0053251 [0,0,0,1,0,0|3,0,0]=4 35 B7R1.1 OC[C@H]1CCOC1 CS-0053313 [0,0,0,1,0,0|3,0,0]=4 36 B7R1.3 CC1COCCN1 CS-0038078 [0,0,0,1,0,0|3,0,0]=4 37 B7R1.3 F[C@@H]1CCCNC1 CS-0053327 [0,0,0,1,0,0|2,0,0]=3 38 B7R1.3 NC1CCCNC1 CS-W005316 [0,0,0,1,0,0|2,0,0]=3 39 B7R1.3 OC1C=CCNC1 CS-0060460 [0,0,0,1,0,0|1,0,1]=3 40 B7R1.3 OC1CCCCN1 CS-0112594 [0,0,0,1,0,0|2,0,0]=3 41 B7R1.3 O[C@@H]1CCCNC1 CS-0053770 [0,0,0,1,0,0|1,0,0]=2 42 B7R1.3 O[C@@H]1CCCOC1 CS-0053086 [0,0,0,1,0,0|2,0,0]=3 43 B7R1.3 SC1CCCNC1 CS-0048753 [0,0,0,1,0,0|1,1,0]=3 44 B7R1.3 [C@H]1(C)CNCCN1 CS-W011321 [0,0,0,1,0,0|2,0,0]=3 45 B7R1.4 C[C@@H]1COC[C@H]1N CS-0047781 [0,0,0,1,0,0|3,0,0]=4 46 B7R1.4 C[C@H]1CCC[C@@H]1O CS-0036071 [0,0,0,1,0,0|2,0,0]=3 47 B7R1.4 C[C@H]1CNC[C@@H]1O CS-0035605 [0,0,0,1,0,0|1,0,0]=2 48 B7R1.4 C[C@H]1CNC[C@H]1O CS-0036375 [0,0,0,1,0,0|1,0,0]=2 49 B7R1.4 F[C@H]1CNC[C@@H]1F CS-0047807 [0,0,0,1,0,0|2,0,0]=3 50 B7R1.4 F[C@H]1CNC[C@H]1F CS-0012663 [0,0,0,1,0,0|2,0,0]=3 51 B7R1.4 NC1CCCC1F CS-0101183 [0,0,0,1,0,0|3,0,0]=4 52 B7R1.4 NC1COCC1O CS-0112323 [0,0,0,1,0,0|2,0,0]=3 53 B7R1.4 N[C@@H]1CCC[C@@H]1O CS-0096405 [0,0,0,1,0,0|2,0,0]=3 54 B7R1.4 N[C@@H]1CCC[C@H]1F CS-0047825 [0,0,0,1,0,0|3,0,0]=4 55 B7R1.4 N[C@@H]1CCC[C@H]1N CS-0047743 [0,0,0,1,0,0|3,0,0]=4 56 B7R1.4 N[C@@H]1CCC[C@H]1O CS-0096407 [0,0,0,1,0,0|2,0,0]=3 57 B7R1.4 N[C@@H]1CNC[C@@H]1F CS-0096695 [0,0,0,1,0,0|2,0,0]=3 58 B7R1.4 N[C@@H]1COC[C@@H]1F CS-0046590 [0,0,0,1,0,0|3,0,0]=4 59 B7R1.4 N[C@@H]1COC[C@@H]1N CS-0049723 [0,0,0,1,0,0|3,0,0]=4 60 B7R1.4 N[C@@H]1COC[C@@H]1O CS-0049679 [0,0,0,1,0,0|2,0,0]=3 61 B7R1.4 N[C@@H]1COC[C@H]1N CS-0046716 [0,0,0,1,0,0|3,0,0]=4 62 B7R1.4 N[C@@H]1COC[C@H]1N CS-0053226 [0,0,0,1,0,0|3,0,0]=4 63 B7R1.4 N[C@@H]1COC[C@H]1O CS-0037840 [0,0,0,1,0,0|2,0,0]=3 64 B7R1.4 N[C@@H]1COC[C@H]1O CS-0046712 [0,0,0,1,0,0|2,0,0]=3 65 B7R1.4 N[C@@H]1CSC[C@@H]1O CS-0046601 [0,0,0,1,0,0|2,0,0]=3 66 B7R1.4 N[C@@H]1CSC[C@H]1O CS-0046604 [0,0,0,1,0,0|2,0,0]=3 67 B7R1.4 N[C@H]1CCC[C@H]1N CS-0049664 [0,0,0,1,0,0|3,0,0]=4 68 B7R1.4 N[C@H]1COC[C@@H]1N CS-0058692 [0,0,0,1,0,0|3,0,0]=4 69 B7R1.4 N[C@H]1COC[C@@H]1O CS-0047593 [0,0,0,1,0,0|2,0,0]=3 70 B7R1.4 N[C@H]1COC[C@H]1F CS-0092759 [0,0,0,1,0,0|3,0,0]=4 71 B7R1.4 N[C@H]1COC[C@H]1O CS-0053228 [0,0,0,1,0,0|2,0,0]=3 72 B7R1.4 O[C@@H]1CCC[C@H]1F CS-0101190 [0,0,0,1,0,0|2,0,0]=3 73 B7R1.4 O[C@@H]1CNC[C@@H]1F CS-0047354 [0,0,0,1,0,0|1,0,0]=2 74 B7R1.4 O[C@@H]1CNC[C@@H]1F CS-0058738 [0,0,0,1,0,0|1,0,0]=2 75 B7R1.4 O[C@H]1CNC[C@@H]1F CS-0047134 [0,0,0,1,0,0|1,0,0]=2 76 B7R1.4 O[C@H]1CNC[C@@H]1O CS-0047805 [0,0,0,1,0,0|0,0,0]=1 77 B7R1.4 O[C@H]1CNC[C@@H]1O CS-0058679 [0,0,0,1,0,0|0,0,0]=1 78 B7R1.4 O[C@H]1COC[C@H]1O CS-0049648 [0,0,0,1,0,0|1,0,0]=2 79 B7R1.4 [C@@H]1(N)CCC[C@H]1O CS-0031413 [0,0,0,1,0,0|2,0,0]=3 80 B7R1.6 NCCC1CCO1 CS-0052220 [0,0,0,1,0,0|2,0,0]=3 81 B7R1.6 OCCC1CCN1 CS-0104824 [0,0,0,1,0,0|2,0,0]=3 82 B7R1.6 OCCC1CCO1 CS-0052219 [0,0,0,1,0,0|1,0,0]=2 83 B7R1.6 OCCC1CNC1 CS-0052250 [0,0,0,1,0,0|3,0,0]=4 84 B7R1.6 OCCC1COC1 CS-0052216 [0,0,0,1,0,0|3,0,0]=4 85 B7R1.6 OCC[C@H]1CCO1 CS-0057152 [0,0,0,1,0,0|1,0,0]=2 86 B7R1.7 OCC#CC1CC1 CS-0051385 [0,0,0,1,0,0|2,0,1]=4 87 B7R1.8 O=C1CCC1CO CS-0045469 [0,0,0,1,0,0|1,0,2]=4 88 B7R1.8 OCC1CCC1F CS-0045492 [0,0,0,1,0,0|2,0,0]=3 89 B7R1.9 C#CC1CC1CO CS-0067820 [0,0,0,1,0,0|2,0,1]=4 90 B7R1.9 OC[C@H]1C[C@H]1CO CS-0053077 [0,0,0,1,0,0|1,0,0]=2 91 B7R1.24 C1CNCCOC1 CS-B1101 [0,0,0,1,0,0|1,0,0]=2 92 B4R0.2 CCCON CS-0106185 [2,0,0,0,0,0|2,0,0]=4 93 B4R0.2 CNCCF CS-0103514 [2,0,0,0,0,0|1,0,0]=3 94 B4R0.2 CNCCN CS-0108722 [2,0,0,0,0,0|1,0,0]=3 95 B4R0.2 COCCBr CS-0015336 [2,0,0,0,0,0|2,0,0]=4 96 B4R0.2 NCCCF CS-0088913 [2,0,0,0,0,0|2,0,0]=4 97 B6R0.1 C#CCC(O)CO CS-0088972 [1,1,0,0,0,0|1,0,1]=4 98 B6R0.1 C=CCC(N)CO CS-0091325 [1,1,0,0,0,0|1,0,1]=4 99 B6R0.1 CCCC(N)CO CS-0089892 [1,1,0,0,0,0|1,0,0]=3 100 B6R0.1 CCC[C@@H](N)CO CS-0088083 [1,1,0,0,0,0|1,0,0]=3 101 B6R0.1 CCNC(=O)CCl CS-0037573 [1,1,0,0,0,0|1,0,1]=4 102 B6R0.1 COCC(N)CO CS-0091346 [1,1,0,0,0,0|2,0,0]=4 103 B6R0.1 COCC(N)CO CS-0106469 [1,1,0,0,0,0|2,0,0]=4 104 B6R0.1 COC[C@@H](N)CO CS-0091344 [1,1,0,0,0,0|2,0,0]=4 105 B6R0.1 COC[C@H](N)CO CS-0091345 [1,1,0,0,0,0|2,0,0]=4 106 B6R0.1 NC(CO)CCO CS-0091333 [1,1,0,0,0,0|0,0,0]=2 107 B6R0.1 N[C@@H](CO)CCO CS-0091341 [1,1,0,0,0,0|0,0,0]=2 108 B6R0.1 N[C@H](CO)CCO CS-0091335 [1,1,0,0,0,0|0,0,0]=2 109 B6R0.4 CC(=O)NCCBr CS-0112060 [1,1,0,0,0,0|1,0,1]=4 110 B6R0.4 CC(F)CCCN CS-0104689 [1,1,0,0,0,0|2,0,0]=4 111 B6R0.4 NCCCC(F)F CS-0098955 [1,1,0,0,0,0|2,0,0]=4 112 B8R0.4 COCCOCCOC CS-0017205 [0,2,0,0,0,0|1,0,0]=3 113 B8R0.4 NCCCCCCCO CS-0088962 [0,2,0,0,0,0|2,0,0]=4 114 B8R0.21 OCCOCC(F)(F)F CS-0059814 [0,2,0,0,0,0|2,0,0]=4 115 B6R1.2 CC1CCCN1 CS-0051829 [1,0,0,1,0,0|1,0,0]=3 116 B6R1.2 NC1CCSC1 CS-0046717 [1,0,0,1,0,0|2,0,0]=4 117 B6R1.2 N[C@H]1CCOC1 CS-0053253 [1,0,0,1,0,0|2,0,0]=4 118 B6R1.2 O=C1NCCO1 CS-W007548 [1,0,0,1,0,0|0,0,2]=4 119 B6R1.2 OC1CCNC1 CS-W002985 [1,0,0,1,0,0|0,0,0]=2 120 B6R1.2 O[C@@H]1CNOC1 CS-0060090 [1,0,0,1,0,0|1,0,0]=3 121 B6R1.2 O[C@H]1CNOC1 CS-0060087 [1,0,0,1,0,0|1,0,0]=3 122 B6R1.3 ICCC1CC1 CS-0012702 [1,0,0,1,0,0|2,0,0]=4 123 B6R1.4 CC1OCC1O CS-0051834 [1,0,0,1,0,0|1,0,0]=3 124 B6R1.4 N[C@@H]1CC[C@H]1O CS-0045479 [1,0,0,1,0,0|1,0,0]=3 125 B6R1.4 N[C@H]1CC[C@H]1O CS-0049745 [1,0,0,1,0,0|1,0,0]=3 126 B6R1.4 O=C1NCC1O CS-0112791 [1,0,0,1,0,0|0,0,2]=4 127 B6R1.6 BrCC1CCO1 CS-0045505 [1,0,0,1,0,0|1,0,0]=3 128 B6R1.6 ICC1CCC1 CS-0053096 [1,0,0,1,0,0|2,0,0]=4 129 B6R1.6 ICC1CCO1 CS-0052227 [1,0,0,1,0,0|1,0,0]=3 130 B6R1.6 N#C[C@@H]1CCN1 CS-0049776 [1,0,0,1,0,0|1,0,1]=4 131 B6R1.6 NCC1CCN1 CS-0049914 [1,0,0,1,0,0|1,0,0]=3 132 B6R1.6 NCC1CCO1 CS-0048767 [1,0,0,1,0,0|1,0,0]=3 133 B6R1.6 NC[C@@H]1CCO1 CS-0100100 [1,0,0,1,0,0|1,0,0]=3 134 B6R1.6 NC[C@H]1CCO1 CS-0102901 [1,0,0,1,0,0|1,0,0]=3 135 B6R1.6 OCC1CCN1 CS-0049913 [1,0,0,1,0,0|0,0,0]=2 136 B6R1.6 OCC1CSC1 CS-0045518 [1,0,0,1,0,0|2,0,0]=4 137 B8R1.2 BrCC1CCCNC1 CS-0112575 [0,1,0,1,0,0|2,0,0]=4 138 B8R1.2 BrCC1CCCOC1 CS-D0475 [0,1,0,1,0,0|2,0,0]=4 139 B8R1.2 BrCC1COCCO1 CS-0099875 [0,1,0,1,0,0|2,0,0]=4 140 B8R1.2 CC[C@@H]1CNCCO1 CS-0096526 [0,1,0,1,0,0|1,0,0]=3 141 B8R1.2 CC[C@@H]1CNCCO1 CS-0100798 [0,1,0,1,0,0|1,0,0]=3 142 B8R1.2 CC[C@H]1CNCCO1 CS-0094360 [0,1,0,1,0,0|1,0,0]=3 143 B8R1.2 CC[C@H]1CNCCO1 CS-0100795 [0,1,0,1,0,0|1,0,0]=3 144 B8R1.2 COC1CCCNC1 CS-0051284 [0,1,0,1,0,0|1,0,0]=3 145 B8R1.2 CO[C@H]1CCCNC1 CS-0053262 [0,1,0,1,0,0|1,0,0]=3 146 B8R1.2 ClCC1CNCCO1 CS-0060823 [0,1,0,1,0,0|1,0,0]=3 147 B8R1.2 FCC1CCCNC1 CS-0105992 [0,1,0,1,0,0|2,0,0]=4 148 B8R1.2 FCC1CNCCN1 CS-0106315 [0,1,0,1,0,0|2,0,0]=4 149 B8R1.2 N#CC1CCCNC1 CS-0048754 [0,1,0,1,0,0|2,0,0]=4 150 B8R1.2 N#CC1CNCCO1 CS-0103652 [0,1,0,1,0,0|1,0,0]=3 151 B8R1.2 N#C[C@@H]1CCCNC1 CS-0060758 [0,1,0,1,0,0|2,0,0]=4 152 B8R1.2 N#C[C@@H]1CNCCO1 CS-0103653 [0,1,0,1,0,0|1,0,0]=3 153 B8R1.2 N#C[C@@H]1COCCN1 CS-0103647 [0,1,0,1,0,0|1,0,1]=4 154 B8R1.2 N#C[C@H]1CCCNC1 CS-0053248 [0,1,0,1,0,0|2,0,0]=4 155 B8R1.2 NCC1CCCOC1 CS-0048770 [0,1,0,1,0,0|2,0,0]=4 156 B8R1.2 NCC1CCCOC1 CS-D0477 [0,1,0,1,0,0|2,0,0]=4 157 B8R1.2 NCC1CNCCN1 CS-0112092 [0,1,0,1,0,0|2,0,0]=4 158 B8R1.2 NC[C@@H]1COCCO1 CS-0037059 [0,1,0,1,0,0|2,0,0]=4 159 B8R1.2 OCC1CCCCO1 CS-0034490 [0,1,0,1,0,0|1,0,0]=3 160 B8R1.2 OCC1CCCOC1 CS-D0478 [0,1,0,1,0,0|1,0,0]=3 161 B8R1.2 OCC1CNCCN1 CS-0106316 [0,1,0,1,0,0|1,0,0]=3 162 B8R1.2 OCC1CNCCO1 CS-0106282 [0,1,0,1,0,0|0,0,0]=2 163 B8R1.2 OC[C@@H]1CNCCN1 CS-0112095 [0,1,0,1,0,0|1,0,0]=3 164 B8R1.2 OC[C@H]1CNCCN1 CS-0106317 [0,1,0,1,0,0|1,0,0]=3 165 B8R1.2 OC[C@H]1CNCCO1 CS-0108806 [0,1,0,1,0,0|0,0,0]=2 166 B8R1.5 CC1CCNCC1O CS-0050805 [0,1,0,1,0,0|1,0,0]=3 167 B8R1.5 CC1CNCCC1=O CS-D0300 [0,1,0,1,0,0|1,0,1]=4 168 B8R1.5 CC1CNCCC1O CS-0051241 [0,1,0,1,0,0|1,0,0]=3 169 B8R1.5 C[C@@H]1CCNC[C@@H]1O CS-0038217 [0,1,0,1,0,0|1,0,0]=3 170 B8R1.5 C[C@@H]1CNCCN1C CS-0006864 [0,1,0,1,0,0|2,0,0]=4 171 B8R1.5 C[C@@H]1CNCCN1C CS-0053508 [0,1,0,1,0,0|2,0,0]=4 172 B8R1.5 C[C@@H]1CNCC[C@@H]1O CS-0100460 [0,1,0,1,0,0|1,0,0]=3 173 B8R1.5 C[C@@H]1CNCC[C@H]1O CS-0051211 [0,1,0,1,0,0|1,0,0]=3 174 B8R1.5 C[C@H]1CCNC[C@@H]1O CS-0036436 [0,1,0,1,0,0|1,0,0]=3 175 B8R1.5 C[C@H]1CNCCN1C CS-0006863 [0,1,0,1,0,0|2,0,0]=4 176 B8R1.5 C[C@H]1CNCCN1C CS-0053455 [0,1,0,1,0,0|2,0,0]=4 177 B8R1.5 F[C@H]1CCNC[C@@H]1F CS-0054840 [0,1,0,1,0,0|2,0,0]=4 178 B8R1.5 F[C@H]1CCNC[C@H]1F CS-0049725 [0,1,0,1,0,0|2,0,0]=4 179 B8R1.5 NC1CCOCC1O CS-0104804 [0,1,0,1,0,0|2,0,0]=4 180 B8R1.5 N[C@@H]1CCCC[C@H]1O CS-0062471 [0,1,0,1,0,0|2,0,0]=4 181 B8R1.5 N[C@@H]1CCCC[C@H]1O CS-0096323 [0,1,0,1,0,0|2,0,0]=4 182 B8R1.5 N[C@@H]1CCNC[C@H]1O CS-0109627 [0,1,0,1,0,0|1,0,0]=3 183 B8R1.5 N[C@@H]1CCOC[C@@H]1O CS-0049677 [0,1,0,1,0,0|2,0,0]=4 184 B8R1.5 N[C@@H]1CCOC[C@H]1O CS-0053238 [0,1,0,1,0,0|2,0,0]=4 185 B8R1.5 N[C@@H]1COCC[C@@H]1O CS-0058644 [0,1,0,1,0,0|2,0,0]=4 186 B8R1.5 N[C@@H]1COCC[C@H]1O CS-0053305 [0,1,0,1,0,0|2,0,0]=4 187 B8R1.5 N[C@H]1CCCC[C@H]1O CS-W008152 [0,1,0,1,0,0|2,0,0]=4 188 B8R1.5 N[C@H]1CCNC[C@@H]1O CS-0109961 [0,1,0,1,0,0|1,0,0]=3 189 B8R1.5 N[C@H]1CCOC[C@@H]1O CS-0029596 [0,1,0,1,0,0|2,0,0]=4 190 B8R1.5 N[C@H]1CCOC[C@@H]1O CS-0053298 [0,1,0,1,0,0|2,0,0]=4 191 B8R1.5 N[C@H]1CCOC[C@H]1O CS-0053229 [0,1,0,1,0,0|2,0,0]=4 192 B8R1.5 N[C@H]1COCC[C@@H]1O CS-0047794 [0,1,0,1,0,0|2,0,0]=4 193 B8R1.5 N[C@H]1COCC[C@@H]1O CS-0053233 [0,1,0,1,0,0|2,0,0]=4 194 B8R1.5 O=C1NCCC[C@H]1O CS-0112089 [0,1,0,1,0,0|1,0,1]=4 195 B8R1.5 OC1CCOCC1F CS-0051356 [0,1,0,1,0,0|2,0,0]=4 196 B8R1.5 O[C@@H]1CCCC[C@H]1F CS-0101188 [0,1,0,1,0,0|2,0,0]=4 197 B8R1.5 O[C@@H]1CCCC[C@H]1F CS-0101192 [0,1,0,1,0,0|2,0,0]=4 198 B8R1.5 O[C@@H]1CCNC[C@@H]1F CS-0102297 [0,1,0,1,0,0|1,0,0]=3 199 B8R1.5 O[C@@H]1CCNC[C@H]1F CS-0021964 [0,1,0,1,0,0|1,0,0]=3 200 B8R1.5 O[C@@H]1CCNC[C@H]1O CS-0047738 [0,1,0,1,0,0|0,0,0]=2 201 B8R1.5 O[C@@H]1CCOC[C@@H]1F CS-0049704 [0,1,0,1,0,0|2,0,0]=4 202 B8R1.5 O[C@@H]1CCOC[C@@H]1F CS-0058688 [0,1,0,1,0,0|2,0,0]=4 203 B8R1.5 O[C@@H]1CNCC[C@H]1F CS-0053301 [0,1,0,1,0,0|1,0,0]=3 204 B8R1.5 O[C@H]1CCCC[C@@H]1F CS-0101186 [0,1,0,1,0,0|2,0,0]=4 205 B8R1.5 O[C@H]1CCNC[C@@H]1F CS-0021965 [0,1,0,1,0,0|1,0,0]=3 206 B8R1.5 O[C@H]1CCNC[C@@H]1F CS-0035996 [0,1,0,1,0,0|1,0,0]=3 207 B8R1.5 O[C@H]1CCNC[C@H]1F CS-0021967 [0,1,0,1,0,0|1,0,0]=3 208 B8R1.5 O[C@H]1CCNC[C@H]1F CS-0039754 [0,1,0,1,0,0|1,0,0]=3 209 B8R1.5 O[C@H]1CCNC[C@H]1F CS-0058642 [0,1,0,1,0,0|1,0,0]=3 210 B8R1.5 O[C@H]1CCOC[C@H]1F CS-0053299 [0,1,0,1,0,0|2,0,0]=4 211 B8R1.5 O[C@H]1CNCC[C@H]1O CS-0049724 [0,1,0,1,0,0|0,0,0]=2 212 B8R1.8 OCCC1CCNC1 CS-0052204 [0,1,0,1,0,0|2,0,0]=4 213 B8R1.11 CN1CCC[C@@H]1CN CS-0053069 [0,1,0,1,0,0|2,0,0]=4 214 B8R1.11 CN1CCC[C@H]1CBr CS-0112933 [0,1,0,1,0,0|2,0,0]=4 215 B8R1.11 CO[C@@H]1CNC[C@@H]1F CS-0036147 [0,1,0,1,0,0|1,0,0]=3 216 B8R1.11 CO[C@@H]1CNC[C@@H]1O CS-0053237 [0,1,0,1,0,0|0,0,0]=2 217 B8R1.11 CO[C@@H]1CNC[C@H]1F CS-0106644 [0,1,0,1,0,0|1,0,0]=3 218 B8R1.11 CO[C@@H]1CNC[C@H]1O CS-0047754 [0,1,0,1,0,0|0,0,0]=2 219 B8R1.11 CO[C@@H]1COC[C@H]1N CS-0046713 [0,1,0,1,0,0|2,0,0]=4 220 B8R1.11 CO[C@H]1CNC[C@H]1O CS-0055739 [0,1,0,1,0,0|0,0,0]=2 221 B8R1.11 N[C@@H]1CNC[C@H]1CO CS-0094627 [0,1,0,1,0,0|1,0,0]=3 222 B8R1.11 OC[C@@H]1CC=C[C@@H]1O CS-M0199 [0,1,0,1,0,0|1,0,1]=4 223 B8R1.11 OC[C@H]1OCC[C@@H]1O CS-0089202 [0,1,0,1,0,0|1,0,0]=3 224 B8R1.22 CC1CCCCNC1 CS-0038439 [0,1,0,1,0,0|2,0,0]=4 225 B8R1.22 CC1CNCCCN1 CS-0100317 [0,1,0,1,0,0|2,0,0]=4 226 B8R1.22 C[C@@H]1CNCCCN1 CS-0100401 [0,1,0,1,0,0|2,0,0]=4 227 B8R1.22 C[C@H]1CNCCCN1 CS-0100318 [0,1,0,1,0,0|2,0,0]=4 228 B8R1.22 O=C1COCCCN1 CS-0037454 [0,1,0,1,0,0|1,0,1]=4 229 B8R1.22 OC1CCCNCC1 CS-0038201 [0,1,0,1,0,0|1,0,0]=3 230 B8R1.36 NCCNCC1CC1 CS-0053535 [0,1,0,1,0,0|2,0,0]=4 231 B8R1.1 NCC1CCC(O)C1 CS-0107088 [0,1,0,1,0,0|2,0,0]=4 232 B8R1.1 O=C1CC[C@H](CO)O1 CS-0046919 [0,1,0,1,0,0|1,0,1]=4 233 B8R1.1 OCC1CCC(O)C1 CS-0108613 [0,1,0,1,0,0|1,0,0]=3 234 B8R1.1 OC[C@@H]1C[C@@H](F)CN1 CS-0035888 [0,1,0,1,0,0|1,0,0]=3 235 B8R1.1 OC[C@H]1C[C@@H](O)CO1 CS-0060089 [0,1,0,1,0,0|1,0,0]=3 236 B8R1.1 OC[C@H]1C[C@H](O)CN1 CS-0053224 [0,1,0,1,0,0|0,0,0]=2 237 B8R1.3 CC1CNC(C)CN1 CS-0106273 [0,1,0,1,0,0|2,0,0]=4 238 B8R1.3 C[C@H]1CC[C@@H](O)CN1 CS-0057814 [0,1,0,1,0,0|1,0,0]=3 239 B8R1.3 C[C@H]1CN[C@@H](C)CN1 CS-0048757 [0,1,0,1,0,0|2,0,0]=4 240 B8R1.3 N[C@H]1CC[C@@H](O)CC1 CS-0049680 [0,1,0,1,0,0|2,0,0]=4 241 B8R1.3 OC1CCC(S)CC1 CS-0106060 [0,1,0,1,0,0|2,0,0]=4 242 B8R1.3 O[C@H]1CC[C@@H](O)CC1 CS-0049754 [0,1,0,1,0,0|2,0,0]=4 243 B8R1.38 CC(CO)C1CCO1 CS-0052218 [0,1,0,1,0,0|1,0,0]=3 244 B8R1.38 NC(CO)C1CCC1 CS-0091364 [0,1,0,1,0,0|2,0,0]=4 245 B8R1.38 N[C@@H](CO)C1CCC1 CS-0091362 [0,1,0,1,0,0|2,0,0]=4 246 B8R1.38 N[C@H](CO)C1CCC1 CS-0089880 [0,1,0,1,0,0|2,0,0]=4 247 B8R1.40 NC(CO)CC1CC1 CS-0091357 [0,1,0,1,0,0|2,0,0]=4 248 B8R1.40 N[C@@H](CO)CC1CC1 CS-0091358 [0,1,0,1,0,0|2,0,0]=4 249 B8R1.40 N[C@H](CO)CC1CC1 CS-0091361 [0,1,0,1,0,0|2,0,0]=4 250 B8R1.52 C[C@@]1(CO)CCCN1 CS-0053062 [0,1,0,1,0,0|1,0,0]=3 251 B8R1.52 C[C@]1(CO)CCCN1 CS-0053068 [0,1,0,1,0,0|1,0,0]=3 252 B8R1.52 NC1(CO)CCCC1 CS-0088069 [0,1,0,1,0,0|2,0,0]=4 253 B8R1.4 CC1CC(O)CCO1 CS-0051835 [0,1,0,1,0,0|2,0,0]=4 254 B8R1.4 CN1CCC[C@@H](N)C1 CS-0053341 [0,1,0,1,0,0|2,0,0]=4 255 B8R1.4 CN1CCC[C@@H](O)C1 CS-0053340 [0,1,0,1,0,0|1,0,0]=3 256 B8R1.4 CN1CCC[C@H](O)C1 CS-0053281 [0,1,0,1,0,0|1,0,0]=3 257 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 CS-0053457 [0,1,0,1,0,0|2,0,0]=4 258 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 CS-0088046 [0,1,0,1,0,0|1,0,0]=3 259 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 CS-W005832 [0,1,0,1,0,0|1,0,0]=3 260 B8R1.4 C[C@H]1CNC[C@H](C)N1 CS-0053399 [0,1,0,1,0,0|2,0,0]=4 261 B8R1.4 C[C@H]1CNC[C@H](C)N1 CS-0099931 [0,1,0,1,0,0|2,0,0]=4 262 B8R1.4 C[C@H]1CNC[C@H](C)O1 CS-0102294 [0,1,0,1,0,0|1,0,0]=3 263 B8R1.4 NC1COCC(O)C1 CS-0050678 [0,1,0,1,0,0|2,0,0]=4 264 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 CS-0047790 [0,1,0,1,0,0|2,0,0]=4 265 B8R1.4 N[C@@H]1CCC[C@H](O)C1 CS-0112892 [0,1,0,1,0,0|2,0,0]=4 266 B8R1.4 N[C@@H]1CCC[C@H](O)C1 CS-W007314 [0,1,0,1,0,0|2,0,0]=4 267 B8R1.4 N[C@H]1CCC[C@H](O)C1 CS-0112699 [0,1,0,1,0,0|2,0,0]=4 268 B8R1.4 O=C1CCCC(O)C1 CS-0051335 [0,1,0,1,0,0|2,0,0]=4 269 B8R1.7 CC(C)[C@@H]1CCCN1 CS-0053448 [0,1,0,1,0,0|2,0,0]=4 270 B8R1.7 CC(C)[C@H]1CCCN1 CS-0053500 [0,1,0,1,0,0|2,0,0]=4 271 B8R1.7 CC(N)C1CCCO1 CS-0091427 [0,1,0,1,0,0|2,0,0]=4 272 B8R1.7 FC(F)[C@@H]1CCCN1 CS-0053451 [0,1,0,1,0,0|2,0,0]=4 273 B8R1.7 O=C(O)[C@H]1CCCO1 CS-W005223 [0,1,0,1,0,0|1,0,1]=4 274 B8R1.19 CC1CNCC1(F)F CS-0102311 [0,1,0,1,0,0|2,0,0]=4 275 B8R1.19 C[C@@]1(O)CCC[C@H]1N CS-0105761 [0,1,0,1,0,0|2,0,0]=4 276 B8R1.19 C[C@@]1(O)CCC[C@H]1N CS-0112219 [0,1,0,1,0,0|2,0,0]=4 277 B8R1.19 C[C@H]1COC[C@@]1(C)O CS-0047333 [0,1,0,1,0,0|2,0,0]=4 278 B8R1.19 OC1CNCC1(F)F CS-0051119 [0,1,0,1,0,0|1,0,0]=3 279 B8R1.27 OCCC1CC1(F)F CS-0054495 [0,1,0,1,0,0|2,0,0]=4 280 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O CS-0053427 [0,1,0,1,0,0|1,0,1]=4 281 B8R1.31 O=C(O)C1CCC1O CS-0090873 [0,1,0,1,0,0|1,0,1]=4 282 B8R1.43 O=C(O)C1CC1CO CS-0098963 [0,1,0,1,0,0|1,0,1]=4 283 B8R1.72 CC1(C)CNCCO1 CS-0052185 [0,1,0,1,0,0|1,0,0]=3 284 B8R1.72 CC1(O)CCCNC1 CS-0051242 [0,1,0,1,0,0|1,0,0]=3 285 B8R1.72 C[C@]1(O)CCCNC1 CS-0053261 [0,1,0,1,0,0|1,0,0]=3 286 B8R1.18 CN1C[C@H](N)[C@H](O)C1 CS-0053297 [0,1,0,1,0,0|1,0,0]=3 287 B8R2.22 C1CC2CNCC12 CS-0046699 [0,0,0,2,0,0|2,0,0]=4 288 B8R2.22 C1CC2CNCC12 CS-0046701 [0,0,0,2,0,0|2,0,0]=4 289 B8R2.22 C1NCC2NCC12 CS-0046539 [0,0,0,2,0,0|2,0,0]=4 290 B8R2.34 C1CC2CC1CN2 CS-0067833 [0,0,0,2,0,0|2,0,0]=4 291 B8R2.34 C1CC2CCC1N2 CS-0050113 [0,0,0,2,0,0|2,0,0]=4 292 B8R2.34 C1NC2CNC1C2 CS-0047653 [0,0,0,2,0,0|2,0,0]=4 293 B8R2.34 C1OC2CNC1C2 CS-0051828 [0,0,0,2,0,0|1,0,0]=3 294 B8R2.34 C1O[C@H]2CN[C@@H]1C2 CS-0053606 [0,0,0,2,0,0|1,0,0]=3 295 B8R2.34 [C@H]12CC[C@H](C1)NC2 CS-0067821 [0,0,0,2,0,0|2,0,0]=4 296 B8R2.55 C1CNC2(C1)CC2 CS-0088474 [0,0,0,2,0,0|2,0,0]=4 297 B8R2.55 C1CNC2(C1)CC2 CS-0103023 [0,0,0,2,0,0|2,0,0]=4 298 B8R2.2 CC12CCCC1O2 CS-0112282 [0,0,0,2,0,0|2,0,0]=4 299 B8R2.18 OC1CC2CC2C1 CS-0035529 [0,0,0,2,0,0|2,0,0]=4 300 B8R2.23 C1NCC2CC1C2 CS-0058463 [0,0,0,2,0,0|2,0,0]=4 301 B8R2.23 C1NCC2CC1O2 CS-0054897 [0,0,0,2,0,0|1,0,0]=3 302 B8R2.25 C1CC2CC2CN1 CS-0059003 [0,0,0,2,0,0|2,0,0]=4 303 B8R2.25 C1CC2NC2CO1 CS-0112795 [0,0,0,2,0,0|1,0,0]=3 304 B8R2.25 C1CC2OC2CO1 CS-0051589 [0,0,0,2,0,0|2,0,0]=4 305 B8R2.25 C1CNC2CC2N1 CS-0052146 [0,0,0,2,0,0|2,0,0]=4 306 B8R2.25 C1COC2CC2N1 CS-0112792 [0,0,0,2,0,0|1,0,0]=3 307 B8R2.38 [C@H]12C[C@H]1CC[C@@H]2O CS-0088889 [0,0,0,2,0,0|2,0,0]=4 308 B8R2.20 OCC1CC12CC2 CS-0067352 [0,0,0,2,0,0|2,0,0]=4 309 B8R2.24 C1CC1NC2CC2 CS-0108470 [0,0,0,2,0,0|2,0,0]=4 310 B8R2.24 C1CC1NC2CC2 CS-W019025 [0,0,0,2,0,0|2,0,0]=4