0 B6R0.6 C#CCNCCO CS-0661673 [0,0,0,0,0,0|1,0,3]=4 1 B6R0.6 CC#CCCCC CS-0204679 [0,0,0,0,0,0|1,0,3]=4 2 B6R0.6 CC=C=CCCO CS-0260353 [0,0,0,0,0,0|0,0,2]=2 3 B6R0.6 CCCC#CCO CS-0143648 [0,0,0,0,0,0|0,0,3]=3 4 B6R0.6 CCCCCCN CS-0214121 [0,0,0,0,0,0|1,0,2]=3 5 B6R0.6 CCCCCCN CS-0468683 [0,0,0,0,0,0|1,0,2]=3 6 B6R0.6 CCCCCNN CS-0297653 [0,0,0,0,0,0|2,0,2]=4 7 B6R0.6 CCCCOCCl CS-0517473 [0,0,0,0,0,0|2,0,2]=4 8 B6R0.6 CCCCSCC CS-0206090 [0,0,0,0,0,0|2,0,1]=3 9 B6R0.6 CCCNCCC CS-0515976 [0,0,0,0,0,0|2,0,1]=3 10 B6R0.6 CCCNCCC CS-0621747 [0,0,0,0,0,0|2,0,1]=3 11 B6R0.6 CCCOCC#N CS-0251393 [0,0,0,0,0,0|2,0,2]=4 12 B6R0.6 CCCSCCO CS-0358874 [0,0,0,0,0,0|1,0,1]=2 13 B6R0.6 CCC\C=C/CO CS-0185821 [0,0,0,0,0,0|0,0,2]=2 14 B6R0.6 CCNCCC#N CS-W011332 [0,0,0,0,0,0|2,0,2]=4 15 B6R0.6 CCNCCCO CS-0209413 [0,0,0,0,0,0|1,0,1]=2 16 B6R0.6 CCOCCC#N CS-W011329 [0,0,0,0,0,0|2,0,2]=4 17 B6R0.6 CCOCCCBr CS-0217812 [0,0,0,0,0,0|2,0,1]=3 18 B6R0.6 CCOCCCCl CS-0209053 [0,0,0,0,0,0|2,0,1]=3 19 B6R0.6 CCOCCCI CS-0252970 [0,0,0,0,0,0|2,0,1]=3 20 B6R0.6 CCOCCON CS-0308943 [0,0,0,0,0,0|3,0,1]=4 21 B6R0.6 CCSCCCO CS-0299691 [0,0,0,0,0,0|1,0,1]=2 22 B6R0.6 CC\C=C/CCBr CS-0700616 [0,0,0,0,0,0|1,0,0]=1 23 B6R0.6 COCCCCN CS-0139373 [0,0,0,0,0,0|2,0,2]=4 24 B6R0.6 COCOCCBr CS-0146691 [0,0,0,0,0,0|3,0,1]=4 25 B6R0.6 C\C=C/CCCO CS-0185820 [0,0,0,0,0,0|0,0,2]=2 26 B6R0.6 C\C=C\C=C\C=O CS-0067535 [0,0,0,0,0,0|0,0,4]=4 27 B6R0.6 C\C=C\CCCO CS-0163135 [0,0,0,0,0,0|0,0,2]=2 28 B6R0.6 C\C=C\CCCO CS-0311846 [0,0,0,0,0,0|0,0,2]=2 29 B6R0.6 ClCCNCCCl CS-0662923 [0,0,0,0,0,0|3,0,1]=4 30 B6R0.6 ClCCOCCI CS-0188318 [0,0,0,0,0,0|3,0,1]=4 31 B6R0.6 N#CCCCCO CS-W001265 [0,0,0,0,0,0|1,0,3]=4 32 B6R0.6 NCCOCCO CS-0648204 [0,0,0,0,0,0|2,0,1]=3 33 B5R0.2 C=C=CCCO CS-0246741 [1,0,0,0,0,0|0,0,2]=3 34 B5R0.2 C=CCCCN CS-0072974 [1,0,0,0,0,0|1,0,2]=4 35 B5R0.2 C=CCNCC CS-0251036 [1,0,0,0,0,0|2,0,1]=4 36 B5R0.2 CC#CCCO CS-0143647 [1,0,0,0,0,0|0,0,2]=3 37 B5R0.2 CCCCCF CS-0716626 [1,0,0,0,0,0|1,0,1]=3 38 B5R0.2 CCCCCN CS-0214092 [1,0,0,0,0,0|1,0,1]=3 39 B5R0.2 CCCCNN CS-0667621 [1,0,0,0,0,0|2,0,1]=4 40 B5R0.2 CCCCO[Ti] CS-0111516 [1,0,0,0,0,0|2,0,1]=4 41 B5R0.2 CCNCC#N CS-0250639 [1,0,0,0,0,0|2,0,1]=4 42 B5R0.2 CCNNCC CS-0343044 [1,0,0,0,0,0|2,0,0]=3 43 B5R0.2 CCSCC#N CS-0261238 [1,0,0,0,0,0|2,0,1]=4 44 B5R0.2 CCSCCBr CS-0232073 [1,0,0,0,0,0|2,0,0]=3 45 B5R0.2 CC\C=C/CO CS-0074371 [1,0,0,0,0,0|0,0,0]=1 46 B5R0.2 CC\C=C\CBr CS-0296500 [1,0,0,0,0,0|1,0,0]=2 47 B5R0.2 CNOCCN CS-W021370 [1,0,0,0,0,0|3,0,0]=4 48 B5R0.2 COCCCI CS-0236599 [1,0,0,0,0,0|2,0,1]=4 49 B5R0.2 COCCCN CS-0162830 [1,0,0,0,0,0|2,0,1]=4 50 B5R0.2 CSCCCN CS-0204914 [1,0,0,0,0,0|2,0,1]=4 51 B5R0.2 CSCCCN CS-0516616 [1,0,0,0,0,0|2,0,1]=4 52 B5R0.2 ClCCOCCl CS-W013455 [1,0,0,0,0,0|3,0,0]=4 53 B5R0.2 NCCCCN CS-0214045 [1,0,0,0,0,0|2,0,1]=4 54 B5R0.2 NCCCCN CS-0468676 [1,0,0,0,0,0|2,0,1]=4 55 B5R0.2 NNCCCO CS-0047562 [1,0,0,0,0,0|2,0,1]=4 56 B5R0.2 NOC\C=C\Cl CS-0239595 [1,0,0,0,0,0|3,0,0]=4 57 B5R0.2 OCCCCI CS-0130048 [1,0,0,0,0,0|1,0,1]=3 58 B5R0.2 OCCCCO CS-0637550 [1,0,0,0,0,0|1,0,1]=3 59 B7R0.1 CCCC#CCCO CS-0143649 [0,1,0,0,0,0|0,0,2]=3 60 B7R0.1 CCCCC#CCO CS-0040175 [0,1,0,0,0,0|0,0,3]=4 61 B7R0.1 CCCCCCCF CS-0699236 [0,1,0,0,0,0|1,0,2]=4 62 B7R0.1 CCCCNCCN CS-0204694 [0,1,0,0,0,0|1,0,2]=4 63 B7R0.1 CCCCOCCBr CS-0702257 [0,1,0,0,0,0|1,0,2]=4 64 B7R0.1 CCCCOCCCl CS-0188002 [0,1,0,0,0,0|1,0,2]=4 65 B7R0.1 CCCCSCCO CS-0313179 [0,1,0,0,0,0|0,0,2]=3 66 B7R0.1 CCCNCCC#N CS-0247666 [0,1,0,0,0,0|2,0,1]=4 67 B7R0.1 CCCNCCCO CS-0209795 [0,1,0,0,0,0|0,0,2]=3 68 B7R0.1 CCCSSCCC CS-0259501 [0,1,0,0,0,0|2,0,1]=4 69 B7R0.1 CCNCCOCC CS-0252490 [0,1,0,0,0,0|2,0,1]=4 70 B7R0.1 CCSCCSCC CS-0236098 [0,1,0,0,0,0|2,0,1]=4 71 B7R0.1 CNCCCCCO CS-0570792 [0,1,0,0,0,0|0,0,2]=3 72 B7R0.1 CNCCNCCN CS-0757275 [0,1,0,0,0,0|2,0,1]=4 73 B7R0.1 CNCCOCCN CS-0245542 [0,1,0,0,0,0|2,0,1]=4 74 B7R0.1 COCCCCCN CS-0252365 [0,1,0,0,0,0|1,0,2]=4 75 B7R0.1 COCCCCOC CS-0699044 [0,1,0,0,0,0|1,0,2]=4 76 B7R0.1 COCCNCCO CS-0217039 [0,1,0,0,0,0|1,0,1]=3 77 B7R0.1 COCCOCCS CS-0115765 [0,1,0,0,0,0|1,1,1]=4 78 B7R0.1 COCCOCCS CS-0115766 [0,1,0,0,0,0|1,1,1]=4 79 B7R0.1 C\C=C/CCCCC CS-0205053 [0,1,0,0,0,0|1,0,2]=4 80 B7R0.1 ClCCCNCCCl CS-0965060 [0,1,0,0,0,0|2,0,1]=4 81 B7R0.1 N#CC\C=C\CC#N CS-0374361 [0,1,0,0,0,0|1,0,2]=4 82 B7R0.1 NCCSCCCO CS-0724060 [0,1,0,0,0,0|1,0,1]=3 83 B7R0.1 NCCSSCCN CS-W012638 [0,1,0,0,0,0|3,0,0]=4 84 B7R0.1 NOCCOCCO CS-0108836 [0,1,0,0,0,0|2,0,1]=4 85 B7R0.1 NOCCOCCO CS-0115869 [0,1,0,0,0,0|2,0,1]=4 86 B7R0.1 OCCCNCCO CS-0073755 [0,1,0,0,0,0|1,0,1]=3 87 B7R0.1 [NH3+]CCCCCC[NH3+] CS-0468682 [0,1,0,0,0,0|1,0,2]=4 88 B7R0.3 C#CCNC(=O)CC CS-0225175 [0,1,0,0,0,0|2,0,1]=4 89 B7R0.3 C#CCOC(=O)CC CS-0464619 [0,1,0,0,0,0|2,0,1]=4 90 B7R0.3 C=CCCC(=O)CC CS-0253493 [0,1,0,0,0,0|1,0,2]=4 91 B7R0.3 CCC(=O)NCCN CS-0697791 [0,1,0,0,0,0|2,0,0]=3 92 B7R0.3 CCC(=O)NCCO CS-0449194 [0,1,0,0,0,0|1,0,0]=2 93 B7R0.3 CCC(C)NCCO CS-0239442 [0,1,0,0,0,0|1,0,1]=3 94 B7R0.3 CCCCC(Br)CC CS-0333705 [0,1,0,0,0,0|1,0,2]=4 95 B7R0.3 CCCCC(C)CO CS-0297350 [0,1,0,0,0,0|0,0,2]=3 96 B7R0.3 CCCCC(O)CC CS-0137777 [0,1,0,0,0,0|1,0,2]=4 97 B7R0.3 CCCC[C@H](N)CO CS-0089877 [0,1,0,0,0,0|0,0,2]=3 98 B7R0.3 CCCNC(=O)CBr CS-0240203 [0,1,0,0,0,0|3,0,0]=4 99 B7R0.3 CCCNC(=O)CN CS-0454285 [0,1,0,0,0,0|3,0,0]=4 100 B7R0.3 CCCOC(=O)CN CS-0727430 [0,1,0,0,0,0|3,0,0]=4 101 B7R0.3 CCN(C)CCCO CS-0215025 [0,1,0,0,0,0|1,0,1]=3 102 B7R0.3 CCOCC(O)CN CS-0128931 [0,1,0,0,0,0|2,0,1]=4 103 B7R0.3 CC[C@H](C)CCCO CS-0198766 [0,1,0,0,0,0|0,0,2]=3 104 B7R0.3 CC\C=C\C(=O)OC CS-0161339 [0,1,0,0,0,0|2,0,1]=4 105 B7R0.3 CC\C=C\C(=O)OC CS-0784965 [0,1,0,0,0,0|2,0,1]=4 106 B7R0.3 CNC(=O)CCCCl CS-0249742 [0,1,0,0,0,0|2,0,1]=4 107 B7R0.3 CNC(=O)CCCN CS-0207685 [0,1,0,0,0,0|2,0,1]=4 108 B7R0.3 CNC(=O)OCCO CS-0075093 [0,1,0,0,0,0|2,0,0]=3 109 B7R0.3 COC(=N)CCCCl CS-0309147 [0,1,0,0,0,0|2,0,1]=4 110 B7R0.3 COCO[C@H](C)CO CS-0732322 [0,1,0,0,0,0|2,0,1]=4 111 B7R0.3 CSCC[C@@H](N)CO CS-0088128 [0,1,0,0,0,0|1,0,2]=4 112 B7R0.3 NNC(=O)CCCO CS-0206368 [0,1,0,0,0,0|2,0,1]=4 113 B7R0.3 O=C(CCl)NCCCl CS-0715480 [0,1,0,0,0,0|3,0,0]=4 114 B7R0.3 OCCCC(O)CO CS-0207492 [0,1,0,0,0,0|1,0,2]=4 115 B7R0.4 CC(=O)NCCCO CS-0037159 [0,1,0,0,0,0|1,0,2]=4 116 B7R0.4 CC(=O)SCCCO CS-0570855 [0,1,0,0,0,0|1,0,2]=4 117 B7R0.4 CC(C)COCCN CS-0249793 [0,1,0,0,0,0|2,0,1]=4 118 B7R0.4 CC(C)CSCCCl CS-0224003 [0,1,0,0,0,0|2,0,1]=4 119 B7R0.4 CC(C)CSCCN CS-0308387 [0,1,0,0,0,0|2,0,1]=4 120 B7R0.4 CC(C)CSCCO CS-0452430 [0,1,0,0,0,0|1,0,1]=3 121 B7R0.4 CC(C)NCCCN CS-0320337 [0,1,0,0,0,0|2,0,1]=4 122 B7R0.4 CC(C)NCCCO CS-0451363 [0,1,0,0,0,0|1,0,1]=3 123 B7R0.4 CC(C)OCCCCl CS-0258066 [0,1,0,0,0,0|2,0,1]=4 124 B7R0.4 CC(O)CNCCN CS-0456827 [0,1,0,0,0,0|2,0,1]=4 125 B7R0.4 CC(O)CNCCO CS-M0804 [0,1,0,0,0,0|1,0,1]=3 126 B7R0.4 CCC#CCC(C)O CS-0324057 [0,1,0,0,0,0|0,0,2]=3 127 B7R0.4 CCCCCC(C)Cl CS-0040143 [0,1,0,0,0,0|1,0,2]=4 128 B7R0.4 CCCNCC(C)O CS-0465479 [0,1,0,0,0,0|1,0,1]=3 129 B7R0.4 CCOCCC(=O)O CS-0216898 [0,1,0,0,0,0|1,0,2]=4 130 B7R0.4 CCSCCC(=O)O CS-0249654 [0,1,0,0,0,0|1,0,2]=4 131 B7R0.4 C\C=C/C=C/C(=O)O CS-0747017 [0,1,0,0,0,0|0,0,3]=4 132 B7R0.4 OCCOCC(F)F CS-0234508 [0,1,0,0,0,0|2,0,1]=4 133 B7R0.7 CCCC(=O)OCCl CS-0199093 [0,1,0,0,0,0|2,0,1]=4 134 B7R0.7 CCNC(C)CCO CS-0309163 [0,1,0,0,0,0|1,0,1]=3 135 B7R0.7 CCOC(=N)CCCl CS-0681393 [0,1,0,0,0,0|2,0,0]=3 136 B7R0.7 CCOC(=S)SCC CS-0238225 [0,1,0,0,0,0|3,0,0]=4 137 B7R0.7 CN(CCN)CCO CS-0453856 [0,1,0,0,0,0|2,0,1]=4 138 B7R0.7 O=S(CCO)CCO CS-0256472 [0,1,0,0,0,0|2,0,1]=4 139 B7R1.1 BrCC1CCCO1 CS-0052243 [0,0,0,1,0,0|1,0,2]=4 140 B7R1.1 CCC1=NCCN1 CS-0206605 [0,0,0,1,0,0|2,0,0]=3 141 B7R1.1 CCC1=NCCO1 CS-W009554 [0,0,0,1,0,0|1,0,0]=2 142 B7R1.1 CCC1C=CCN1 CS-0742452 [0,0,0,1,0,0|2,0,0]=3 143 B7R1.1 CC[C@H]1CCNC1 CS-0053268 [0,0,0,1,0,0|2,0,1]=4 144 B7R1.1 CNC1=NCCS1 CS-0250614 [0,0,0,1,0,0|2,1,0]=4 145 B7R1.1 CSC1=NCCN1 CS-0150090 [0,0,0,1,0,0|3,0,0]=4 146 B7R1.1 CSC1=NCCS1 CS-W013388 [0,0,0,1,0,0|2,1,0]=4 147 B7R1.1 ClC[C@@H]1CCCN1 CS-0215002 [0,0,0,1,0,0|2,0,1]=4 148 B7R1.1 FC[C@H]1CCCN1 CS-0053502 [0,0,0,1,0,0|2,0,1]=4 149 B7R1.1 FC[C@H]1CCNC1 CS-0433415 [0,0,0,1,0,0|2,0,1]=4 150 B7R1.1 ICC1CCCO1 CS-0225833 [0,0,0,1,0,0|1,0,2]=4 151 B7R1.1 N#CC1=CCCC1 CS-0089734 [0,0,0,1,0,0|2,0,1]=4 152 B7R1.1 NCC1=CN=CO1 CS-0054595 [0,0,0,1,0,0|2,0,1]=4 153 B7R1.1 NCC1=CN=CO1 CS-W018747 [0,0,0,1,0,0|2,0,1]=4 154 B7R1.1 NCC1CC=CC1 CS-0199428 [0,0,0,1,0,0|1,0,2]=4 155 B7R1.1 NCC1CCNC1 CS-0477135 [0,0,0,1,0,0|2,0,1]=4 156 B7R1.1 NCC1CCOC1 CS-0048762 [0,0,0,1,0,0|2,0,1]=4 157 B7R1.1 NCC1OCCO1 CS-D0489 [0,0,0,1,0,0|2,0,1]=4 158 B7R1.1 NC[C@H]1CCCN1 CS-W017562 [0,0,0,1,0,0|2,0,1]=4 159 B7R1.1 NC[C@H]1CCCO1 CS-0469844 [0,0,0,1,0,0|1,0,2]=4 160 B7R1.1 OCC1=CNC=C1 CS-0342992 [0,0,0,1,0,0|1,0,2]=4 161 B7R1.1 OCC1CCNC1 CS-0048724 [0,0,0,1,0,0|1,0,1]=3 162 B7R1.1 OCC1CCNC1 CS-0155220 [0,0,0,1,0,0|1,0,1]=3 163 B7R1.1 OC[C@@H]1CCCN1 CS-0199747 [0,0,0,1,0,0|1,0,1]=3 164 B7R1.1 OC[C@H]1CCNC1 CS-0053246 [0,0,0,1,0,0|1,0,1]=3 165 B7R1.1 OC[C@H]1CCOC1 CS-0053313 [0,0,0,1,0,0|1,0,1]=3 166 B7R1.1 [C@@H]1(CO)CCNC1 CS-0044035 [0,0,0,1,0,0|1,0,1]=3 167 B7R1.3 BrC1CCNCC1 CS-0683338 [0,0,0,1,0,0|2,0,1]=4 168 B7R1.3 CB1OCCCO1 CS-0698995 [0,0,0,1,0,0|2,0,1]=4 169 B7R1.3 CN1CC=CCC1 CS-0315628 [0,0,0,1,0,0|2,0,0]=3 170 B7R1.3 C[C@@H]1CCCCN1 CS-0146588 [0,0,0,1,0,0|1,0,2]=4 171 B7R1.3 C[C@@H]1CNCCN1 CS-0170840 [0,0,0,1,0,0|2,0,1]=4 172 B7R1.3 ClC1C=CCCC1 CS-0111298 [0,0,0,1,0,0|2,0,0]=3 173 B7R1.3 NC1CCCCC1 CS-0214048 [0,0,0,1,0,0|1,0,2]=4 174 B7R1.3 NC1CCOCC1 CS-0439638 [0,0,0,1,0,0|2,0,1]=4 175 B7R1.3 N[C@H]1CCCNC1 CS-0310189 [0,0,0,1,0,0|2,0,1]=4 176 B7R1.3 OC1CCCSC1 CS-0256670 [0,0,0,1,0,0|1,0,1]=3 177 B7R1.3 OC1COCOC1 CS-0249215 [0,0,0,1,0,0|2,0,1]=4 178 B7R1.3 O[C@@H]1CCCOC1 CS-0053086 [0,0,0,1,0,0|1,0,1]=3 179 B7R1.3 SC1CCNCC1 CS-0048752 [0,0,0,1,0,0|1,1,1]=4 180 B7R1.4 CC1CCCC1N CS-0145127 [0,0,0,1,0,0|1,0,2]=4 181 B7R1.4 CC1CCCC1O CS-0464755 [0,0,0,1,0,0|0,0,2]=3 182 B7R1.4 CC1CNCC1O CS-0486549 [0,0,0,1,0,0|1,0,1]=3 183 B7R1.4 C[C@@H]1CNC[C@@H]1O CS-0184525 [0,0,0,1,0,0|1,0,1]=3 184 B7R1.4 C[C@H]1CCC[C@@H]1O CS-0036071 [0,0,0,1,0,0|0,0,2]=3 185 B7R1.4 NC1CCCC1O CS-W005452 [0,0,0,1,0,0|1,0,2]=4 186 B7R1.4 NC1CNCC1O CS-0671458 [0,0,0,1,0,0|2,0,1]=4 187 B7R1.4 NC1COCC1O CS-0112323 [0,0,0,1,0,0|2,0,1]=4 188 B7R1.4 N[C@@H]1COC[C@@H]1O CS-0049679 [0,0,0,1,0,0|2,0,1]=4 189 B7R1.4 N[C@H]1COC[C@@H]1O CS-0037840 [0,0,0,1,0,0|2,0,1]=4 190 B7R1.4 OC1CCCC1Br CS-0527053 [0,0,0,1,0,0|1,0,2]=4 191 B7R1.4 O[C@@H]1CCC[C@H]1F CS-0101190 [0,0,0,1,0,0|1,0,2]=4 192 B7R1.4 O[C@@H]1COC[C@H]1F CS-0309512 [0,0,0,1,0,0|2,0,1]=4 193 B7R1.4 O[C@@H]1COC[C@H]1O CS-0132915 [0,0,0,1,0,0|2,0,1]=4 194 B7R1.4 O[C@H]1CCC[C@H]1Cl CS-0518472 [0,0,0,1,0,0|1,0,2]=4 195 B7R1.4 O[C@H]1CNC[C@@H]1O CS-0047805 [0,0,0,1,0,0|2,0,1]=4 196 B7R1.4 O[C@H]1CNC[C@@H]1O CS-0058679 [0,0,0,1,0,0|2,0,1]=4 197 B7R1.6 COC=C1COC1 CS-0463078 [0,0,0,1,0,0|3,0,0]=4 198 B7R1.6 ClCCN1CCC1 CS-0054781 [0,0,0,1,0,0|2,0,1]=4 199 B7R1.6 OCCC1CNC1 CS-0044129 [0,0,0,1,0,0|1,0,2]=4 200 B7R1.7 BrCCCC1CO1 CS-0959492 [0,0,0,1,0,0|1,0,2]=4 201 B7R1.7 NCCNC1CC1 CS-0252702 [0,0,0,1,0,0|2,0,1]=4 202 B7R1.7 NCCOC1CC1 CS-0656225 [0,0,0,1,0,0|2,0,1]=4 203 B7R1.8 CN1CCC1CO CS-0343601 [0,0,0,1,0,0|1,0,2]=4 204 B7R1.8 CN1CC[C@H]1CO CS-0172435 [0,0,0,1,0,0|1,0,2]=4 205 B7R1.24 C1=CCOCOC1 CS-0204459 [0,0,0,1,0,0|1,0,2]=4 206 B7R1.24 C1CNCCSC1 CS-0271950 [0,0,0,1,0,0|1,1,1]=4 207 B4R0.2 C(Cl)=CCCl CS-W011274 [2,0,0,0,0,0|2,0,0]=4 208 B4R0.2 C=C=CCO CS-0239838 [2,0,0,0,0,0|0,0,2]=4 209 B4R0.2 C=CCCN CS-0227046 [2,0,0,0,0,0|1,0,0]=3 210 B4R0.2 C=CCNN CS-0038154 [2,0,0,0,0,0|2,0,0]=4 211 B4R0.2 CCCCN CS-0214095 [2,0,0,0,0,0|1,0,0]=3 212 B4R0.2 CCCC[O-] CS-0870886 [2,0,0,0,0,0|0,0,1]=3 213 B4R0.2 CCCON CS-0106185 [2,0,0,0,0,0|2,0,0]=4 214 B4R0.2 CCNCC CS-0621902 [2,0,0,0,0,0|1,0,0]=3 215 B4R0.2 CCNOC CS-0160235 [2,0,0,0,0,0|2,0,0]=4 216 B4R0.2 CCSSC CS-0343199 [2,0,0,0,0,0|2,0,0]=4 217 B4R0.2 CC\C=N\O CS-0239378 [2,0,0,0,0,0|1,0,0]=3 218 B4R0.2 CNCCF CS-0103514 [2,0,0,0,0,0|2,0,0]=4 219 B4R0.2 CNCCN CS-W003799 [2,0,0,0,0,0|2,0,0]=4 220 B4R0.2 COCCN CS-0115625 [2,0,0,0,0,0|2,0,0]=4 221 B4R0.2 COCCN CS-0214155 [2,0,0,0,0,0|2,0,0]=4 222 B4R0.2 CSCCBr CS-0208163 [2,0,0,0,0,0|2,0,0]=4 223 B4R0.2 CSCCN CS-W016668 [2,0,0,0,0,0|2,0,0]=4 224 B4R0.2 NCCCO CS-0375891 [2,0,0,0,0,0|1,0,0]=3 225 B6R0.1 C(C)=CC(=O)CC CS-W013723 [1,1,0,0,0,0|0,0,1]=3 226 B6R0.1 CC(CN)CCO CS-0264833 [1,1,0,0,0,0|1,0,1]=4 227 B6R0.1 CC(CO)CCCl CS-0858617 [1,1,0,0,0,0|1,0,1]=4 228 B6R0.1 CCC(C)CCO CS-0204814 [1,1,0,0,0,0|0,0,1]=3 229 B6R0.1 CCC(N)CCN CS-0238941 [1,1,0,0,0,0|1,0,1]=4 230 B6R0.1 CCCC(=O)CCl CS-0252325 [1,1,0,0,0,0|1,0,1]=4 231 B6R0.1 CCCC(=O)NO CS-0179704 [1,1,0,0,0,0|1,0,1]=4 232 B6R0.1 CCCC(N)CO CS-0089892 [1,1,0,0,0,0|0,0,1]=3 233 B6R0.1 CCC[C@@H](N)CO CS-0088083 [1,1,0,0,0,0|0,0,1]=3 234 B6R0.1 CCC[C@@H](N)CO CS-1181369 [1,1,0,0,0,0|0,0,1]=3 235 B6R0.1 CCNC(=O)CC CS-0205055 [1,1,0,0,0,0|1,0,0]=3 236 B6R0.1 CCNC(=O)CCl CS-0037573 [1,1,0,0,0,0|2,0,0]=4 237 B6R0.1 CCNC(=O)CI CS-0258404 [1,1,0,0,0,0|2,0,0]=4 238 B6R0.1 CCNC(=O)CN CS-0464992 [1,1,0,0,0,0|2,0,0]=4 239 B6R0.1 CCNC(=O)CO CS-0239967 [1,1,0,0,0,0|1,0,0]=3 240 B6R0.1 CCNC(C)CO CS-0298610 [1,1,0,0,0,0|1,0,0]=3 241 B6R0.1 CCOC(=N)CC CS-0047019 [1,1,0,0,0,0|1,0,0]=3 242 B6R0.1 CCOC(=N)CCl CS-0208478 [1,1,0,0,0,0|2,0,0]=4 243 B6R0.1 CCOC(=O)NO CS-0235105 [1,1,0,0,0,0|2,0,0]=4 244 B6R0.1 CCS(=O)CCCl CS-0697603 [1,1,0,0,0,0|2,0,0]=4 245 B6R0.1 CCSC(=O)CC CS-0313626 [1,1,0,0,0,0|1,0,0]=3 246 B6R0.1 CC[C@H](C)CCO CS-0198789 [1,1,0,0,0,0|0,0,1]=3 247 B6R0.1 CN(C=O)CCO CS-0315134 [1,1,0,0,0,0|2,0,0]=4 248 B6R0.1 CNC(=O)CCN CS-0665982 [1,1,0,0,0,0|2,0,0]=4 249 B6R0.1 CNC(C)CCO CS-0661493 [1,1,0,0,0,0|1,0,1]=4 250 B6R0.1 COCC(C)CO CS-0144671 [1,1,0,0,0,0|1,0,1]=4 251 B6R0.1 COCC(O)CO CS-W011295 [1,1,0,0,0,0|1,0,1]=4 252 B6R0.1 C[C@@H](CO)CCN CS-0205665 [1,1,0,0,0,0|1,0,1]=4 253 B6R0.1 C\N=C(/O)CCN CS-W007299 [1,1,0,0,0,0|2,0,0]=4 254 B6R0.1 OCC[C@@H](O)CO CS-0069613 [1,1,0,0,0,0|1,0,1]=4 255 B6R0.4 C=CCC[C@@H](C)O CS-0179239 [1,1,0,0,0,0|0,0,2]=4 256 B6R0.4 C=CCC[C@H](C)O CS-0246373 [1,1,0,0,0,0|0,0,2]=4 257 B6R0.4 CC(=O)CCCBr CS-0103669 [1,1,0,0,0,0|1,0,1]=4 258 B6R0.4 CC(=O)NCCN CS-W013694 [1,1,0,0,0,0|2,0,0]=4 259 B6R0.4 CC(=O)SCCN CS-0256575 [1,1,0,0,0,0|2,0,0]=4 260 B6R0.4 CC(=O)SCCN CS-0680538 [1,1,0,0,0,0|2,0,0]=4 261 B6R0.4 CC(C)=CCC#N CS-0665898 [1,1,0,0,0,0|1,0,1]=4 262 B6R0.4 CC(C)CCCI CS-0570782 [1,1,0,0,0,0|1,0,1]=4 263 B6R0.4 CC(C)SCCN CS-0214989 [1,1,0,0,0,0|2,0,0]=4 264 B6R0.4 CC(O)CCCCl CS-0210356 [1,1,0,0,0,0|1,0,1]=4 265 B6R0.4 CCC#CC(C)O CS-W013721 [1,1,0,0,0,0|0,0,2]=4 266 B6R0.4 CCCCC(C)Br CS-0206476 [1,1,0,0,0,0|0,0,2]=4 267 B6R0.4 CCCCC(C)Cl CS-0102663 [1,1,0,0,0,0|0,0,2]=4 268 B6R0.4 CCNCC(=O)O CS-0250575 [1,1,0,0,0,0|1,0,1]=4 269 B6R0.4 CCNCC(C)O CS-0622152 [1,1,0,0,0,0|1,0,0]=3 270 B6R0.4 CCNC[C@H](C)O CS-0670719 [1,1,0,0,0,0|1,0,0]=3 271 B6R0.4 CCOCC(C)N CS-0688785 [1,1,0,0,0,0|1,0,1]=4 272 B6R0.4 CC\C=C\B(O)O CS-0179254 [1,1,0,0,0,0|1,0,0]=3 273 B6R0.4 CC\C=C\C(C)=O CS-0782888 [1,1,0,0,0,0|0,0,1]=3 274 B6R0.4 C\C(O)=N\CCCl CS-W011197 [1,1,0,0,0,0|2,0,0]=4 275 B6R0.4 FC(F)=CCCBr CS-0206787 [1,1,0,0,0,0|2,0,0]=4 276 B6R0.4 N=C(N)NCCO CS-0261897 [1,1,0,0,0,0|2,0,0]=4 277 B6R0.4 N=C(N)SCCO CS-0243233 [1,1,0,0,0,0|2,0,0]=4 278 B6R0.4 NC(=O)CCCO CS-0678691 [1,1,0,0,0,0|1,0,1]=4 279 B6R0.4 NC(=O)OCCO CS-0218046 [1,1,0,0,0,0|2,0,0]=4 280 B6R0.4 OB(O)\C=C\CCl CS-0162303 [1,1,0,0,0,0|2,0,0]=4 281 B8R0.1 CCCNC(=O)CCN CS-0250637 [0,2,0,0,0,0|1,0,1]=4 282 B8R0.1 CCCNC(=O)CNC CS-0246714 [0,2,0,0,0,0|2,0,0]=4 283 B8R0.1 CCCOC(=O)CCN CS-0258841 [0,2,0,0,0,0|1,0,1]=4 284 B8R0.1 CCNC(=O)NCCO CS-0258450 [0,2,0,0,0,0|1,0,0]=3 285 B8R0.1 CCOC(=N)CCCBr CS-0124515 [0,2,0,0,0,0|1,0,1]=4 286 B8R0.1 CCOC(=O)CCOC CS-0217247 [0,2,0,0,0,0|1,0,0]=3 287 B8R0.1 CCOC(=O)CSCC CS-0151560 [0,2,0,0,0,0|2,0,0]=4 288 B8R0.1 CCOC(=O)NCCCl CS-0151524 [0,2,0,0,0,0|2,0,0]=4 289 B8R0.1 CCOC(=O)NCCO CS-0719448 [0,2,0,0,0,0|1,0,0]=3 290 B8R0.1 CCOC(=O)\C=C\CBr CS-0166774 [0,2,0,0,0,0|1,0,1]=4 291 B8R0.1 CCOC(=O)\C=C\CO CS-0683674 [0,2,0,0,0,0|0,0,1]=3 292 B8R0.1 CC\C=C\C(=O)OCC CS-0361328 [0,2,0,0,0,0|1,0,1]=4 293 B8R0.1 COCCN(C)CCO CS-0323795 [0,2,0,0,0,0|1,0,1]=4 294 B8R0.1 C\C=C\C(=O)CCCC CS-0504757 [0,2,0,0,0,0|1,0,1]=4 295 B8R0.1 N#CCC(=O)NCCO CS-0308621 [0,2,0,0,0,0|1,0,1]=4 296 B8R0.4 CCCCCC#CCO CS-0320711 [0,2,0,0,0,0|0,0,2]=4 297 B8R0.4 CCCCCNCCO CS-0260490 [0,2,0,0,0,0|0,0,2]=4 298 B8R0.4 CCCCCOCCO CS-0454274 [0,2,0,0,0,0|0,0,2]=4 299 B8R0.4 CCCCOCCCO CS-0772426 [0,2,0,0,0,0|0,0,2]=4 300 B8R0.4 CCCCOCCOC CS-0196688 [0,2,0,0,0,0|0,0,2]=4 301 B8R0.4 CCCC\C=C/CCO CS-0185640 [0,2,0,0,0,0|0,0,0]=2 302 B8R0.4 CCC\C=C\C=C\CO CS-0186043 [0,2,0,0,0,0|0,0,1]=3 303 B8R0.4 CCNCCOCCO CS-0238877 [0,2,0,0,0,0|0,0,2]=4 304 B8R0.4 CNCCOCCOC CS-0937383 [0,2,0,0,0,0|1,0,1]=4 305 B8R0.4 COCCCCCCBr CS-0162875 [0,2,0,0,0,0|0,0,2]=4 306 B8R0.4 COCCCCCCO CS-0771682 [0,2,0,0,0,0|0,0,2]=4 307 B8R0.4 COCCCCCOC CS-0621638 [0,2,0,0,0,0|0,0,2]=4 308 B8R0.4 COCCCNCCO CS-0235540 [0,2,0,0,0,0|0,0,2]=4 309 B8R0.4 COCCNCCCN CS-0234381 [0,2,0,0,0,0|1,0,1]=4 310 B8R0.4 COCCOCCCBr CS-0205310 [0,2,0,0,0,0|1,0,1]=4 311 B8R0.4 OCCCCCCCCl CS-0747527 [0,2,0,0,0,0|0,0,2]=4 312 B8R0.4 OCCCSCCCO CS-0440634 [0,2,0,0,0,0|0,0,2]=4 313 B8R0.6 C=C[C@@H](O)CCCCC CS-0566736 [0,2,0,0,0,0|0,0,2]=4 314 B8R0.6 CCC(C)NCCOC CS-0303607 [0,2,0,0,0,0|1,0,1]=4 315 B8R0.6 CCCCNC(=O)CC CS-0465067 [0,2,0,0,0,0|1,0,1]=4 316 B8R0.6 CCCNCC(O)CO CS-0697355 [0,2,0,0,0,0|0,0,2]=4 317 B8R0.6 CCCOCC(O)CO CS-0185759 [0,2,0,0,0,0|0,0,2]=4 318 B8R0.6 CCC\C=C\C(=O)OC CS-0166790 [0,2,0,0,0,0|1,0,1]=4 319 B8R0.6 CC[C@H](C)CCCCO CS-0198804 [0,2,0,0,0,0|0,0,2]=4 320 B8R0.6 COCCNC(=O)CCl CS-0076569 [0,2,0,0,0,0|2,0,0]=4 321 B8R0.6 COCCNC(=O)CN CS-0260223 [0,2,0,0,0,0|2,0,0]=4 322 B8R0.6 COCCOC(=O)CCl CS-0321021 [0,2,0,0,0,0|2,0,0]=4 323 B8R0.6 NCCCCC(N)CO CS-0961428 [0,2,0,0,0,0|0,0,2]=4 324 B8R0.6 NCCCC[C@H](N)CO CS-0158356 [0,2,0,0,0,0|0,0,2]=4 325 B8R0.6 NCCNCC(O)CO CS-0134587 [0,2,0,0,0,0|1,0,1]=4 326 B8R0.6 OCCOCC(O)CO CS-0758146 [0,2,0,0,0,0|1,0,1]=4 327 B8R0.7 CC(C)CCNCCO CS-0263334 [0,2,0,0,0,0|0,0,2]=4 328 B8R0.7 CC(O)CCCCCO CS-1161432 [0,2,0,0,0,0|0,0,2]=4 329 B8R0.7 CCCSCCC(=O)O CS-0259094 [0,2,0,0,0,0|1,0,1]=4 330 B8R0.7 CCC\C=C\CC(=O)O CS-0185675 [0,2,0,0,0,0|0,0,1]=3 331 B8R0.7 CCOCCCC(=O)O CS-0248539 [0,2,0,0,0,0|1,0,1]=4 332 B8R0.7 COCCNCC(C)C CS-0246575 [0,2,0,0,0,0|1,0,1]=4 333 B8R0.3 CCCC(=O)C(=O)OC CS-0185771 [0,2,0,0,0,0|2,0,0]=4 334 B8R0.3 CCCC(=O)C(C)CC CS-0205164 [0,2,0,0,0,0|1,0,1]=4 335 B8R0.3 CCOC(=O)C(C)CBr CS-0265062 [0,2,0,0,0,0|2,0,0]=4 336 B8R0.3 CCOC(=O)C(C)CN CS-0307929 [0,2,0,0,0,0|2,0,0]=4 337 B8R0.3 CCOC(=O)[C@H](N)CC CS-0260968 [0,2,0,0,0,0|2,0,0]=4 338 B8R0.8 CC(C)C(=O)NCCN CS-0258564 [0,2,0,0,0,0|2,0,0]=4 339 B8R0.8 CC(O)C(=O)NCCO CS-0153945 [0,2,0,0,0,0|1,0,0]=3 340 B8R0.8 CCCCC(=O)[C@H](C)N CS-0152397 [0,2,0,0,0,0|1,0,1]=4 341 B8R0.8 CCCNC(=O)C(C)Cl CS-0241506 [0,2,0,0,0,0|2,0,0]=4 342 B8R0.8 CCCNC(=O)C(C)N CS-0231050 [0,2,0,0,0,0|2,0,0]=4 343 B8R0.8 CCCOC(=O)C(C)Cl CS-0263294 [0,2,0,0,0,0|2,0,0]=4 344 B8R0.8 CCCOC(=O)[C@H](C)N CS-0538737 [0,2,0,0,0,0|2,0,0]=4 345 B8R0.8 CCCOC(=O)[C@H](C)O CS-0238611 [0,2,0,0,0,0|2,0,0]=4 346 B8R0.9 CC(C)NC[C@@H](O)CO CS-0680205 [0,2,0,0,0,0|1,0,1]=4 347 B8R0.9 CC(C)NC[C@H](O)CO CS-0677844 [0,2,0,0,0,0|1,0,1]=4 348 B8R0.9 CCC(=O)NCC(C)C CS-0152594 [0,2,0,0,0,0|2,0,0]=4 349 B8R0.9 CC\C(C)=C\CC(=O)O CS-W022219 [0,2,0,0,0,0|0,0,1]=3 350 B8R0.11 CCC\C=C(\CC)CO CS-0699177 [0,2,0,0,0,0|1,0,0]=3 351 B8R0.25 CCS(=O)(=O)CCCO CS-0210148 [0,2,0,0,0,0|1,0,1]=4 352 B8R0.5 C=C(CCC)CC(=O)O CS-0698502 [0,2,0,0,0,0|0,0,2]=4 353 B8R0.5 CC(C)C[C@H](N)CCO CS-0572887 [0,2,0,0,0,0|0,0,2]=4 354 B8R0.5 CC(C)NC(=O)CCCl CS-0246585 [0,2,0,0,0,0|2,0,0]=4 355 B8R0.5 CC(C)NC(=O)CCN CS-0249002 [0,2,0,0,0,0|2,0,0]=4 356 B8R0.5 CC(C)OC(=O)CCBr CS-0749273 [0,2,0,0,0,0|2,0,0]=4 357 B8R0.5 CC(C)OC(=O)CCN CS-0241136 [0,2,0,0,0,0|2,0,0]=4 358 B8R0.5 CCCC(=O)CC(C)C CS-0454369 [0,2,0,0,0,0|1,0,1]=4 359 B8R0.5 CCOC(=N)CC(C)C CS-0039985 [0,2,0,0,0,0|2,0,0]=4 360 B8R0.5 CCOC(=O)CC(C)N CS-0376333 [0,2,0,0,0,0|2,0,0]=4 361 B8R0.21 CC(C)(C)SCCCO CS-0231946 [0,2,0,0,0,0|1,0,1]=4 362 B8R0.21 CCCNCC(C)(C)O CS-0258270 [0,2,0,0,0,0|1,0,1]=4 363 B8R0.28 CC(C)=CCC[C@H](C)O CS-0877163 [0,2,0,0,0,0|0,0,2]=4 364 B8R0.28 CC(C)CCCC(C)O CS-0274181 [0,2,0,0,0,0|0,0,2]=4 365 B8R0.28 CC(C)\C=C\CC(=O)O CS-0154348 [0,2,0,0,0,0|0,0,1]=3 366 B8R0.22 CCCC(CN)CCO CS-0264864 [0,2,0,0,0,0|0,0,2]=4 367 B6R1.1 C1=COCCO1 CS-0465803 [1,0,0,1,0,0|1,0,1]=4 368 B6R1.1 C1CNCCN1 CS-0210526 [1,0,0,1,0,0|2,0,0]=4 369 B6R1.1 C1CNCOC1 CS-W007123 [1,0,0,1,0,0|1,0,1]=4 370 B6R1.1 C1COCCN1 CS-0214064 [1,0,0,1,0,0|1,0,0]=3 371 B6R1.1 C1COCCN1 CS-0214146 [1,0,0,1,0,0|1,0,0]=3 372 B6R1.1 C1COCOC1 CS-0331949 [1,0,0,1,0,0|1,0,1]=4 373 B6R1.2 BrC1=CCCC1 CS-0205606 [1,0,0,1,0,0|2,0,0]=4 374 B6R1.2 BrC1CCNC1 CS-0256433 [1,0,0,1,0,0|2,0,0]=4 375 B6R1.2 BrC1CCSC1 CS-0242008 [1,0,0,1,0,0|2,0,0]=4 376 B6R1.2 CC1=NCCN1 CS-0282476 [1,0,0,1,0,0|2,0,0]=4 377 B6R1.2 CC1=NCCS1 CS-W013704 [1,0,0,1,0,0|1,1,0]=4 378 B6R1.2 CC1CCCN1 CS-0051829 [1,0,0,1,0,0|1,0,1]=4 379 B6R1.2 CC1CCCS1 CS-0207040 [1,0,0,1,0,0|0,1,1]=4 380 B6R1.2 ClC1=CCCC1 CS-0204701 [1,0,0,1,0,0|2,0,0]=4 381 B6R1.2 Cl[C@@H]1CCNC1 CS-0445255 [1,0,0,1,0,0|2,0,0]=4 382 B6R1.2 IC1CCNC1 CS-0058319 [1,0,0,1,0,0|2,0,0]=4 383 B6R1.2 IC1ccCC1 CS-0873862 [1,0,0,1,0,0|1,0,0]=3 384 B6R1.2 N=C1NCCO1 CS-0265648 [1,0,0,1,0,0|2,0,0]=4 385 B6R1.2 NC1=NCCO1 CS-0186913 [1,0,0,1,0,0|2,0,0]=4 386 B6R1.2 NC1CCSC1 CS-0184405 [1,0,0,1,0,0|2,0,0]=4 387 B6R1.2 N[C@H]1CCOC1 CS-0053253 [1,0,0,1,0,0|2,0,0]=4 388 B6R1.2 OC1CCCO1 CS-0197674 [1,0,0,1,0,0|1,0,1]=4 389 B6R1.2 O[C@@H]1CNOC1 CS-0060090 [1,0,0,1,0,0|2,0,0]=4 390 B6R1.2 [C@H]1(C)CCCN1 CS-W005764 [1,0,0,1,0,0|1,0,1]=4 391 B6R1.2 [C@H]1(N)CCNC1 CS-W017772 [1,0,0,1,0,0|2,0,0]=4 392 B6R1.3 BrCCC1CC1 CS-0053533 [1,0,0,1,0,0|1,0,1]=4 393 B6R1.3 BrCC[C@H]1CO1 CS-0158425 [1,0,0,1,0,0|1,0,1]=4 394 B6R1.3 OCCC1CO1 CS-0057153 [1,0,0,1,0,0|1,0,1]=4 395 B6R1.4 C[C@@H]1NC[C@H]1F CS-0433518 [1,0,0,1,0,0|2,0,0]=4 396 B6R1.4 C[C@@H]1NC[C@H]1O CS-0045456 [1,0,0,1,0,0|1,0,0]=3 397 B6R1.4 C[C@H]1NC[C@@H]1F CS-0478353 [1,0,0,1,0,0|2,0,0]=4 398 B6R1.4 C[C@H]1NC[C@@H]1O CS-0045457 [1,0,0,1,0,0|1,0,0]=3 399 B6R1.4 C[C@H]1NC[C@H]1O CS-0045459 [1,0,0,1,0,0|1,0,0]=3 400 B6R1.4 C[C@H]1NC[C@H]1O CS-0368655 [1,0,0,1,0,0|1,0,0]=3 401 B6R1.6 NCC1CCN1 CS-0005437 [1,0,0,1,0,0|2,0,0]=4 402 B6R1.6 OCC1CNC1 CS-0045522 [1,0,0,1,0,0|1,0,1]=4 403 B6R1.6 OCC1COC1 CS-W004925 [1,0,0,1,0,0|1,0,1]=4 404 B6R1.6 OC[C@@H]1CCN1 CS-W018891 [1,0,0,1,0,0|1,0,0]=3 405 B6R1.6 OC[C@H]1CCO1 CS-0120764 [1,0,0,1,0,0|1,0,0]=3 406 B6R1.8 CC1CC1CN CS-0248472 [1,0,0,1,0,0|1,0,1]=4 407 B6R1.8 OC[C@@H]1C[C@H]1F CS-0447822 [1,0,0,1,0,0|1,0,1]=4 408 B8R1.2 CCC1COCCN1 CS-0715614 [0,1,0,1,0,0|1,0,1]=4 409 B8R1.2 COC1=CCC=CC1 CS-0204293 [0,1,0,1,0,0|0,0,2]=4 410 B8R1.2 COC1CCCCC1 CS-0361650 [0,1,0,1,0,0|0,0,2]=4 411 B8R1.2 CO[C@@H]1CCCNC1 CS-0053324 [0,1,0,1,0,0|1,0,1]=4 412 B8R1.2 ClCC1CCCCO1 CS-0204782 [0,1,0,1,0,0|0,0,2]=4 413 B8R1.2 ClCC1CNCCO1 CS-0692221 [0,1,0,1,0,0|1,0,1]=4 414 B8R1.2 ICC1COCCO1 CS-0071504 [0,1,0,1,0,0|1,0,1]=4 415 B8R1.2 N#CC1=COCCO1 CS-0071728 [0,1,0,1,0,0|1,0,1]=4 416 B8R1.2 NCC1CCCCO1 CS-0041578 [0,1,0,1,0,0|0,0,2]=4 417 B8R1.2 NCC1CCCCO1 CS-0205807 [0,1,0,1,0,0|0,0,2]=4 418 B8R1.2 OC[C@@H]1CCCCN1 CS-0309833 [0,1,0,1,0,0|0,0,2]=4 419 B8R1.2 ONC1CCCCC1 CS-0155322 [0,1,0,1,0,0|0,0,2]=4 420 B8R1.5 CC1CCCOC1=O CS-0440412 [0,1,0,1,0,0|2,0,0]=4 421 B8R1.5 CC1CCNCC1O CS-0050805 [0,1,0,1,0,0|0,0,2]=4 422 B8R1.5 CC1CNCCC1O CS-W006376 [0,1,0,1,0,0|0,0,2]=4 423 B8R1.5 CC1SCCNC1=O CS-0006425 [0,1,0,1,0,0|1,1,0]=4 424 B8R1.5 C[C@@H]1CCCC[C@H]1O CS-0886871 [0,1,0,1,0,0|0,0,2]=4 425 B8R1.5 N[C@@H]1COCC[C@H]1O CS-0801126 [0,1,0,1,0,0|1,0,1]=4 426 B8R1.5 N[C@H]1CCCC[C@H]1O CS-0030060 [0,1,0,1,0,0|0,0,2]=4 427 B8R1.5 N[C@H]1CCOC[C@@H]1O CS-0053298 [0,1,0,1,0,0|1,0,1]=4 428 B8R1.5 N[C@H]1CCOC[C@H]1O CS-0053229 [0,1,0,1,0,0|1,0,1]=4 429 B8R1.5 N[C@H]1COCC[C@@H]1O CS-0047794 [0,1,0,1,0,0|1,0,1]=4 430 B8R1.5 N[C@H]1COCC[C@@H]1O CS-0053233 [0,1,0,1,0,0|1,0,1]=4 431 B8R1.5 N[C@H]1COCC[C@@H]1O CS-0927382 [0,1,0,1,0,0|1,0,1]=4 432 B8R1.5 O[C@@H]1CCCC[C@H]1Br CS-0247917 [0,1,0,1,0,0|0,0,2]=4 433 B8R1.5 O[C@@H]1CCCC[C@H]1F CS-0101188 [0,1,0,1,0,0|0,0,2]=4 434 B8R1.5 O[C@@H]1CCCC[C@H]1F CS-0101192 [0,1,0,1,0,0|0,0,2]=4 435 B8R1.5 O[C@@H]1CCNC[C@H]1O CS-0047738 [0,1,0,1,0,0|1,0,1]=4 436 B8R1.5 O[C@@H]1CNCC[C@H]1F CS-0863968 [0,1,0,1,0,0|1,0,1]=4 437 B8R1.5 O[C@H]1CCNC[C@@H]1O CS-0491320 [0,1,0,1,0,0|1,0,1]=4 438 B8R1.8 CCCC1=NCCO1 CS-0147317 [0,1,0,1,0,0|0,0,1]=3 439 B8R1.8 CCCC1C=CCN1 CS-0297312 [0,1,0,1,0,0|2,0,0]=4 440 B8R1.8 CCNC1CCOC1 CS-0048813 [0,1,0,1,0,0|1,0,1]=4 441 B8R1.8 CCOC1=NCCC1 CS-0207567 [0,1,0,1,0,0|1,0,1]=4 442 B8R1.8 CNCC1=CC=CO1 CS-0070074 [0,1,0,1,0,0|0,0,2]=4 443 B8R1.8 CNCC1CCCO1 CS-0145097 [0,1,0,1,0,0|0,0,2]=4 444 B8R1.8 CNCC1OCCO1 CS-0204729 [0,1,0,1,0,0|1,0,1]=4 445 B8R1.8 COCC1CCCN1 CS-0036150 [0,1,0,1,0,0|1,0,1]=4 446 B8R1.8 COC[C@@H]1CCNC1 CS-0053335 [0,1,0,1,0,0|1,0,1]=4 447 B8R1.8 COC[C@H]1CCCN1 CS-0172532 [0,1,0,1,0,0|1,0,1]=4 448 B8R1.8 ICCC1OCCO1 CS-0433339 [0,1,0,1,0,0|1,0,1]=4 449 B8R1.8 N#CCC1=CCCC1 CS-0186442 [0,1,0,1,0,0|1,0,1]=4 450 B8R1.8 N#C\C=C1\CCOC1 CS-0246761 [0,1,0,1,0,0|1,0,1]=4 451 B8R1.8 NCCC1CCCO1 CS-0286564 [0,1,0,1,0,0|0,0,2]=4 452 B8R1.8 NCCC1CCCO1 CS-0467451 [0,1,0,1,0,0|0,0,2]=4 453 B8R1.8 NCCC1OCCO1 CS-0205328 [0,1,0,1,0,0|1,0,1]=4 454 B8R1.8 OCCC1=CC=CO1 CS-0047160 [0,1,0,1,0,0|0,0,2]=4 455 B8R1.8 OCCC1=CNN=C1 CS-0129616 [0,1,0,1,0,0|1,0,1]=4 456 B8R1.8 OCCC1=COC=C1 CS-0040854 [0,1,0,1,0,0|0,0,2]=4 457 B8R1.8 OCCC1=NC=CN1 CS-W005588 [0,1,0,1,0,0|1,0,1]=4 458 B8R1.8 OCCC1CCNC1 CS-0052204 [0,1,0,1,0,0|0,0,2]=4 459 B8R1.8 OCCN1C=CC=C1 CS-W016621 [0,1,0,1,0,0|0,0,2]=4 460 B8R1.8 OCCN1CCC=N1 CS-0239628 [0,1,0,1,0,0|1,0,0]=3 461 B8R1.10 OCCCN1CCC1 CS-D0260 [0,1,0,1,0,0|0,0,2]=4 462 B8R1.11 CC1=C(CO)C=CO1 CS-0260838 [0,1,0,1,0,0|0,0,2]=4 463 B8R1.11 CC1=C(CO)OC=C1 CS-0239946 [0,1,0,1,0,0|0,0,2]=4 464 B8R1.11 CC1=C(CO)SC=C1 CS-0232586 [0,1,0,1,0,0|0,0,2]=4 465 B8R1.11 CO[C@@H]1CCC[C@H]1O CS-0473355 [0,1,0,1,0,0|0,0,2]=4 466 B8R1.11 CO[C@H]1CCC[C@@H]1O CS-0287097 [0,1,0,1,0,0|0,0,2]=4 467 B8R1.11 CO[C@H]1CNC[C@@H]1O CS-0184524 [0,1,0,1,0,0|1,0,1]=4 468 B8R1.11 O=C1CCCN1CO CS-0216990 [0,1,0,1,0,0|1,0,1]=4 469 B8R1.12 OCC1CCC1CO CS-0369550 [0,1,0,1,0,0|0,0,2]=4 470 B8R1.12 OC[C@@H]1CC[C@H]1CO CS-0147675 [0,1,0,1,0,0|0,0,2]=4 471 B8R1.12 OC[C@H]1CC[C@H]1CO CS-0129397 [0,1,0,1,0,0|0,0,2]=4 472 B8R1.13 O=C1CCC1CCCl CS-0474223 [0,1,0,1,0,0|1,0,1]=4 473 B8R1.22 O=C1CCOCCO1 CS-0205374 [0,1,0,1,0,0|1,0,0]=3 474 B8R1.22 OC1CCCNCC1 CS-0053742 [0,1,0,1,0,0|0,0,2]=4 475 B8R1.22 OC1CNCCOC1 CS-0341556 [0,1,0,1,0,0|1,0,1]=4 476 B8R1.22 O[C@@H]1CCCCNC1 CS-0464646 [0,1,0,1,0,0|0,0,2]=4 477 B8R1.22 O[C@@H]1CCCNCC1 CS-0341837 [0,1,0,1,0,0|0,0,2]=4 478 B8R1.22 O[C@H]1CCCCNC1 CS-0340118 [0,1,0,1,0,0|0,0,2]=4 479 B8R1.22 S=C1CCCCCN1 CS-W016412 [0,1,0,1,0,0|2,0,0]=4 480 B8R1.36 BrCCCCC1CO1 CS-0764850 [0,1,0,1,0,0|0,0,2]=4 481 B8R1.36 COCCNC1CC1 CS-0249212 [0,1,0,1,0,0|1,0,1]=4 482 B8R1.36 OCCNCC1CC1 CS-0251553 [0,1,0,1,0,0|0,0,2]=4 483 B8R1.49 C1=CCCC=CCC1 CS-0035176 [0,1,0,1,0,0|1,0,0]=3 484 B8R1.49 C1=CCCC=CCC1 CS-0035192 [0,1,0,1,0,0|1,0,0]=3 485 B8R1.49 C1=CCCC=CCC1 CS-0082633 [0,1,0,1,0,0|1,0,0]=3 486 B8R1.49 C1=CCCC=CCC1 CS-0082930 [0,1,0,1,0,0|1,0,0]=3 487 B8R1.49 C1=CCCC=CCC1 CS-0085868 [0,1,0,1,0,0|1,0,0]=3 488 B8R1.49 C1=CCCC=CCC1 CS-0087377 [0,1,0,1,0,0|1,0,0]=3 489 B8R1.49 C1=CCCC=CCC1 CS-0187327 [0,1,0,1,0,0|1,0,0]=3 490 B8R1.1 CCC1=CC(O)=NO1 CS-0152522 [0,1,0,1,0,0|1,0,1]=4 491 B8R1.1 CCC1=CC=C(C)O1 CS-0333891 [0,1,0,1,0,0|0,0,2]=4 492 B8R1.1 CCC1CCC(=O)C1 CS-0206422 [0,1,0,1,0,0|1,0,1]=4 493 B8R1.1 CCN1CCC(O)C1 CS-W016601 [0,1,0,1,0,0|1,0,1]=4 494 B8R1.1 O=C1CCC(CI)N1 CS-0511747 [0,1,0,1,0,0|2,0,0]=4 495 B8R1.1 O=C1CC[C@H](CO)O1 CS-0046919 [0,1,0,1,0,0|1,0,0]=3 496 B8R1.1 O=C1C[C@@H](CO)CN1 CS-0471469 [0,1,0,1,0,0|1,0,1]=4 497 B8R1.1 O=C1NCC(CO)N1 CS-1009826 [0,1,0,1,0,0|2,0,0]=4 498 B8R1.1 OC[C@@H]1C[C@H](O)CN1 CS-0184493 [0,1,0,1,0,0|1,0,1]=4 499 B8R1.3 CC1C=CC(=O)CC1 CS-0051212 [0,1,0,1,0,0|1,0,1]=4 500 B8R1.3 CN1CC=C(Br)CC1 CS-0696146 [0,1,0,1,0,0|2,0,0]=4 501 B8R1.3 C[C@@H]1CO[C@H](C)CN1 CS-0245663 [0,1,0,1,0,0|1,0,1]=4 502 B8R1.3 C[C@H]1CN[C@H](C)CO1 CS-0040651 [0,1,0,1,0,0|1,0,1]=4 503 B8R1.3 O=C1CCC(Br)CC1 CS-0139183 [0,1,0,1,0,0|1,0,1]=4 504 B8R1.3 O=C1CC[C@@H](O)CN1 CS-D0041 [0,1,0,1,0,0|1,0,0]=3 505 B8R1.3 O=C1NCC(O)CN1 CS-0149711 [0,1,0,1,0,0|2,0,0]=4 506 B8R1.3 [C@H]1(N)CCC(O)=NC1 CS-W006881 [0,1,0,1,0,0|2,0,0]=4 507 B8R1.38 NC(CO)C1CCC1 CS-0719506 [0,1,0,1,0,0|0,0,2]=4 508 B8R1.40 NC(CO)CC1CC1 CS-0091357 [0,1,0,1,0,0|0,0,2]=4 509 B8R1.50 CN1C(=O)CCC1O CS-W000536 [0,1,0,1,0,0|1,0,1]=4 510 B8R1.52 CC1(CO)CCCN1 CS-0146156 [0,1,0,1,0,0|1,0,1]=4 511 B8R1.52 CC1(CO)CCOC1 CS-0055404 [0,1,0,1,0,0|1,0,1]=4 512 B8R1.52 C[C@@]1(CO)CCCN1 CS-0053062 [0,1,0,1,0,0|1,0,1]=4 513 B8R1.52 NC1(CO)CCCC1 CS-0146522 [0,1,0,1,0,0|0,0,2]=4 514 B8R1.4 CC1CCCC(=O)C1 CS-W011266 [0,1,0,1,0,0|1,0,1]=4 515 B8R1.4 CC1CCCC(O)C1 CS-W011243 [0,1,0,1,0,0|0,0,2]=4 516 B8R1.4 CC1CNCC(C)O1 CS-0187731 [0,1,0,1,0,0|1,0,1]=4 517 B8R1.4 CN1CCC=C(Br)C1 CS-W001547 [0,1,0,1,0,0|2,0,0]=4 518 B8R1.4 CN1CCC[C@H](O)C1 CS-0053281 [0,1,0,1,0,0|1,0,1]=4 519 B8R1.4 C[C@@H]1CCCC(=O)C1 CS-0217860 [0,1,0,1,0,0|1,0,1]=4 520 B8R1.4 C[C@@H]1CCC[C@H](O)C1 CS-0474738 [0,1,0,1,0,0|0,0,2]=4 521 B8R1.4 C[C@@H]1C[C@@H](O)CCO1 CS-0858466 [0,1,0,1,0,0|0,0,2]=4 522 B8R1.4 C[C@H]1C[C@@H](O)CCO1 CS-0183100 [0,1,0,1,0,0|0,0,2]=4 523 B8R1.4 NC1CCCC(=O)C1 CS-0055078 [0,1,0,1,0,0|1,0,1]=4 524 B8R1.4 NC1CCCC(=O)C1 CS-0464639 [0,1,0,1,0,0|1,0,1]=4 525 B8R1.4 NC1CCN=C(O)C1 CS-W005407 [0,1,0,1,0,0|2,0,0]=4 526 B8R1.4 N[C@@H]1CCC[C@H](O)C1 CS-0058729 [0,1,0,1,0,0|0,0,2]=4 527 B8R1.4 O=C1CCCC(O)C1 CS-0051335 [0,1,0,1,0,0|0,0,1]=3 528 B8R1.4 O[C@H]1CCC[C@@H](O)C1 CS-0135348 [0,1,0,1,0,0|0,0,2]=4 529 B8R1.6 CCCN1CC(O)C1 CS-0308809 [0,1,0,1,0,0|1,0,1]=4 530 B8R1.7 CC(=O)C1=CCCC1 CS-0272100 [0,1,0,1,0,0|1,0,1]=4 531 B8R1.7 CC(C)C1=NCCO1 CS-0321419 [0,1,0,1,0,0|1,0,0]=3 532 B8R1.7 CC(N)C1=CC=CO1 CS-0030195 [0,1,0,1,0,0|0,0,2]=4 533 B8R1.7 CC(N)C1CCCO1 CS-0091427 [0,1,0,1,0,0|0,0,2]=4 534 B8R1.7 CC(N)C1CCCO1 CS-0244871 [0,1,0,1,0,0|0,0,2]=4 535 B8R1.7 C[C@@H](O)C1=CC=CO1 CS-0158192 [0,1,0,1,0,0|0,0,2]=4 536 B8R1.7 C[C@H](N)C1=CC=CO1 CS-0962538 [0,1,0,1,0,0|0,0,2]=4 537 B8R1.7 C[C@H](N)C1CCCO1 CS-0266756 [0,1,0,1,0,0|0,0,2]=4 538 B8R1.7 C[C@H](O)C1=CC=CO1 CS-0260782 [0,1,0,1,0,0|0,0,2]=4 539 B8R1.19 CC1(C)CNCC1O CS-0136464 [0,1,0,1,0,0|1,0,1]=4 540 B8R1.35 CC(O)CNC1CC1 CS-0243796 [0,1,0,1,0,0|1,0,1]=4 541 B8R1.72 C[C@]1(O)CCCNC1 CS-0184500 [0,1,0,1,0,0|1,0,1]=4 542 B8R1.72 FC1(F)CC=CCC1 CS-0771654 [0,1,0,1,0,0|1,0,0]=3 543 B8R1.18 CC1=CC(=O)CC1C CS-0186737 [0,1,0,1,0,0|1,0,1]=4 544 B8R1.18 CC1=CC(=O)OC1O CS-0050459 [0,1,0,1,0,0|1,0,1]=4 545 B8R1.37 CCCC(=O)C1CC1 CS-0183635 [0,1,0,1,0,0|1,0,1]=4 546 B8R2.34 C1=CC2C=CC1C2 CS-0635025 [0,0,0,2,0,0|1,0,1]=4 547 B8R2.34 C1=CC2CC1CN2 CS-0049772 [0,0,0,2,0,0|1,0,0]=3 548 B8R2.34 C1OC2CNC1C2 CS-0051828 [0,0,0,2,0,0|1,0,1]=4 549 B8R2.34 C1O[C@@H]2CN[C@H]1C2 CS-0053548 [0,0,0,2,0,0|1,0,1]=4 550 B8R2.34 C1O[C@H]2CN[C@@H]1C2 CS-0053606 [0,0,0,2,0,0|1,0,1]=4 551 B8R2.34 C1O[C@H]2CN[C@@H]1C2 CS-0058732 [0,0,0,2,0,0|1,0,1]=4 552 B8R2.18 OC1CC2OC2C1 CS-0771546 [0,0,0,2,0,0|1,0,1]=4 553 B8R2.18 [C@H]12C[C@@H](O)C[C@H]1C2 CS-0054512 [0,0,0,2,0,0|0,0,2]=4