0 B5R0.2 BrCCCCBr 1100-9-14 [0,0,0,0,0,0|3,0,0]=3 1 B5R0.2 C#CCCC#N 3537-1-X0 [0,0,0,0,0,0|1,0,3]=4 2 B5R0.2 C#CCCCC 1500-1-X2 [0,0,0,0,0,0|2,0,1]=3 3 B5R0.2 C#CCCCCl 1500-5-X0 [0,0,0,0,0,0|2,0,1]=3 4 B5R0.2 C#CCCCO 2501-1-01 [0,0,0,0,0,0|2,0,1]=3 5 B5R0.2 C=CCCCBr 1300-9-13 [0,0,0,0,0,0|2,0,1]=3 6 B5R0.2 C=CCCCC 1300-1-48 [0,0,0,0,0,0|2,0,1]=3 7 B5R0.2 CCC#CCC 1500-1-09 [0,0,0,0,0,0|2,0,2]=4 8 B5R0.2 CCC#CCO 2501-1-13 [0,0,0,0,0,0|2,0,2]=4 9 B5R0.2 CCCCC=O 2115-1-00 [0,0,0,0,0,0|2,0,1]=3 10 B5R0.2 CCCCCC 1100-1-18 [0,0,0,0,0,0|2,0,0]=2 11 B5R0.2 CCCCCF 1100-3-65 [0,0,0,0,0,0|2,0,0]=2 12 B5R0.2 CCCCCN 3130-1-X6 [0,0,0,0,0,0|1,0,0]=1 13 B5R0.2 CCCN=C=S 7168-1-26 [0,0,0,0,0,0|3,0,1]=4 14 B5R0.2 CCNCCN 3130-1-X2 [0,0,0,0,0,0|2,0,0]=2 15 B5R0.2 CCSCCCl 5166-5-01 [0,0,0,0,0,0|3,0,0]=3 16 B5R0.2 CNCCNC 3131-1-17 [0,0,0,0,0,0|3,0,0]=3 17 B5R0.2 COCCCBr 2107-9-02 [0,0,0,0,0,0|1,1,0]=2 18 B5R0.2 COCCOC 2108-1-00 [0,0,0,0,0,0|2,1,0]=3 19 B5R0.2 COCN=C=S 8168-1-17 [0,0,0,0,0,0|2,1,1]=4 20 B5R0.2 CSCCCN 8166-1-X3 [0,0,0,0,0,0|0,0,0]=0 21 B5R0.2 ClCCCCI 1100-M-14 [0,0,0,0,0,0|3,0,0]=3 22 B5R0.2 FCCCCBr 1100-B-22 [0,0,0,0,0,0|3,0,0]=3 23 B5R0.2 ICCCCI 1100-H-14 [0,0,0,0,0,0|3,0,0]=3 24 B5R0.2 O=C=NCCCl 4149-5-X0 [0,0,0,0,0,0|4,0,0]=4 25 B5R0.2 OCCCCF 2101-3-1V [0,0,0,0,0,0|3,0,0]=3 26 B5R0.2 S=C=NCCBr 7168-9-01 [0,0,0,0,0,0|4,0,0]=4 27 B5R0.2 S=C=NCCCl 7168-5-01 [0,0,0,0,0,0|4,0,0]=4 28 B5R0.2 SCCCCS 5161-1-05 [0,0,0,0,0,0|3,0,0]=3 29 B4R0.2 BrCCCBr 1100-9-13 [1,0,0,0,0,0|2,0,0]=3 30 B4R0.2 C#CCCC 1500-1-X1 [1,0,0,0,0,0|1,0,1]=3 31 B4R0.2 C#CCCO P311-A-35 [1,0,0,0,0,0|1,0,2]=4 32 B4R0.2 C#COCC 2507-1-01 [1,0,0,0,0,0|2,0,1]=4 33 B4R0.2 C=CCCBr 1300-9-04 [1,0,0,0,0,0|1,0,2]=4 34 B4R0.2 C=CCCC 1300-1-09 [1,0,0,0,0,0|1,0,1]=3 35 B4R0.2 CC#CCBr 1500-9-X1 [1,0,0,0,0,0|1,0,2]=4 36 B4R0.2 CC#CCO 2501-1-04 [1,0,0,0,0,0|1,0,2]=4 37 B4R0.2 CCCC#N 3137-1-Y3 [1,0,0,0,0,0|0,0,2]=3 38 B4R0.2 CCCCBr 1100-9-15 [1,0,0,0,0,0|1,0,0]=2 39 B4R0.2 CCCCF 1100-3-32 [1,0,0,0,0,0|1,0,0]=2 40 B4R0.2 CCNCC 3133-5-06 [1,0,0,0,0,0|2,0,0]=3 41 B4R0.2 CCOCC 6160-3-09 [1,0,0,0,0,0|2,0,0]=3 42 B4R0.2 CCOCCl 2107-5-01 [1,0,0,0,0,0|2,0,0]=3 43 B4R0.2 CNCCCl 3133-5-05 [1,0,0,0,0,0|2,0,0]=3 44 B4R0.2 CNCCN 3131-1-11 [1,0,0,0,0,0|1,0,0]=2 45 B4R0.2 CNCCO 4156-1-3Y [1,0,0,0,0,0|2,0,0]=3 46 B4R0.2 COCC#N 4137-1-Y6 [1,0,0,0,0,0|0,1,2]=4 47 B4R0.2 COCCBr 2107-9-X1 [1,0,0,0,0,0|1,1,0]=3 48 B4R0.2 COCCCl 2107-5-0R [1,0,0,0,0,0|1,1,0]=3 49 B4R0.2 COCCN 4130-1-X3 [1,0,0,0,0,0|0,1,0]=2 50 B4R0.2 COCOC 2108-1-07 [1,0,0,0,0,0|1,1,0]=3 51 B4R0.2 CSCCN 7166-1-X1 [1,0,0,0,0,0|0,0,0]=1 52 B4R0.2 C\C=C\CC 1300-1-05 [1,0,0,0,0,0|1,0,1]=3 53 B4R0.2 ClCCCCl 1100-5-19 [1,0,0,0,0,0|2,0,0]=3 54 B4R0.2 ClCCCI 1100-M-01 [1,0,0,0,0,0|2,0,0]=3 55 B4R0.2 FCCCF 1100-3-16 [1,0,0,0,0,0|2,0,0]=3 56 B4R0.2 FCCCI 1100-K-35 [1,0,0,0,0,0|2,0,0]=3 57 B4R0.2 ICCCI 1100-H-X0 [1,0,0,0,0,0|2,0,0]=3 58 B4R0.2 N#CCCO 4137-1-Y3 [1,0,0,0,0,0|0,1,2]=4 59 B4R0.2 NCCCBr 3130-9-X0 [1,0,0,0,0,0|1,0,0]=2 60 B4R0.2 NCCCCl 3130-5-03 [1,0,0,0,0,0|1,0,0]=2 61 B4R0.2 NCCCF 3130-7-13 [1,0,0,0,0,0|1,0,0]=2 62 B4R0.2 NNCCO 4139-1-01 [1,0,0,0,0,0|1,1,0]=3 63 B4R0.2 OCCCBr 2101-9-X2 [1,0,0,0,0,0|1,1,0]=3 64 B4R0.2 OCCCCl 2101-5-13 [1,0,0,0,0,0|1,1,0]=3 65 B4R0.2 OCCCF 2101-3-50 [1,0,0,0,0,0|1,1,0]=3 66 B4R0.2 OCCCI 2101-H-01 [1,0,0,0,0,0|1,1,0]=3 67 B4R0.2 OCCCO 2104-1-11 [1,0,0,0,0,0|1,1,0]=3 68 B6R0.1 CCCC(=O)NN 4156-1-15 [0,1,0,0,0,0|2,0,1]=4 69 B6R0.1 CCCC(C)CCl 1100-5-0A [0,1,0,0,0,0|2,0,0]=3 70 B6R0.1 CCCC(O)CO 2104-1-0A [0,1,0,0,0,0|2,0,0]=3 71 B6R0.1 CCOC(=O)CN 4158-5-25 [0,1,0,0,0,0|2,0,1]=4 72 B6R0.1 CNC(=O)CCN 4148-1-13 [0,1,0,0,0,0|1,0,1]=3 73 B6R0.1 COC(=O)CCN 4158-1-02 [0,1,0,0,0,0|0,1,1]=3 74 B6R0.1 COC(=O)CSC 6166-1-06 [0,1,0,0,0,0|2,0,1]=4 75 B6R0.1 COCC(O)CO 2107-1-11 [0,1,0,0,0,0|1,1,0]=3 76 B6R0.1 OCC[C@H](O)CO 2104-1-S1 [0,1,0,0,0,0|3,0,0]=4 77 B6R0.4 C=CCC[C@@H](C)O 2302-1-R1 [0,1,0,0,0,0|2,0,1]=4 78 B6R0.4 CC(=O)CCCCl 2117-5-52 [0,1,0,0,0,0|2,0,0]=3 79 B6R0.4 CC(=O)NCCCl 4148-5-15 [0,1,0,0,0,0|3,0,0]=4 80 B6R0.4 CC(C)OCCO 2107-1-0H [0,1,0,0,0,0|3,0,0]=4 81 B6R0.4 CCCCB(O)O 6160-1-06 [0,1,0,0,0,0|3,0,0]=4 82 B6R0.4 CCCCC(=O)O 2121-1-0C [0,1,0,0,0,0|2,0,1]=4 83 B6R0.4 CCCNC(N)=S 7167-1-23 [0,1,0,0,0,0|2,0,1]=4 84 B6R0.4 CCCOC(C)=O 2123-1-32 [0,1,0,0,0,0|3,0,0]=4 85 B6R0.4 CN(C)CCCBr 3132-9-03 [0,1,0,0,0,0|2,0,0]=3 86 B6R0.4 CN(C)CCCCl 3132-5-X0 [0,1,0,0,0,0|2,0,0]=3 87 B6R0.4 CN(C)CCCO 4156-1-40 [0,1,0,0,0,0|2,0,0]=3 88 B6R0.4 CNCCC(N)=O 4148-1-30 [0,1,0,0,0,0|1,0,1]=3 89 B6R0.4 NCCCC(=O)O 4157-1-X2 [0,1,0,0,0,0|2,0,0]=3 90 B6R0.4 NCCNC(N)=O 4153-5-07 [0,1,0,0,0,0|3,0,0]=4 91 B6R0.4 O=C(Cl)CCCCl 2116-5-X5 [0,1,0,0,0,0|3,0,0]=4 92 B6R0.6 BrCCOCCBr 2107-9-00 [0,1,0,0,0,0|3,0,0]=4 93 B6R0.6 C#CCCCCCl 1500-5-01 [0,1,0,0,0,0|2,0,1]=4 94 B6R0.6 C#CCOCCN 4556-1-07 [0,1,0,0,0,0|1,0,1]=3 95 B6R0.6 C=CCCCCBr 1300-9-X5 [0,1,0,0,0,0|2,0,1]=4 96 B6R0.6 C=CCCCCO 2301-1-06 [0,1,0,0,0,0|2,0,1]=4 97 B6R0.6 CCCCCC=O 2115-1-X2 [0,1,0,0,0,0|2,0,0]=3 98 B6R0.6 CCCCCCCl 1100-5-29 [0,1,0,0,0,0|2,0,0]=3 99 B6R0.6 CCCCCCF 1100-3-61 [0,1,0,0,0,0|2,0,0]=3 100 B6R0.6 CCCCN=C=S 7168-1-X0 [0,1,0,0,0,0|2,0,1]=4 101 B6R0.6 COCCN=C=S 8168-1-15 [0,1,0,0,0,0|1,1,1]=4 102 B6R0.6 COCCOCCl 2108-5-X0 [0,1,0,0,0,0|1,1,0]=3 103 B6R0.6 ClCCCCCBr 1100-D-X1 [0,1,0,0,0,0|2,0,0]=3 104 B6R0.6 ClCCCCCI 1100-M-X0 [0,1,0,0,0,0|2,0,0]=3 105 B6R0.6 ClCCNCCCl 3131-5-X0 [0,1,0,0,0,0|3,0,0]=4 106 B6R0.6 ClCCOCCCl 2107-5-0J [0,1,0,0,0,0|3,0,0]=4 107 B6R0.6 ICCCCCI 1100-H-00 [0,1,0,0,0,0|2,0,0]=3 108 B6R0.6 ICCOCCI 2107-H-01 [0,1,0,0,0,0|3,0,0]=4 109 B6R0.6 N#CCCCCCl 3137-5-X4 [0,1,0,0,0,0|1,0,2]=4 110 B6R0.6 NCCCCCN 3130-1-20 [0,1,0,0,0,0|1,0,0]=2 111 B6R0.6 NCCCCCO 4156-1-0AT [0,1,0,0,0,0|1,0,0]=2 112 B6R0.6 NCCCCCO 4156-1-Z9 [0,1,0,0,0,0|1,0,0]=2 113 B6R0.6 NCCNCCN 3130-1-23 [0,1,0,0,0,0|2,0,0]=3 114 B6R0.6 OCCCCCBr 2101-9-0A [0,1,0,0,0,0|2,0,0]=3 115 B6R0.6 OCCCCCCl 2101-5-04 [0,1,0,0,0,0|2,0,0]=3 116 B6R0.6 OCCNCCO 4156-1-62 [0,1,0,0,0,0|3,0,0]=4 117 B6R0.6 S=C=NCCCBr 7168-9-02 [0,1,0,0,0,0|2,0,1]=4 118 B6R0.6 S=C=NCCCCl 7168-5-02 [0,1,0,0,0,0|2,0,1]=4 119 B6R1.1 C1=CCOCC1 2H10-1-53 [0,0,0,1,0,0|1,1,1]=4 120 B6R1.1 C1=COCCC1 2H02-1-12 [0,0,0,1,0,0|1,1,1]=4 121 B6R1.1 C1CCCCC1 1200-1-06 [0,0,0,1,0,0|2,0,0]=3 122 B6R1.1 C1CNCCN1 3H31-1-03 [0,0,0,1,0,0|2,0,0]=3 123 B6R1.1 C1COCCN1 4H31-1-01 [0,0,0,1,0,0|2,0,0]=3 124 B6R1.1 C1COCCO1 2H08-1-14 [0,0,0,1,0,0|2,1,0]=4 125 B6R1.1 C1CSCCN1 7H70-1-Z9 [0,0,0,1,0,0|2,0,0]=3 126 B6R1.1 C1CSCSC1 5H66-1-31 [0,0,0,1,0,0|1,0,0]=2 127 B6R1.2 BrC1CCCC1 1200-9-01 [0,0,0,1,0,0|2,0,0]=3 128 B6R1.2 CC1CCCC1 1200-1-07 [0,0,0,1,0,0|2,0,0]=3 129 B6R1.2 CC1CCCO1 2H10-1-01 [0,0,0,1,0,0|2,0,0]=3 130 B6R1.2 CC1CCNC1 3H31-5-95 [0,0,0,1,0,0|2,0,0]=3 131 B6R1.2 CC1OCCO1 2H08-1-01 [0,0,0,1,0,0|3,0,0]=4 132 B6R1.2 C[C@@H]1CCCN1 3H31-5-3F [0,0,0,1,0,0|1,0,0]=2 133 B6R1.2 C[C@H]1CCCN1 3H31-5-S6 [0,0,0,1,0,0|1,0,0]=2 134 B6R1.2 C[C@H]1CCNC1 3H31-5-S5 [0,0,0,1,0,0|2,0,0]=3 135 B6R1.2 ClC1CCCC1 1200-5-02 [0,0,0,1,0,0|2,0,0]=3 136 B6R1.2 FC1CCNC1 3H31-3-64 [0,0,0,1,0,0|2,0,0]=3 137 B6R1.2 F[C@@H]1CCNC1 3H31-3-R2 [0,0,0,1,0,0|2,0,0]=3 138 B6R1.2 F[C@@H]1CCNC1 3H31-7-05 [0,0,0,1,0,0|2,0,0]=3 139 B6R1.2 F[C@H]1CCNC1 3H31-3-S2 [0,0,0,1,0,0|2,0,0]=3 140 B6R1.2 F[C@H]1CCNC1 3H31-7-X5 [0,0,0,1,0,0|2,0,0]=3 141 B6R1.2 NC1CCOC1 4H30-1-07 [0,0,0,1,0,0|0,1,0]=2 142 B6R1.2 NC1CCOC1 4H56-5-2A [0,0,0,1,0,0|0,1,0]=2 143 B6R1.2 N[C@@H]1CCOC1 4H56-1-R04 [0,0,0,1,0,0|0,1,0]=2 144 B6R1.2 N[C@@H]1CCOC1 4H56-5-R0 [0,0,0,1,0,0|0,1,0]=2 145 B6R1.2 N[C@H]1CCOC1 4H56-1-S13 [0,0,0,1,0,0|0,1,0]=2 146 B6R1.2 O=C1CCCC1 2217-1-01 [0,0,0,1,0,0|2,0,1]=4 147 B6R1.2 O=C1CCNC1 4H17-5-04 [0,0,0,1,0,0|2,0,1]=4 148 B6R1.2 O=C1CCOC1 2H17-1-Y1 [0,0,0,1,0,0|1,1,1]=4 149 B6R1.2 O=C1CCSC1 6H66-1-Y6 [0,0,0,1,0,0|1,0,1]=3 150 B6R1.2 O=C1NCCS1 8H70-1-8S [0,0,0,1,0,0|3,0,0]=4 151 B6R1.2 OC1CC=CC1 2402-1-00 [0,0,0,1,0,0|2,0,1]=4 152 B6R1.2 OC1CCNC1 4H01-5-23 [0,0,0,1,0,0|2,0,0]=3 153 B6R1.2 OC1CCNC1 4H56-1-831 [0,0,0,1,0,0|2,0,0]=3 154 B6R1.2 OC1CCOC1 2H10-1-87 [0,0,0,1,0,0|1,1,0]=3 155 B6R1.2 O[C@@H]1CCNC1 4H01-1-M0 [0,0,0,1,0,0|2,0,0]=3 156 B6R1.2 O[C@@H]1CCNC1 4H56-1-R3 [0,0,0,1,0,0|2,0,0]=3 157 B6R1.2 O[C@@H]1CCOC1 2H01-1-Y2 [0,0,0,1,0,0|1,1,0]=3 158 B6R1.2 O[C@H]1CCNC1 4H01-1-M4 [0,0,0,1,0,0|2,0,0]=3 159 B6R1.2 O[C@H]1CCNC1 4H56-5-J2 [0,0,0,1,0,0|2,0,0]=3 160 B6R1.2 O[C@H]1CCOC1 G311-A-08 [0,0,0,1,0,0|1,1,0]=3 161 B6R1.2 S=C1CCCN1 7H67-1-31 [0,0,0,1,0,0|2,0,0]=3 162 B6R1.3 NCCC1CC1 3230-5-07 [0,0,0,1,0,0|1,0,0]=2 163 B6R1.3 OCCC1CC1 2201-1-11 [0,0,0,1,0,0|2,0,0]=3 164 B6R1.6 BrCC1CCC1 1200-9-21 [0,0,0,1,0,0|2,0,0]=3 165 B6R1.6 COC1CNC1 4H07-5-01 [0,0,0,1,0,0|2,1,0]=4 166 B6R1.6 CSC1CNC1 7H66-1-65 [0,0,0,1,0,0|2,0,0]=3 167 B6R1.6 N#CC1CCC1 3237-1-05 [0,0,0,1,0,0|1,0,2]=4 168 B6R1.6 N#CC1CNC1 3H37-5-20 [0,0,0,1,0,0|1,0,2]=4 169 B6R1.6 NCC1CCC1 3230-5-03 [0,0,0,1,0,0|1,0,0]=2 170 B6R1.6 NCC1CNC1 3H30-5-8B [0,0,0,1,0,0|1,0,0]=2 171 B6R1.6 O=CC1CCC1 2215-1-03 [0,0,0,1,0,0|2,0,1]=4 172 B6R1.6 OCC1COC1 2H10-1-44 [0,0,0,1,0,0|1,1,0]=3 173 B3R0.1 BrCCI 1100-S-04 [2,0,0,0,0,0|2,0,0]=4 174 B3R0.1 C#CCC 1500-1-05 [2,0,0,0,0,0|0,0,2]=4 175 B3R0.1 C=CCC 1300-1-25 [2,0,0,0,0,0|0,0,2]=4 176 B3R0.1 CC#CC 1500-1-02 [2,0,0,0,0,0|0,0,2]=4 177 B3R0.1 CCC=O 2115-1-05 [2,0,0,0,0,0|0,1,1]=4 178 B3R0.1 CCCBr 1100-9-37 [2,0,0,0,0,0|1,0,0]=3 179 B3R0.1 CCCC 1100-1-X0 [2,0,0,0,0,0|0,0,0]=2 180 B3R0.1 CCCCl 1100-5-01 [2,0,0,0,0,0|1,0,0]=3 181 B3R0.1 CCCI 1100-H-X9 [2,0,0,0,0,0|1,0,0]=3 182 B3R0.1 CCNN 3139-5-05 [2,0,0,0,0,0|1,0,0]=3 183 B3R0.1 CNOC 4147-5-01 [2,0,0,0,0,0|1,1,0]=4 184 B3R0.1 COCBr 2107-9-01 [2,0,0,0,0,0|1,1,0]=4 185 B3R0.1 C\C=C/C 1300-1-29 [2,0,0,0,0,0|0,0,2]=4 186 B3R0.1 C\C=C\C 1300-1-04 [2,0,0,0,0,0|0,0,2]=4 187 B3R0.1 ClCCCl 1100-5-15 [2,0,0,0,0,0|2,0,0]=4 188 B3R0.1 ClCCI 1100-M-00 [2,0,0,0,0,0|2,0,0]=4 189 B3R0.1 FCCCl 1100-7-05 [2,0,0,0,0,0|2,0,0]=4 190 B3R0.1 FCCI 1100-K-18 [2,0,0,0,0,0|2,0,0]=4 191 B3R0.1 NCCBr 3130-9-X1 [2,0,0,0,0,0|1,0,0]=3 192 B3R0.1 NCCCl 3130-5-01 [2,0,0,0,0,0|1,0,0]=3 193 B3R0.1 NCCF 3130-7-04 [2,0,0,0,0,0|1,0,0]=3 194 B3R0.1 NCCS 7161-5-01 [2,0,0,0,0,0|0,0,0]=2 195 B3R0.1 OCCBr 2101-9-02 [2,0,0,0,0,0|1,1,0]=4 196 B5R0.1 C=CCC(C)O 2302-1-00 [1,1,0,0,0,0|1,0,1]=4 197 B5R0.1 CC(C)CCI 1100-H-X4 [1,1,0,0,0,0|1,0,0]=3 198 B5R0.1 CC(C)CCN 3130-1-X4 [1,1,0,0,0,0|0,0,0]=2 199 B5R0.1 CC(C)CCO 2101-1-53 [1,1,0,0,0,0|1,0,0]=3 200 B5R0.1 CC(C)CNN 3139-5-X0 [1,1,0,0,0,0|1,0,0]=3 201 B5R0.1 CC(N)CCO 4156-1-4D [1,1,0,0,0,0|0,1,0]=3 202 B5R0.1 CCCB(O)O 6160-1-X5 [1,1,0,0,0,0|2,0,0]=4 203 B5R0.1 CCCC(=O)Cl 2116-5-09 [1,1,0,0,0,0|1,0,1]=4 204 B5R0.1 CCCC(=O)[O-] 2122-1-X1 [1,1,0,0,0,0|1,0,1]=4 205 B5R0.1 CCCC(C)C 1100-1-04 [1,1,0,0,0,0|1,0,0]=3 206 B5R0.1 CCCC(C)O 2102-1-52 [1,1,0,0,0,0|1,0,0]=3 207 B5R0.1 CCNC(N)=O 4153-1-X1 [1,1,0,0,0,0|1,0,1]=4 208 B5R0.1 CN(C)CCN 3132-1-X2 [1,1,0,0,0,0|1,0,0]=3 209 B5R0.1 CSCC(=O)O 6166-1-05 [1,1,0,0,0,0|1,0,1]=4 210 B5R0.1 C[C@@H](N)CCO 4156-1-RB [1,1,0,0,0,0|0,1,0]=3 211 B5R0.1 C[C@@H](O)CCO 2101-1-X0 [1,1,0,0,0,0|1,0,0]=3 212 B5R0.1 NC(=O)CCBr 4148-9-00 [1,1,0,0,0,0|1,0,1]=4 213 B5R0.1 NC(=O)CCCl 4148-5-02 [1,1,0,0,0,0|1,0,1]=4 214 B5R0.3 C#CC(O)CC 2502-1-02 [1,1,0,0,0,0|1,0,1]=4 215 B5R0.3 CCC(=O)CBr 2117-9-01 [1,1,0,0,0,0|1,0,1]=4 216 B5R0.3 CCC(C)C=O 2115-1-0C [1,1,0,0,0,0|1,0,1]=4 217 B5R0.3 CCC(C)CN 3130-1-X5 [1,1,0,0,0,0|0,0,0]=2 218 B5R0.3 CCC(N)CC 3130-1-14 [1,1,0,0,0,0|1,0,0]=3 219 B5R0.3 CCC(N)CO 4156-1-38 [1,1,0,0,0,0|1,0,0]=3 220 B5R0.3 CCC(O)CN 4156-1-Z4 [1,1,0,0,0,0|0,0,0]=2 221 B5R0.3 CC[C@@H](N)CO 4156-1-R4 [1,1,0,0,0,0|1,0,0]=3 222 B5R0.3 CC[C@H](N)CO 4156-1-W2 [1,1,0,0,0,0|1,0,0]=3 223 B5R0.3 COC(=O)CN 4158-5-40 [1,1,0,0,0,0|0,1,1]=4 224 B5R0.3 CSC(=N)NN 7167-H-X0 [1,1,0,0,0,0|1,0,1]=4 225 B5R0.3 CSC(=S)NN 8169-1-0B [1,1,0,0,0,0|1,0,1]=4 226 B5R0.3 ClCC(Br)CBr 1100-D-12 [1,1,0,0,0,0|2,0,0]=4 227 B5R0.3 ClCC(Cl)CCl 1100-5-10 [1,1,0,0,0,0|2,0,0]=4 228 B5R0.3 FCC(Br)CBr 1100-B-28 [1,1,0,0,0,0|2,0,0]=4 229 B5R0.3 NC(CO)CO 4104-1-X0 [1,1,0,0,0,0|1,1,0]=4 230 B5R0.3 NCC(O)CN 4156-1-Y7 [1,1,0,0,0,0|1,0,0]=3 231 B5R0.3 NCC(O)CO 4156-1-Z8 [1,1,0,0,0,0|0,1,0]=3 232 B5R0.3 OC(CBr)CBr 2101-9-X1 [1,1,0,0,0,0|2,0,0]=4 233 B5R0.3 OC(CCl)CCl 2102-5-13 [1,1,0,0,0,0|2,0,0]=4 234 B5R0.3 OC(CF)CCl 2102-7-02 [1,1,0,0,0,0|2,0,0]=4 235 B5R0.3 OC(CF)CF 2102-3-13 [1,1,0,0,0,0|2,0,0]=4 236 B5R0.3 OCC(O)CBr 2104-9-01 [1,1,0,0,0,0|1,1,0]=4 237 B5R0.3 OCC(O)CS 6161-1-X4 [1,1,0,0,0,0|1,0,0]=3 238 B7R0.2 CCC(C)CC(C)N 3130-5-X2 [0,2,0,0,0,0|1,0,0]=3 239 B7R0.2 CN(C)CC(O)CO 4156-1-0H [0,2,0,0,0,0|2,0,0]=4 240 B7R0.3 CNCCC(=O)NC 4148-1-31 [0,2,0,0,0,0|1,0,1]=4 241 B7R0.3 COC(=O)CCCBr 2123-9-0H [0,2,0,0,0,0|1,1,0]=4 242 B7R0.3 COC(=O)CCCN 4158-5-18 [0,2,0,0,0,0|0,1,0]=3 243 B7R0.7 CCCC(=O)CCC 2117-1-15 [0,2,0,0,0,0|2,0,0]=4 244 B7R0.7 CCCC(Br)CCC 1100-9-23 [0,2,0,0,0,0|2,0,0]=4 245 B7R0.7 CCCC(Br)CCC 1100-9-23T [0,2,0,0,0,0|2,0,0]=4 246 B7R0.7 CCOC(=O)CCN 4158-5-01 [0,2,0,0,0,0|0,1,1]=4 247 B7R0.10 COC(=O)[C@@H](N)CN 4158-5-S0 [0,2,0,0,0,0|0,1,1]=4 248 B7R0.12 COC(CSC)OC 6166-1-0M [0,2,0,0,0,0|2,0,0]=4 249 B7R0.4 CCCCCB(O)O 6160-1-07 [0,2,0,0,0,0|2,0,0]=4 250 B7R0.4 CCCCCC(=O)Cl 2116-5-11 [0,2,0,0,0,0|2,0,0]=4 251 B7R0.4 CCCCNC(N)=S 7167-1-03 [0,2,0,0,0,0|1,0,1]=4 252 B7R0.4 COCCNC(N)=S 8168-1-16 [0,2,0,0,0,0|0,1,1]=4 253 B7R0.4 NCCCCC(=O)O 4157-1-37 [0,2,0,0,0,0|1,0,1]=4 254 B7R0.4 NCCNCC(=O)O 4158-1-1D [0,2,0,0,0,0|2,0,0]=4 255 B7R0.4 NCCOCC(=O)O 4157-1-05 [0,2,0,0,0,0|2,0,0]=4 256 B7R0.8 CS(=O)(=O)CCCO 6163-1-0D [0,2,0,0,0,0|1,0,1]=4 257 B7R0.8 CS(=O)(=O)SCCN 8163-9-X0 [0,2,0,0,0,0|1,0,1]=4 258 B7R0.8 C[Si](C)(Cl)CCCCl 5181-5-12 [0,2,0,0,0,0|2,0,0]=4 259 B7R0.8 NCCCC(F)(F)F 3130-3-44 [0,2,0,0,0,0|2,0,0]=4 260 B7R0.8 NCCCC(F)(F)F 3130-7-44 [0,2,0,0,0,0|2,0,0]=4 261 B7R0.1 BrCCCCCCBr 1100-9-X7 [0,2,0,0,0,0|2,0,0]=4 262 B7R0.1 C#CCCCCCC 1500-1-X3 [0,2,0,0,0,0|2,0,0]=4 263 B7R0.1 C=CCCCCCBr 1300-9-X1 [0,2,0,0,0,0|2,0,0]=4 264 B7R0.1 C=CCCCCCC 1300-1-08 [0,2,0,0,0,0|2,0,0]=4 265 B7R0.1 CCCCCCCF 1100-3-71 [0,2,0,0,0,0|2,0,0]=4 266 B7R0.1 CCCCCN=C=S 7168-1-22 [0,2,0,0,0,0|1,0,1]=4 267 B7R0.1 CCCNCCC#N 3137-1-11 [0,2,0,0,0,0|1,0,1]=4 268 B7R0.1 COCCCN=C=S 8168-1-18 [0,2,0,0,0,0|0,1,1]=4 269 B7R0.1 COCCOCCO 2108-1-13 [0,2,0,0,0,0|1,1,0]=4 270 B7R0.1 ClCCCCCCI 1100-M-04 [0,2,0,0,0,0|2,0,0]=4 271 B7R0.1 ICCCCCCI 1100-H-X3 [0,2,0,0,0,0|2,0,0]=4 272 B7R0.1 NCCCCCCO 4156-1-08 [0,2,0,0,0,0|1,0,0]=3 273 B7R0.1 OCCCCCCBr 2101-9-X0 [0,2,0,0,0,0|2,0,0]=4 274 B7R0.1 OCCCCCCCl 2101-5-16 [0,2,0,0,0,0|2,0,0]=4 275 B7R0.1 OCCCCCCO 2104-1-35 [0,2,0,0,0,0|2,0,0]=4 276 B7R0.1 SCCCCCCS 5161-1-06 [0,2,0,0,0,0|2,0,0]=4 277 B5R1.1 C1=CCCC1 1400-1-05 [1,0,0,1,0,0|1,0,1]=4 278 B5R1.1 C1=CCNC1 3431-1-X0 [1,0,0,1,0,0|0,0,2]=4 279 B5R1.1 C1CCCC1 1200-1-05 [1,0,0,1,0,0|1,0,0]=3 280 B5R1.1 C1CCNC1 3H31-1-Z9 [1,0,0,1,0,0|0,0,0]=2 281 B5R1.1 C1CCOC1 6H60-1-13 [1,0,0,1,0,0|0,1,0]=3 282 B5R1.2 BrC1CCC1 1200-9-17 [1,0,0,1,0,0|1,0,0]=3 283 B5R1.2 BrC1COC1 2H10-9-07 [1,0,0,1,0,0|1,1,0]=4 284 B5R1.2 FC1CNC1 3231-7-01 [1,0,0,1,0,0|2,0,0]=4 285 B5R1.2 IC1COC1 2H10-H-05 [1,0,0,1,0,0|1,1,0]=4 286 B5R1.2 NC1CCC1 3230-1-X4 [1,0,0,1,0,0|0,0,0]=2 287 B5R1.2 NC1CNC1 3H30-5-38 [1,0,0,1,0,0|1,0,0]=3 288 B5R1.2 O=C1CCC1 2217-1-X6 [1,0,0,1,0,0|1,0,1]=4 289 B5R1.2 O=C1CCN1 4H48-1-F4 [1,0,0,1,0,0|0,1,1]=4 290 B5R1.2 O=C1CSC1 6H66-1-39 [1,0,0,1,0,0|1,0,1]=4 291 B5R1.2 OC1CNC1 4H01-5-63 [1,0,0,1,0,0|2,0,0]=4 292 B5R1.2 OC1COC1 2H01-1-X3 [1,0,0,1,0,0|1,1,0]=4 293 B5R1.3 BrCC1CC1 1200-9-X0 [1,0,0,1,0,0|1,0,0]=3 294 B5R1.3 C#CC1CC1 1500-1-04 [1,0,0,1,0,0|1,0,1]=4 295 B5R1.3 CNC1CC1 3231-5-04 [1,0,0,1,0,0|1,0,0]=3 296 B5R1.3 ClCC1CC1 1200-5-01 [1,0,0,1,0,0|1,0,0]=3 297 B5R1.3 ClCC1CO1 2109-5-01 [1,0,0,1,0,0|1,1,0]=4 298 B5R1.3 ClC[C@@H]1CO1 2109-5-X0 [1,0,0,1,0,0|1,1,0]=4 299 B5R1.3 ClC[C@H]1CO1 2109-5-X1 [1,0,0,1,0,0|1,1,0]=4 300 B5R1.3 FCC1CO1 2109-3-20 [1,0,0,1,0,0|1,1,0]=4 301 B5R1.3 ICC1CC1 1200-H-04 [1,0,0,1,0,0|1,0,0]=3 302 B5R1.3 N#CC1CC1 3237-1-Y6 [1,0,0,1,0,0|0,0,2]=4 303 B5R1.3 NCC1CC1 P911-A-36 [1,0,0,1,0,0|0,0,0]=2 304 B5R1.3 O=CC1CC1 2215-1-X2 [1,0,0,1,0,0|1,0,1]=4 305 B5R1.3 OCC1CC1 2301-1-X2 [1,0,0,1,0,0|1,0,0]=3 306 B5R1.3 OC[C@@H]1CO1 2109-1-R2 [1,0,0,1,0,0|1,1,0]=4 307 B5R1.3 OC[C@H]1CO1 2109-1-S1 [1,0,0,1,0,0|1,1,0]=4 308 B5R1.4 C[C@@H]1O[C@@H]1C 2109-1-Z0 [1,0,0,1,0,0|2,0,0]=4 309 B5R1.4 C[C@@H]1O[C@H]1C 2109-1-E0 [1,0,0,1,0,0|2,0,0]=4 310 B7R1.1 BrCC1CCCC1 1200-9-X1 [0,1,0,1,0,0|2,0,0]=4 311 B7R1.1 CNC1CCCC1 3231-1-03 [0,1,0,1,0,0|1,0,0]=3 312 B7R1.1 COC1CCCC1 2207-1-01 [0,1,0,1,0,0|1,1,0]=4 313 B7R1.1 ClCC1=NCCN1 3H32-5-P4 [0,1,0,1,0,0|2,0,0]=4 314 B7R1.1 ICC1CCCC1 1200-H-X0 [0,1,0,1,0,0|2,0,0]=4 315 B7R1.1 N#CC1CCCN1 4H37-3-17 [0,1,0,1,0,0|1,0,1]=4 316 B7R1.1 N#CC1CCOC1 3H37-1-4Z [0,1,0,1,0,0|0,1,1]=4 317 B7R1.1 N#C[C@@H]1CCCN1 3H37-5-0J [0,1,0,1,0,0|1,0,1]=4 318 B7R1.1 NCC1CCOC1 4H56-1-Q2 [0,1,0,1,0,0|0,1,0]=3 319 B7R1.1 NCC1CCOC1 4H56-5-60 [0,1,0,1,0,0|0,1,0]=3 320 B7R1.1 NNC1CCCC1 P911-A-67 [0,1,0,1,0,0|1,0,0]=3 321 B7R1.1 O=CC1CCOC1 2H15-1-1K [0,1,0,1,0,0|1,1,0]=4 322 B7R1.1 OCC1CC=CC1 2401-1-06 [0,1,0,1,0,0|2,0,0]=4 323 B7R1.1 OCC1CCCC1 2301-1-X3 [0,1,0,1,0,0|2,0,0]=4 324 B7R1.1 OCC1CCCN1 4H01-1-95 [0,1,0,1,0,0|1,0,0]=3 325 B7R1.1 OCC1CCNC1 4H56-5-0C [0,1,0,1,0,0|2,0,0]=4 326 B7R1.1 OCC1CCOC1 2H10-1-34 [0,1,0,1,0,0|1,1,0]=4 327 B7R1.1 OC[C@@H]1CCCN1 4H01-1-M2 [0,1,0,1,0,0|1,0,0]=3 328 B7R1.1 OC[C@@H]1CCCO1 2H01-1-04 [0,1,0,1,0,0|2,0,0]=4 329 B7R1.1 OC[C@@H]1CCNC1 4H56-1-R0 [0,1,0,1,0,0|2,0,0]=4 330 B7R1.1 [C@H]1(CO)CCCN1 4H56-1-L1 [0,1,0,1,0,0|1,0,0]=3 331 B7R1.2 CN1CCC(O)C1 4H56-1-Z4 [0,1,0,1,0,0|2,0,0]=4 332 B7R1.2 CN1CC[C@@H](O)C1 4H56-1-R1 [0,1,0,1,0,0|2,0,0]=4 333 B7R1.2 CN1CC[C@H](O)C1 4H56-1-S4 [0,1,0,1,0,0|2,0,0]=4 334 B7R1.2 O=C1C[C@H](O)CN1 4H20-1-X7 [0,1,0,1,0,0|2,0,0]=4 335 B7R1.3 BrC1CCOCC1 2H10-9-19 [0,1,0,1,0,0|1,1,0]=4 336 B7R1.3 CC1=CCCCC1 1400-1-04 [0,1,0,1,0,0|2,0,0]=4 337 B7R1.3 CC1=CCCNC1 3H31-5-0N [0,1,0,1,0,0|1,0,1]=4 338 B7R1.3 CC1CCCCC1 1200-1-19 [0,1,0,1,0,0|2,0,0]=4 339 B7R1.3 CC1CCCCN1 3H31-1-00 [0,1,0,1,0,0|1,0,0]=3 340 B7R1.3 CC1CCNCC1 3H31-1-Q3 [0,1,0,1,0,0|1,0,0]=3 341 B7R1.3 CC1CNCCO1 4H56-1-9N [0,1,0,1,0,0|2,0,0]=4 342 B7R1.3 CC1COCCN1 4H56-1-98 [0,1,0,1,0,0|1,0,0]=3 343 B7R1.3 CN1CCNCC1 3H32-1-L1 [0,1,0,1,0,0|2,0,0]=4 344 B7R1.3 CN1CCOCC1 4H44-1-03 [0,1,0,1,0,0|2,0,0]=4 345 B7R1.3 C[C@@H]1COCCN1 4H56-1-9Y [0,1,0,1,0,0|1,0,0]=3 346 B7R1.3 C[C@@H]1COCCN1 4H56-5-CX [0,1,0,1,0,0|1,0,0]=3 347 B7R1.3 C[C@H]1CCCCN1 3H31-1-S5 [0,1,0,1,0,0|1,0,0]=3 348 B7R1.3 C[C@H]1CNCCN1 3H31-1-P8 [0,1,0,1,0,0|1,0,0]=3 349 B7R1.3 FC1CCCCC1 1200-3-02 [0,1,0,1,0,0|2,0,0]=4 350 B7R1.3 FC1CCNCC1 3H31-7-X9 [0,1,0,1,0,0|1,0,0]=3 351 B7R1.3 IC1CCOCC1 2H10-H-X0 [0,1,0,1,0,0|1,1,0]=4 352 B7R1.3 NC1CCCNC1 3H30-5-61 [0,1,0,1,0,0|1,0,0]=3 353 B7R1.3 NC1CCOCC1 G311-A-59 [0,1,0,1,0,0|0,1,0]=3 354 B7R1.3 NC1CCOCC1 P911-A-50 [0,1,0,1,0,0|0,1,0]=3 355 B7R1.3 NC1CCSCC1 7H66-1-Y1 [0,1,0,1,0,0|0,0,0]=2 356 B7R1.3 NN1CCOCC1 4H56-1-VA [0,1,0,1,0,0|1,1,0]=4 357 B7R1.3 O=C1CCCCN1 4H48-1-1L [0,1,0,1,0,0|1,0,1]=4 358 B7R1.3 O=C1CCCNC1 4H56-5-M8 [0,1,0,1,0,0|1,0,0]=3 359 B7R1.3 O=C1CCCOC1 2H17-1-09 [0,1,0,1,0,0|1,1,0]=4 360 B7R1.3 O=C1CCCSC1 6H66-1-40 [0,1,0,1,0,0|1,0,0]=3 361 B7R1.3 O=C1CCNCC1 4H17-1-3B [0,1,0,1,0,0|1,0,1]=4 362 B7R1.3 O=C1CCNCC1 4H56-5-3R [0,1,0,1,0,0|1,0,1]=4 363 B7R1.3 O=C1CCSCC1 6H66-1-Y7 [0,1,0,1,0,0|1,0,1]=4 364 B7R1.3 O=C1CNCCN1 4H48-1-W4 [0,1,0,1,0,0|2,0,0]=4 365 B7R1.3 O=C1COCCN1 4H58-1-05 [0,1,0,1,0,0|2,0,0]=4 366 B7R1.3 OC1CCCNC1 4H56-5-90 [0,1,0,1,0,0|1,0,0]=3 367 B7R1.3 OC1CCCOC1 2H10-1-41 [0,1,0,1,0,0|1,1,0]=4 368 B7R1.3 OC1CCNCC1 4H56-1-UJ [0,1,0,1,0,0|1,0,0]=3 369 B7R1.3 OC1CCOCC1 2H10-1-Y4 [0,1,0,1,0,0|1,1,0]=4 370 B7R1.3 O[C@@H]1CCCNC1 4H56-5-R4 [0,1,0,1,0,0|1,0,0]=3 371 B7R1.3 O[C@H]1CCCNC1 4H56-1-SD [0,1,0,1,0,0|1,0,0]=3 372 B7R1.3 SC1CCCCC1 5261-1-04 [0,1,0,1,0,0|2,0,0]=4 373 B7R1.3 [C@@H]1(C)CNCCN1 3H31-1-R1 [0,1,0,1,0,0|1,0,0]=3 374 B7R1.3 [C@@H]1(N)CCCNC1 3H30-5-R1 [0,1,0,1,0,0|1,0,0]=3 375 B7R1.3 [C@H]1(N)CCCNC1 3H30-5-V8 [0,1,0,1,0,0|1,0,0]=3 376 B7R1.3 [C@H]1(O)CCCNC1 4H56-5-L3 [0,1,0,1,0,0|1,0,0]=3 377 B7R1.3 [NH3+]C1CCOCC1 4H30-1-Y9 [0,1,0,1,0,0|0,1,1]=4 378 B7R1.4 NC1CCSC1=O 8H70-5-Z1 [0,1,0,1,0,0|0,0,1]=3 379 B7R1.4 NN1CCCC1=O 4H48-5-BN [0,1,0,1,0,0|2,0,0]=4 380 B7R1.4 O=C1NCCC1O 4H20-1-X1 [0,1,0,1,0,0|2,0,0]=4 381 B7R1.25 CC1(CN)CCC1 3230-5-02 [0,1,0,1,0,0|1,0,0]=3 382 B7R1.25 CC1(CO)COC1 2H10-1-54 [0,1,0,1,0,0|1,1,0]=4 383 B7R1.14 CC1(O)CCCC1 2201-1-01 [0,1,0,1,0,0|2,0,0]=4 384 B7R1.14 CC1(O)CCNC1 4H01-1-5R [0,1,0,1,0,0|2,0,0]=4 385 B7R1.14 CC1(O)CCNC1 4H56-5-0D [0,1,0,1,0,0|2,0,0]=4 386 B7R1.14 FC1(F)CCNC1 3H31-7-X7 [0,1,0,1,0,0|2,0,0]=4 387 B7R1.18 N=C(N)C1CCC1 3241-5-X0 [0,1,0,1,0,0|1,0,1]=4 388 B7R1.18 O=C(O)[C@H]1CCN1 4H57-1-03 [0,1,0,1,0,0|2,0,0]=4 389 B7R1.23 NCC1CC1(F)F 3230-7-0K [0,1,0,1,0,0|2,0,0]=4 390 B7R1.24 C1CCCNCC1 3H31-1-1H [0,1,0,1,0,0|1,0,0]=3 391 B7R1.24 C1CCCOCC1 2H10-1-0X [0,1,0,1,0,0|1,1,0]=4 392 B7R1.24 C1CNCCNC1 3H31-1-T8 [0,1,0,1,0,0|1,0,0]=3 393 B7R1.24 C1CNCCOC1 4H56-1-EA [0,1,0,1,0,0|0,1,0]=3 394 B7R2.13 C1CC2OC2C1 2209-1-X1 [0,0,0,2,0,0|1,1,0]=4 395 B7R2.13 C1NCC2CC12 3H31-5-90 [0,0,0,2,0,0|1,0,0]=3 396 B7R2.13 C1OCC2OC12 2H10-1-Y2 [0,0,0,2,0,0|1,1,0]=4