0 B6R1.2 BrC1=CNC=N1 Z1213725191 [0,0,0,0,0,0|3,0,1]=4 1 B6R1.2 C=C1CCNC1 Z3019986853 [0,0,0,0,0,0|4,0,0]=4 2 B6R1.2 CC1=CCNC1 Z1203734447 [0,0,0,0,0,0|4,0,0]=4 3 B6R1.2 CC1=CNN=N1 Z1255358215 [0,0,0,0,0,0|4,0,0]=4 4 B6R1.2 CC1=COC=N1 Z1198313432 [0,0,0,0,0,0|3,0,1]=4 5 B6R1.2 CC1=NC=CN1 Z104494990 [0,0,0,0,0,0|2,0,2]=4 6 B6R1.2 CC1=NCCN1 Z204020260 [0,0,0,0,0,0|2,0,0]=2 7 B6R1.2 CC1=NCCS1 Z104480256 [0,0,0,0,0,0|1,0,0]=1 8 B6R1.2 CC1=NNC=C1 Z450469310 [0,0,0,0,0,0|3,0,1]=4 9 B6R1.2 CC1=NNC=N1 Z939944658 [0,0,0,0,0,0|3,0,1]=4 10 B6R1.2 CC1CCCN1 Z1274177652 [0,0,0,0,0,0|2,0,2]=4 11 B6R1.2 ClC1=NC=NN1 Z56788868 [0,0,0,0,0,0|3,0,1]=4 12 B6R1.2 ClC1=NNC=C1 Z1255493581 [0,0,0,0,0,0|3,0,1]=4 13 B6R1.2 N=C1CCCN1 Z204007506 [0,0,0,0,0,0|1,0,2]=3 14 B6R1.2 NC1=CC=NO1 Z415654518 [0,0,0,0,0,0|2,1,1]=4 15 B6R1.2 NC1=CC=NS1 Z2568737642 [0,0,0,0,0,0|2,0,1]=3 16 B6R1.2 NC1=CN=NS1 Z1116303505 [0,0,0,0,0,0|3,0,0]=3 17 B6R1.2 NC1=CNC=N1 Z3241270014 [0,0,0,0,0,0|2,0,1]=3 18 B6R1.2 NC1=CNN=N1 Z1964347651 [0,0,0,0,0,0|3,0,0]=3 19 B6R1.2 NC1=CSC=C1 Z1962138158 [0,0,0,0,0,0|3,0,1]=4 20 B6R1.2 NC1=CSN=C1 Z2467685283 [0,0,0,0,0,0|4,0,0]=4 21 B6R1.2 NC1=CSN=N1 Z1868316819 [0,0,0,0,0,0|3,0,0]=3 22 B6R1.2 NC1=NC=CN1 Z1262237195 [0,0,0,0,0,0|1,0,2]=3 23 B6R1.2 NC1=NC=CO1 Z939904646 [0,0,0,0,0,0|0,1,2]=3 24 B6R1.2 NC1=NC=CS1 Z104472798 [0,0,0,0,0,0|0,0,2]=2 25 B6R1.2 NC1=NC=NS1 Z1827897976 [0,0,0,0,0,0|1,0,1]=2 26 B6R1.2 NC1=NCCO1 Z336087916 [0,0,0,0,0,0|0,1,0]=1 27 B6R1.2 NC1=NN=CN1 Z56866006 [0,0,0,0,0,0|2,0,1]=3 28 B6R1.2 NC1=NN=CO1 Z277559304 [0,0,0,0,0,0|1,1,1]=3 29 B6R1.2 NC1=NN=CS1 Z56899142 [0,0,0,0,0,0|1,0,1]=2 30 B6R1.2 NC1=NN=NN1 Z1250100717 [0,0,0,0,0,0|3,0,0]=3 31 B6R1.2 NC1=NN=NS1 Z57087680 [0,0,0,0,0,0|2,0,0]=2 32 B6R1.2 NC1=NNC=C1 Z240126818 [0,0,0,0,0,0|2,0,1]=3 33 B6R1.2 NC1=NNCC1 Z1569708704 [0,0,0,0,0,0|2,0,0]=2 34 B6R1.2 NC1=NON=C1 Z1203638167 [0,0,0,0,0,0|3,0,0]=3 35 B6R1.2 NC1=NSN=C1 Z2065788230 [0,0,0,0,0,0|3,0,0]=3 36 B6R1.2 NC1C=CCC1 Z2679312470 [0,0,0,0,0,0|2,0,2]=4 37 B6R1.2 NC1CCOC1 Z802544198 [0,0,0,0,0,0|3,0,1]=4 38 B6R1.2 NC1CCSC1 Z1267885911 [0,0,0,0,0,0|3,0,1]=4 39 B6R1.2 N[C@@H]1C=CCC1 Z1203585093 [0,0,0,0,0,0|2,0,2]=4 40 B6R1.2 O=C1C=CCO1 Z1219048777 [0,0,0,0,0,0|2,1,1]=4 41 B6R1.2 O=C1CCCN1 Z104472846 [0,0,0,0,0,0|2,0,1]=3 42 B6R1.2 O=C1CCNC1 Z1741976513 [0,0,0,0,0,0|4,0,0]=4 43 B6R1.2 O=C1CCNN1 Z2935001239 [0,0,0,0,0,0|3,0,1]=4 44 B6R1.2 O=C1CCSC1 Z104495638 [0,0,0,0,0,0|4,0,0]=4 45 B6R1.2 O=C1NC=CS1 Z445210514 [0,0,0,0,0,0|1,0,3]=4 46 B6R1.2 O=C1NCCN1 Z104494954 [0,0,0,0,0,0|2,0,1]=3 47 B6R1.2 O=C1NCCO1 Z104474784 [0,0,0,0,0,0|1,1,1]=3 48 B6R1.2 O=C1NCCS1 Z55928860 [0,0,0,0,0,0|1,0,1]=2 49 B6R1.2 O=C1OCCO1 Z1172235744 [0,0,0,0,0,0|2,1,0]=3 50 B6R1.2 O=S1CCCC1 Z278052312 [0,0,0,0,0,0|4,0,0]=4 51 B6R1.2 OC1=NN=CS1 Z1238571564 [0,0,0,0,0,0|2,0,1]=3 52 B6R1.2 OC1=NOC=C1 Z1255501207 [0,0,0,0,0,0|3,0,1]=4 53 B6R1.2 OC1=NSN=C1 Z119989398 [0,0,0,0,0,0|4,0,0]=4 54 B6R1.2 SC1=NC=CN1 Z1198723329 [0,0,0,0,0,0|2,0,2]=4 55 B6R1.2 SC1=NC=NN1 Z56871783 [0,0,0,0,0,0|3,0,1]=4 56 B6R1.2 SC1=NCCN1 Z104497392 [0,0,0,0,0,0|2,0,0]=2 57 B6R1.2 SC1=NN=CS1 Z104503476 [0,0,0,0,0,0|2,0,1]=3 58 B6R1.2 [S-]C1=CN=NS1 Z1198153122 [0,0,0,0,0,0|4,0,0]=4 59 B5R1.1 C1=CCNC1 Z2306624771 [1,0,0,0,0,0|3,0,0]=4 60 B5R1.1 C1=CNC=N1 Z104472692 [1,0,0,0,0,0|1,0,2]=4 61 B5R1.1 C1=CNN=C1 Z104507728 [1,0,0,0,0,0|2,0,1]=4 62 B5R1.1 C1=CNN=N1 Z237528494 [1,0,0,0,0,0|3,0,0]=4 63 B5R1.1 C1=NN=CN1 Z104479156 [1,0,0,0,0,0|2,0,1]=4 64 B5R1.1 C1=NN=CS1 Z1198156558 [1,0,0,0,0,0|1,0,1]=3 65 B7R1.1 C#CC1=NC=CS1 Z1255400696 [0,1,0,0,0,0|1,0,2]=4 66 B7R1.1 CNC1=CNN=N1 Z5069198351 [0,1,0,0,0,0|3,0,0]=4 67 B7R1.1 CNC1=NC=CS1 Z336483296 [0,1,0,0,0,0|0,0,2]=3 68 B7R1.1 CNC1=NCCN1 Z3072981652 [0,1,0,0,0,0|1,0,0]=2 69 B7R1.1 CNC1=NCCS1 Z744843656 [0,1,0,0,0,0|0,0,0]=1 70 B7R1.1 CNC1=NN=CO1 Z235540568 [0,1,0,0,0,0|1,1,1]=4 71 B7R1.1 CNC1=NN=CS1 Z1082870996 [0,1,0,0,0,0|1,0,1]=3 72 B7R1.1 CNC1=NN=NN1 Z2572821634 [0,1,0,0,0,0|3,0,0]=4 73 B7R1.1 CNC1=NOC=C1 Z2489381644 [0,1,0,0,0,0|2,0,1]=4 74 B7R1.1 CNC1CCCC1 Z102766802 [0,1,0,0,0,0|2,0,1]=4 75 B7R1.1 COC1=NCCC1 Z147641734 [0,1,0,0,0,0|2,0,0]=3 76 B7R1.1 COC1=NN=CS1 Z1642058386 [0,1,0,0,0,0|2,0,1]=4 77 B7R1.1 CSC1=NCCN1 Z56790627 [0,1,0,0,0,0|2,0,0]=3 78 B7R1.1 N#CC1=NC=CS1 Z1198221374 [0,1,0,0,0,0|0,0,3]=4 79 B7R1.1 N#CC1CCCS1 Z1201681638 [0,1,0,0,0,0|1,0,2]=4 80 B7R1.1 NCC1=CC=CS1 Z104485908 [0,1,0,0,0,0|1,0,2]=4 81 B7R1.1 NCC1=CC=NS1 Z2310716170 [0,1,0,0,0,0|2,0,1]=4 82 B7R1.1 NCC1=CNN=N1 Z2768172060 [0,1,0,0,0,0|3,0,0]=4 83 B7R1.1 NCC1=NC=CN1 Z1962341939 [0,1,0,0,0,0|1,0,2]=4 84 B7R1.1 NCC1=NC=CO1 Z4774639311 [0,1,0,0,0,0|0,1,2]=4 85 B7R1.1 NCC1=NC=CS1 Z1198107502 [0,1,0,0,0,0|0,0,2]=3 86 B7R1.1 NCC1=NC=NO1 Z2310727797 [0,1,0,0,0,0|1,1,1]=4 87 B7R1.1 NCC1=NCCN1 Z2714784585 [0,1,0,0,0,0|1,0,0]=2 88 B7R1.1 NCC1=NN=CO1 Z104505014 [0,1,0,0,0,0|1,1,1]=4 89 B7R1.1 NCC1=NN=CS1 Z2738360224 [0,1,0,0,0,0|1,0,1]=3 90 B7R1.1 NCC1=NN=NN1 Z1172068153 [0,1,0,0,0,0|3,0,0]=4 91 B7R1.1 NCC1=NOC=C1 Z802903300 [0,1,0,0,0,0|2,0,1]=4 92 B7R1.1 NCC1=NOC=N1 Z1266854926 [0,1,0,0,0,0|2,0,1]=4 93 B7R1.1 NCC1=NOCC1 Z3217343112 [0,1,0,0,0,0|2,0,0]=3 94 B7R1.1 NCC1=NON=C1 Z2944173400 [0,1,0,0,0,0|3,0,0]=4 95 B7R1.1 NCC1CCCC1 Z367452206 [0,1,0,0,0,0|2,0,1]=4 96 B7R1.1 NCC1CCCS1 Z1201677924 [0,1,0,0,0,0|1,0,1]=3 97 B7R1.1 NC[C@@H]1CCCN1 Z3235020468 [0,1,0,0,0,0|1,0,2]=4 98 B7R1.1 NC[C@H]1CCCN1 Z1483956794 [0,1,0,0,0,0|1,0,2]=4 99 B7R1.1 NNC1CCCC1 Z285139110 [0,1,0,0,0,0|2,0,1]=4 100 B7R1.1 O=CC1=CCCC1 Z1190318866 [0,1,0,0,0,0|3,0,0]=4 101 B7R1.1 OCC1=NC=CS1 Z57161013 [0,1,0,0,0,0|1,0,2]=4 102 B7R1.1 OCC1CCCS1 Z1201679857 [0,1,0,0,0,0|2,0,1]=4 103 B7R1.2 BrC1=CN=C(S1)Br Z1267861077 [0,1,0,0,0,0|1,0,2]=4 104 B7R1.2 BrC1=CSC(=N1)Br Z600503298 [0,1,0,0,0,0|1,0,2]=4 105 B7R1.2 BrC1=NN=C(S1)Br Z56871608 [0,1,0,0,0,0|2,0,1]=4 106 B7R1.2 CC1=CC(=NO1)N Z104503828 [0,1,0,0,0,0|2,0,1]=4 107 B7R1.2 CC1=CC(=NS1)N Z1198165856 [0,1,0,0,0,0|2,0,1]=4 108 B7R1.2 CC1=CN=C(O1)N Z994267654 [0,1,0,0,0,0|0,1,2]=4 109 B7R1.2 CC1=CN=C(S1)N Z104500072 [0,1,0,0,0,0|0,0,2]=3 110 B7R1.2 CC1=CNC(=N1)N Z2515238565 [0,1,0,0,0,0|1,0,2]=4 111 B7R1.2 CC1=CSC(=N1)N Z48847548 [0,1,0,0,0,0|0,0,2]=3 112 B7R1.2 CC1=CSC(=N1)S Z203045926 [0,1,0,0,0,0|1,0,2]=4 113 B7R1.2 CC1=NC(=NO1)N Z1147462977 [0,1,0,0,0,0|2,0,1]=4 114 B7R1.2 CC1=NC(=NS1)N Z1198313987 [0,1,0,0,0,0|2,0,1]=4 115 B7R1.2 CC1=NC=C(S1)N Z951517342 [0,1,0,0,0,0|1,0,2]=4 116 B7R1.2 CC1=NN=C(N1)N Z951367902 [0,1,0,0,0,0|2,0,1]=4 117 B7R1.2 CC1=NN=C(O1)N Z56957510 [0,1,0,0,0,0|1,1,1]=4 118 B7R1.2 CC1=NN=C(S1)Br Z431956576 [0,1,0,0,0,0|2,0,1]=4 119 B7R1.2 CC1=NN=C(S1)N Z56900928 [0,1,0,0,0,0|1,0,1]=3 120 B7R1.2 CC1=NN=C(S1)O Z1238571569 [0,1,0,0,0,0|2,0,1]=4 121 B7R1.2 CC1=NN=C(S1)S Z104485716 [0,1,0,0,0,0|2,0,1]=4 122 B7R1.2 CC1=NOC(=N1)N Z339356524 [0,1,0,0,0,0|1,1,1]=4 123 B7R1.2 CC1=NSC(=C1)N Z204042038 [0,1,0,0,0,0|2,0,1]=4 124 B7R1.2 CC1=NSC(=N1)Cl Z368555490 [0,1,0,0,0,0|2,0,1]=4 125 B7R1.2 CC1=NSC(=N1)N Z431702718 [0,1,0,0,0,0|1,0,1]=3 126 B7R1.2 CC1CC(CS1)N Z1203639702 [0,1,0,0,0,0|2,0,1]=4 127 B7R1.2 CC1CCC(=O)N1 Z1250132456 [0,1,0,0,0,0|2,0,1]=4 128 B7R1.2 CC1CCC(=O)O1 Z963595138 [0,1,0,0,0,0|2,1,0]=4 129 B7R1.2 CC1CN=C(N1)N Z1642389934 [0,1,0,0,0,0|1,0,0]=2 130 B7R1.2 CC1CN=C(O1)N Z1203579428 [0,1,0,0,0,0|0,1,0]=2 131 B7R1.2 CC1CNC(=N)C1 Z4085233400 [0,1,0,0,0,0|1,0,2]=4 132 B7R1.2 CC1CNC(=O)C1 Z959319678 [0,1,0,0,0,0|2,0,1]=4 133 B7R1.2 CC1CNC(=O)N1 Z1203730895 [0,1,0,0,0,0|2,0,1]=4 134 B7R1.2 CC1CNC(=O)O1 Z1198149952 [0,1,0,0,0,0|1,1,1]=4 135 B7R1.2 CN1C=C(N=N1)N Z2177030666 [0,1,0,0,0,0|3,0,0]=4 136 B7R1.2 CN1C=NC(=C1)N Z2472857442 [0,1,0,0,0,0|2,0,1]=4 137 B7R1.2 CN1C=NC(=N1)N Z57466217 [0,1,0,0,0,0|2,0,1]=4 138 B7R1.2 CN1CCC(=N1)N Z1582262999 [0,1,0,0,0,0|2,0,0]=3 139 B7R1.2 CN1N=NC(=N1)N Z1198158669 [0,1,0,0,0,0|3,0,0]=4 140 B7R1.2 NC1=CC(=O)CC1 Z1124125496 [0,1,0,0,0,0|2,0,1]=4 141 B7R1.2 NC1=CCC(=O)N1 Z1203591710 [0,1,0,0,0,0|1,0,2]=4 142 B7R1.2 NC1=CSC(=N1)N Z190661742 [0,1,0,0,0,0|0,0,2]=3 143 B7R1.2 NC1=CSC(=N1)O Z1033300716 [0,1,0,0,0,0|1,0,2]=4 144 B7R1.2 NC1=NC(=O)CS1 Z57104428 [0,1,0,0,0,0|0,0,1]=2 145 B7R1.2 NC1=NC(=S)SS1 Z56761438 [0,1,0,0,0,0|1,0,1]=3 146 B7R1.2 NC1=NC=C(S1)Br Z57032577 [0,1,0,0,0,0|0,0,2]=3 147 B7R1.2 NC1=NC=C(S1)F Z1198184822 [0,1,0,0,0,0|0,0,2]=3 148 B7R1.2 NC1=NCC(=O)N1 Z203038534 [0,1,0,0,0,0|1,0,1]=3 149 B7R1.2 NC1=NN=C(N1)O Z1869802420 [0,1,0,0,0,0|2,0,1]=4 150 B7R1.2 NC1=NN=C(S1)Br Z362772468 [0,1,0,0,0,0|1,0,1]=3 151 B7R1.2 NC1=NN=C(S1)N Z56900782 [0,1,0,0,0,0|1,0,1]=3 152 B7R1.2 NC1=NN=C(S1)O Z1824511386 [0,1,0,0,0,0|1,0,1]=3 153 B7R1.2 NC1=NN=C(S1)S Z57032546 [0,1,0,0,0,0|1,0,1]=3 154 B7R1.2 NC1=NNC(=N1)N Z274514098 [0,1,0,0,0,0|2,0,1]=4 155 B7R1.2 NC1=NNC(=N1)S Z56913172 [0,1,0,0,0,0|2,0,1]=4 156 B7R1.2 NC1=NSC(=N1)N Z56755595 [0,1,0,0,0,0|1,0,1]=3 157 B7R1.2 NC1CNC(=O)C1 Z1198329759 [0,1,0,0,0,0|2,0,1]=4 158 B7R1.2 N[C@H]1CC[C@H](C1)N Z2752749810 [0,1,0,0,0,0|2,0,1]=4 159 B7R1.2 O=C1CC(CN1)O Z1198157723 [0,1,0,0,0,0|2,0,1]=4 160 B7R1.2 O=C1CSC(=O)N1 Z57131032 [0,1,0,0,0,0|1,0,2]=4 161 B7R1.2 O=C1CSC(=S)N1 Z57127468 [0,1,0,0,0,0|1,0,2]=4 162 B7R1.4 C=C1CCOC1=O Z1255438435 [0,1,0,0,0,0|2,1,0]=4 163 B7R1.4 CC1=C(SC=N1)N Z1815155510 [0,1,0,0,0,0|2,0,1]=4 164 B7R1.4 CC1=C(SN=C1)N Z3716437679 [0,1,0,0,0,0|2,0,1]=4 165 B7R1.4 CC1=CON=C1N Z995041844 [0,1,0,0,0,0|2,0,1]=4 166 B7R1.4 CC1=NON=C1N Z57948408 [0,1,0,0,0,0|3,0,0]=4 167 B7R1.4 CC1CCCC1=O Z813018382 [0,1,0,0,0,0|3,0,0]=4 168 B7R1.4 CC1CCCC1N Z1219738990 [0,1,0,0,0,0|2,0,1]=4 169 B7R1.4 CC1CCNC1=O Z1198147219 [0,1,0,0,0,0|2,0,1]=4 170 B7R1.4 CC1SCCC1N Z2408712737 [0,1,0,0,0,0|2,0,1]=4 171 B7R1.4 CN1C=CN=C1N Z2309759326 [0,1,0,0,0,0|1,0,2]=4 172 B7R1.4 CN1C=NN=C1N Z1692788308 [0,1,0,0,0,0|2,0,1]=4 173 B7R1.4 CN1CCCC1=O Z104478382 [0,1,0,0,0,0|2,0,1]=4 174 B7R1.4 CN1CCNC1=O Z336079928 [0,1,0,0,0,0|2,0,1]=4 175 B7R1.4 CN1CCSC1=N Z3242405392 [0,1,0,0,0,0|0,0,2]=3 176 B7R1.4 CN1N=CN=C1N Z56757681 [0,1,0,0,0,0|2,0,1]=4 177 B7R1.4 CN1N=NN=C1N Z56791607 [0,1,0,0,0,0|3,0,0]=4 178 B7R1.4 C[C@@H]1CCC[C@@H]1N Z2309845262 [0,1,0,0,0,0|2,0,1]=4 179 B7R1.4 C[C@@H]1CCC[C@H]1N Z2568757690 [0,1,0,0,0,0|2,0,1]=4 180 B7R1.4 C[N+]1=C(SC=C1)N Z56872230 [0,1,0,0,0,0|0,0,3]=4 181 B7R1.4 NC1=CNN=C1N Z802599594 [0,1,0,0,0,0|2,0,1]=4 182 B7R1.4 NC1=NNC=C1Cl Z1741966355 [0,1,0,0,0,0|2,0,1]=4 183 B7R1.4 NC1=NNC=C1I Z1269216483 [0,1,0,0,0,0|2,0,1]=4 184 B7R1.4 NC1CCOC1=O Z56921763 [0,1,0,0,0,0|2,1,0]=4 185 B7R1.4 NC1CCSC1=O Z56922158 [0,1,0,0,0,0|2,0,0]=3 186 B7R1.4 NN1CCOC1=O Z1198147716 [0,1,0,0,0,0|1,1,1]=4 187 B7R1.4 N[C@@H]1CCC[C@@H]1O Z2306841441 [0,1,0,0,0,0|2,0,1]=4 188 B7R1.4 N[C@@H]1CCC[C@H]1N Z2786079696 [0,1,0,0,0,0|2,0,1]=4 189 B7R1.4 N[C@@H]1CCC[C@H]1O Z2256393934 [0,1,0,0,0,0|2,0,1]=4 190 B7R1.4 N[C@@H]1CCSC1=O Z5069355115 [0,1,0,0,0,0|2,0,0]=3 191 B7R1.4 N[C@H]1CCC[C@@H]1O Z1197994837 [0,1,0,0,0,0|2,0,1]=4 192 B7R1.4 N[C@H]1CCSC1=O Z5069354967 [0,1,0,0,0,0|2,0,0]=3 193 B7R1.4 O=C1CCCC1Cl Z104492966 [0,1,0,0,0,0|3,0,0]=4 194 B7R1.4 O=C1NCCC1F Z1203745843 [0,1,0,0,0,0|2,0,1]=4 195 B5R0.1 C/C(=N/C#N)/N Z2573128414 [0,0,1,0,0,0|2,0,1]=4 196 B5R0.1 CC#CC(=O)N Z1203579284 [0,0,1,0,0,0|1,1,1]=4 197 B5R0.1 CCCC(=N)N Z1198394172 [0,0,1,0,0,0|1,0,0]=2 198 B5R0.1 CCCC(=O)N Z33546461 [0,0,1,0,0,0|1,1,0]=3 199 B5R0.1 CCCC(=O)O Z104495380 [0,0,1,0,0,0|2,1,0]=4 200 B5R0.1 CCCC(C)N Z2417819590 [0,0,1,0,0,0|2,0,1]=4 201 B5R0.1 CCNC(=N)N Z2574931373 [0,0,1,0,0,0|1,0,0]=2 202 B5R0.1 CCOC(=N)N Z1741973543 [0,0,1,0,0,0|0,1,0]=2 203 B5R0.1 CCOC(=O)N Z33546369 [0,0,1,0,0,0|1,1,0]=3 204 B5R0.1 CCSC(=N)N Z1708092306 [0,0,1,0,0,0|0,0,0]=1 205 B5R0.1 CNCC(=O)N Z415678308 [0,0,1,0,0,0|2,1,0]=4 206 B5R0.1 COCC(=N)N Z1258620054 [0,0,1,0,0,0|2,0,0]=3 207 B5R0.1 COCC(=O)N Z33546778 [0,0,1,0,0,0|2,1,0]=4 208 B5R0.1 CSCC(=N)N Z1459934800 [0,0,1,0,0,0|2,0,0]=3 209 B5R0.1 CSCC(=O)N Z33545668 [0,0,1,0,0,0|2,1,0]=4 210 B5R0.1 N#CCC(=N)N Z1198223505 [0,0,1,0,0,0|2,0,1]=4 211 B5R0.1 N#CNC(=N)N Z203045078 [0,0,1,0,0,0|2,0,1]=4 212 B5R0.1 N=C(N)CCO Z1198394167 [0,0,1,0,0,0|2,0,0]=3 213 B5R0.1 N=C(N)NC=O Z1203578554 [0,0,1,0,0,0|2,0,1]=4 214 B5R0.1 NC(=O)CCO Z431951940 [0,0,1,0,0,0|2,1,0]=4 215 B5R0.1 NCCC(=O)N Z415728050 [0,0,1,0,0,0|2,1,0]=4 216 B5R0.2 C/C=C/CCN Z1268152372 [0,0,1,0,0,0|2,0,1]=4 217 B5R0.2 C=CCCCN Z993058434 [0,0,1,0,0,0|2,0,1]=4 218 B5R0.2 CCCCC=O Z104472992 [0,0,1,0,0,0|3,0,0]=4 219 B5R0.2 CCCCCN Z104472246 [0,0,1,0,0,0|2,0,1]=4 220 B5R0.2 CCSCCN Z3061111063 [0,0,1,0,0,0|1,0,2]=4 221 B5R0.2 NCCCCF Z2177031126 [0,0,1,0,0,0|2,0,1]=4 222 B5R0.2 NCCCCN Z104472592 [0,0,1,0,0,0|1,0,2]=4 223 B5R0.3 C/N=C(\C)/NC Z1431002714 [0,0,1,0,0,0|2,0,0]=3 224 B5R0.3 C/N=C(\N)/NC Z1089996530 [0,0,1,0,0,0|1,0,0]=2 225 B5R0.3 C/N=C(\N)/SC Z107728770 [0,0,1,0,0,0|0,0,0]=1 226 B5R0.3 CC/C(=N/O)/N Z241067842 [0,0,1,0,0,0|2,0,0]=3 227 B5R0.3 CCC(=O)CC Z104476878 [0,0,1,0,0,0|3,0,0]=4 228 B5R1.2 NC1CCC1 Z1266823158 [0,0,0,0,1,0|1,0,1]=3 229 B5R1.2 NC1COC1 Z317054188 [0,0,0,0,1,0|2,0,1]=4 230 B5R1.2 O=C1CCO1 Z1089877620 [0,0,0,0,1,0|1,1,0]=3 231 B7R1.3 C=C1CCNCC1 Z1124146875 [0,0,0,0,0,1|3,0,0]=4 232 B7R1.3 CC1=CCCNC1 Z2143573194 [0,0,0,0,0,1|2,0,1]=4 233 B7R1.3 CC1CNCCS1 Z334686272 [0,0,0,0,0,1|1,0,2]=4 234 B7R1.3 CC1CSCCN1 Z334686282 [0,0,0,0,0,1|1,0,2]=4 235 B7R1.3 FC1=CCCNC1 Z1570657372 [0,0,0,0,0,1|2,0,1]=4 236 B7R1.3 NC1=CN=CC=C1 Z104494800 [0,0,0,0,0,1|1,0,2]=4 237 B7R1.3 NC1=CN=CN=C1 Z800187814 [0,0,0,0,0,1|2,0,1]=4 238 B7R1.3 NC1=NC=CC=C1 Z104472278 [0,0,0,0,0,1|1,0,2]=4 239 B7R1.3 NC1=NC=CC=N1 Z2895177097 [0,0,0,0,0,1|1,0,2]=4 240 B7R1.3 NC1=NC=CN=C1 Z56899063 [0,0,0,0,0,1|1,0,2]=4 241 B7R1.3 NC1=NC=NC=C1 Z3244659415 [0,0,0,0,0,1|1,0,2]=4 242 B7R1.3 NC1=NC=NC=N1 Z1165162993 [0,0,0,0,0,1|1,0,2]=4 243 B7R1.3 NC1=NC=NN=C1 Z1203581736 [0,0,0,0,0,1|2,0,1]=4 244 B7R1.3 NC1=NCCCC1 Z1723418848 [0,0,0,0,0,1|1,0,0]=2 245 B7R1.3 NC1=NCCCN1 Z1259041088 [0,0,0,0,0,1|1,0,0]=2 246 B7R1.3 NC1=NCCCS1 Z2211231389 [0,0,0,0,0,1|0,0,0]=1 247 B7R1.3 NC1=NN=CC=C1 Z991531024 [0,0,0,0,0,1|1,0,2]=4 248 B7R1.3 NC1=NN=CC=N1 Z104477884 [0,0,0,0,0,1|1,0,2]=4 249 B7R1.3 NC1C=CCCC1 Z1203579654 [0,0,0,0,0,1|2,0,1]=4 250 B7R1.3 NC1CCCCC1 Z1945707495 [0,0,0,0,0,1|2,0,1]=4 251 B7R1.3 NC1CCCOC1 Z1013492300 [0,0,0,0,0,1|1,1,1]=4 252 B7R1.3 NC1CCCSC1 Z1029463244 [0,0,0,0,0,1|1,0,1]=3 253 B7R1.3 NC1CCOCC1 Z600428352 [0,0,0,0,0,1|2,0,1]=4 254 B7R1.3 NC1CCSCC1 Z992716928 [0,0,0,0,0,1|2,0,1]=4 255 B7R1.3 O=C1C=CCCC1 Z295197140 [0,0,0,0,0,1|3,0,0]=4 256 B7R1.3 O=C1C=CCCO1 Z1255402681 [0,0,0,0,0,1|2,1,0]=4 257 B7R1.3 O=C1CCCCC1 Z104474256 [0,0,0,0,0,1|3,0,0]=4 258 B7R1.3 O=C1CCCCN1 Z168817684 [0,0,0,0,0,1|2,0,1]=4 259 B7R1.3 O=C1CCCCO1 Z432085120 [0,0,0,0,0,1|2,1,0]=4 260 B7R1.3 O=C1CCCCS1 Z1726147018 [0,0,0,0,0,1|2,0,0]=3 261 B7R1.3 O=C1CCCNC1 Z3063726909 [0,0,0,0,0,1|2,0,1]=4 262 B7R1.3 O=C1CCCNN1 Z1416174508 [0,0,0,0,0,1|2,0,1]=4 263 B7R1.3 O=C1CCCSC1 Z979714552 [0,0,0,0,0,1|2,0,0]=3 264 B7R1.3 O=C1CCNCC1 Z1741959513 [0,0,0,0,0,1|3,0,0]=4 265 B7R1.3 O=C1CNCCN1 Z56968535 [0,0,0,0,0,1|2,0,1]=4 266 B7R1.3 O=C1CSCCN1 Z337709368 [0,0,0,0,0,1|1,0,1]=3 267 B7R1.3 O=C1CSCSC1 Z1251333166 [0,0,0,0,0,1|3,0,0]=4 268 B7R1.3 O=C1NCCCN1 Z1203730774 [0,0,0,0,0,1|2,0,1]=4 269 B7R1.3 O=C1NCCCO1 Z1198312172 [0,0,0,0,0,1|1,1,1]=4 270 B7R1.3 O=C1NCNCN1 Z1255437058 [0,0,0,0,0,1|2,0,1]=4 271 B7R1.3 O=C1NNCCO1 Z2732442016 [0,0,0,0,0,1|1,1,1]=4 272 B7R1.3 OC1CCCSC1 Z993818972 [0,0,0,0,0,1|2,0,1]=4 273 B7R1.3 S=C1NCNCN1 Z56756573 [0,0,0,0,0,1|2,0,1]=4 274 B4R0.1 CCC(=N)N Z1741969146 [1,0,1,0,0,0|0,0,0]=2 275 B4R0.1 CCC(=O)N Z33546482 [1,0,1,0,0,0|0,1,0]=3 276 B4R0.1 CCC(=O)O Z104474154 [1,0,1,0,0,0|1,1,0]=4 277 B4R0.1 CCC(=S)N Z241091446 [1,0,1,0,0,0|0,0,1]=3 278 B4R0.1 CCC(C)N Z104472234 [1,0,1,0,0,0|1,0,1]=4 279 B4R0.1 CNC(=N)C Z2146515751 [1,0,1,0,0,0|0,0,2]=4 280 B4R0.1 CNC(=O)C Z32016274 [1,0,1,0,0,0|1,0,1]=4 281 B4R0.1 CNC(=O)N Z56932989 [1,0,1,0,0,0|0,1,1]=4 282 B4R0.1 COC(=N)N Z1741976783 [1,0,1,0,0,0|0,1,0]=3 283 B4R0.1 COC(=O)N Z104476722 [1,0,1,0,0,0|1,1,0]=4 284 B4R0.1 CSC(=N)N Z1741980405 [1,0,1,0,0,0|0,0,0]=2 285 B4R0.1 N=C(N)CCl Z204878288 [1,0,1,0,0,0|1,0,0]=3 286 B4R0.1 N=C(N)CN Z3798800325 [1,0,1,0,0,0|1,0,0]=3 287 B4R0.1 N=C(N)CO Z1259341033 [1,0,1,0,0,0|1,0,0]=3 288 B4R0.1 N=C(N)NN Z1259217988 [1,0,1,0,0,0|2,0,0]=4 289 B4R0.1 NC(=O)CF Z104475768 [1,0,1,0,0,0|1,1,0]=4 290 B4R0.1 NC(=O)CI Z1080376832 [1,0,1,0,0,0|1,1,0]=4 291 B4R0.1 NC(=O)CO Z424788508 [1,0,1,0,0,0|1,1,0]=4 292 B4R0.1 NCC(=O)N Z1262254285 [1,0,1,0,0,0|1,1,0]=4 293 B4R0.2 C=NCC#N Z425450894 [1,0,1,0,0,0|1,0,1]=4 294 B4R0.2 CCCCN Z104474314 [1,0,1,0,0,0|1,0,1]=4 295 B4R0.2 CCCNN Z415728048 [1,0,1,0,0,0|1,0,1]=4 296 B4R0.2 CSCCO Z149154880 [1,0,1,0,0,0|1,0,1]=4 297 B4R0.2 NCCCN Z104478068 [1,0,1,0,0,0|0,0,2]=4 298 B4R0.2 NCCCO Z56771034 [1,0,1,0,0,0|0,1,1]=4 299 B6R0.1 CCCC(=O)CN Z1203579017 [0,1,1,0,0,0|1,1,0]=4 300 B6R0.1 CCCC(=O)NO Z59181937 [0,1,1,0,0,0|1,1,0]=4 301 B6R0.1 CCNC(=N)NC Z1357224692 [0,1,1,0,0,0|1,0,0]=3 302 B6R0.1 CCNC(=O)CN Z54747476 [0,1,1,0,0,0|0,1,1]=4 303 B6R0.1 CCNC(=S)NN Z56965890 [0,1,1,0,0,0|0,0,2]=4 304 B6R0.1 CCOC(=N)CC Z3033961910 [0,1,1,0,0,0|1,1,0]=4 305 B6R0.1 CCOC(=O)CN Z594038186 [0,1,1,0,0,0|1,1,0]=4 306 B6R0.1 CCOC(=O)NN Z104478458 [0,1,1,0,0,0|1,1,0]=4 307 B6R0.1 CS/C(=N/C#N)/N Z1203578988 [0,1,1,0,0,0|1,0,1]=4 308 B6R0.2 CC(=O)NC(=N)N Z1203578060 [0,1,1,0,0,0|1,0,1]=4 309 B6R0.2 CC(C)CC(=N)N Z1346385639 [0,1,1,0,0,0|1,0,0]=3 310 B6R0.2 CC(C)CC(=O)N Z33546511 [0,1,1,0,0,0|1,1,0]=4 311 B6R0.2 CC(C)NC(=N)N Z1650168329 [0,1,1,0,0,0|1,0,0]=3 312 B6R0.2 CC(C)NC(=O)N Z56887677 [0,1,1,0,0,0|0,1,1]=4 313 B6R0.2 CC(C)NC(=S)N Z56979374 [0,1,1,0,0,0|0,0,2]=4 314 B6R0.2 CC(N)CC(=O)N Z594220690 [0,1,1,0,0,0|1,1,0]=4 315 B6R0.3 CCC(C)C(=N)N Z823287482 [0,1,1,0,0,0|1,0,0]=3 316 B6R0.3 CCC(C)C(=O)N Z270978420 [0,1,1,0,0,0|1,1,0]=4 317 B6R0.3 CCC(O)C(=O)N Z965049008 [0,1,1,0,0,0|1,1,0]=4 318 B6R0.3 CCN(C)C(=N)N Z1718490393 [0,1,1,0,0,0|1,0,0]=3 319 B6R0.3 COC(=O)C(=N)N Z1198220825 [0,1,1,0,0,0|2,0,0]=4 320 B6R0.3 COC(C)C(=N)N Z1365534351 [0,1,1,0,0,0|2,0,0]=4 321 B6R0.3 CSC(C)C(=N)N Z5622504221 [0,1,1,0,0,0|2,0,0]=4 322 B6R0.4 C#CCNC(=N)N Z1737940712 [0,1,1,0,0,0|1,0,1]=4 323 B6R0.4 C#CCSC(=N)N Z2805877169 [0,1,1,0,0,0|0,0,1]=3 324 B6R0.4 CCCCC(=N)N Z1723418909 [0,1,1,0,0,0|1,0,0]=3 325 B6R0.4 CCCCC(=O)N Z104476278 [0,1,1,0,0,0|1,1,0]=4 326 B6R0.4 CCCNC(=S)N Z56930715 [0,1,1,0,0,0|0,0,2]=4 327 B6R0.4 CCCOC(=O)N Z1198148877 [0,1,1,0,0,0|1,1,0]=4 328 B6R0.4 CCNCC(=O)N Z1459435506 [0,1,1,0,0,0|0,1,1]=4 329 B6R0.4 CCSCC(C)N Z1203641186 [0,1,1,0,0,0|1,0,1]=4 330 B6R0.4 COCCC(=N)N Z1592042674 [0,1,1,0,0,0|1,0,0]=3 331 B6R0.4 COCCC(=O)N Z394696458 [0,1,1,0,0,0|1,1,0]=4 332 B6R0.4 CSCCC(=N)N Z1266823407 [0,1,1,0,0,0|1,0,0]=3 333 B6R0.4 N#CCCC(=N)N Z3771050569 [0,1,1,0,0,0|1,0,1]=4 334 B6R0.4 N=C(N)NCCN Z2235813444 [0,1,1,0,0,0|1,0,0]=3 335 B6R0.4 N=C(N)NCCO Z911465228 [0,1,1,0,0,0|1,0,0]=3 336 B6R0.4 N=C(N)SCCO Z57111959 [0,1,1,0,0,0|0,0,0]=2 337 B6R0.4 NC(=O)CCCO Z1203578394 [0,1,1,0,0,0|1,1,0]=4 338 B6R0.4 NC(=O)NCCF Z1203582184 [0,1,1,0,0,0|0,1,1]=4 339 B6R0.4 NC(=O)OCCO Z1198158440 [0,1,1,0,0,0|1,1,0]=4 340 B6R0.4 NCCCC(=O)N Z398513418 [0,1,1,0,0,0|1,1,0]=4 341 B6R0.4 NCCNC(=O)N Z1268152381 [0,1,1,0,0,0|0,1,1]=4 342 B6R0.4 NCCOC(=O)N Z1587257433 [0,1,1,0,0,0|1,1,0]=4 343 B6R0.6 C=CCSCCN Z1262237162 [0,1,1,0,0,0|1,0,1]=4 344 B6R0.9 C/N=C(/NC)\SC Z107728778 [0,1,1,0,0,0|0,0,0]=2 345 B6R0.9 CN=C(NC)NC Z1089996514 [0,1,1,0,0,0|1,0,0]=3 346 B6R0.9 CNC(=NN)NC Z1601562190 [0,1,1,0,0,0|1,0,1]=4 347 B6R1.4 CC1CCC1N Z2082999653 [0,1,0,0,1,0|1,0,1]=4 348 B6R1.5 CC1CC(C1)N Z1357823942 [0,1,0,0,1,0|1,0,1]=4 349 B6R1.5 NC1CC(C1)N Z1511513968 [0,1,0,0,1,0|1,0,1]=4 350 B6R1.5 N[C@H]1C[C@@H](C1)N Z3244521251 [0,1,0,0,1,0|1,0,1]=4 351 B6R1.5 N[C@H]1C[C@H](C1)F Z3015579885 [0,1,0,0,1,0|1,0,1]=4 352 B6R1.5 N[C@H]1C[C@H](C1)O Z1416282421 [0,1,0,0,1,0|1,0,1]=4 353 B6R1.6 CNC1CCC1 Z1263820270 [0,1,0,0,1,0|1,0,1]=4 354 B6R1.6 NCC1CCC1 Z381061564 [0,1,0,0,1,0|1,0,1]=4 355 B6R1.10 CC1(CCC1)N Z1741969618 [0,1,0,0,1,0|1,0,1]=4 356 B8R1.2 CNC1=NCCCC1 Z1744713171 [0,1,0,0,0,1|1,0,0]=3 357 B8R1.2 CNC1CCCSC1 Z1873867368 [0,1,0,0,0,1|1,0,1]=4 358 B8R1.2 COC1=NCCCC1 Z729471270 [0,1,0,0,0,1|2,0,0]=4 359 B8R1.2 CSC1=NCCCN1 Z104341704 [0,1,0,0,0,1|2,0,0]=4 360 B8R1.2 NCC1=CCCCC1 Z2230911155 [0,1,0,0,0,1|2,0,0]=4 361 B8R1.2 NCC1=CCCOC1 Z2096659348 [0,1,0,0,0,1|1,1,0]=4 362 B8R1.2 NCC1=CCOCC1 Z2234185641 [0,1,0,0,0,1|2,0,0]=4 363 B8R1.2 NCC1=COCCO1 Z425641798 [0,1,0,0,0,1|1,1,0]=4 364 B8R1.2 NCC1=NCCCN1 Z994488026 [0,1,0,0,0,1|1,0,0]=3 365 B8R1.2 NCC1CCCCS1 Z1318217220 [0,1,0,0,0,1|1,0,1]=4 366 B8R1.2 NCC1CSCCN1 Z1203585142 [0,1,0,0,0,1|0,0,2]=4 367 B8R1.2 NCC1CSCCS1 Z1198167851 [0,1,0,0,0,1|1,0,1]=4 368 B8R1.2 O=CC1=CCCSC1 Z1255380334 [0,1,0,0,0,1|2,0,0]=4 369 B8R1.3 CC1CN=C(NC1)N Z1203586632 [0,1,0,0,0,1|1,0,0]=3 370 B8R1.3 CN1CN=C(NC1)S Z57980315 [0,1,0,0,0,1|2,0,0]=4 371 B8R1.4 CC1CCN=C(N1)N Z3512513301 [0,1,0,0,0,1|1,0,0]=3 372 B8R1.4 NC1=CC(=O)CCC1 Z56899207 [0,1,0,0,0,1|2,0,0]=4 373 B8R1.4 O=C1CCSC(=O)N1 Z56871611 [0,1,0,0,0,1|1,0,1]=4 374 B8R1.5 CC1SCCCC1=O Z1359849054 [0,1,0,0,0,1|2,0,0]=4 375 B8R1.5 CC1SCCNC1=O Z1098219156 [0,1,0,0,0,1|1,0,1]=4 376 B8R1.5 CN1CCCN=C1N Z2865417319 [0,1,0,0,0,1|1,0,0]=3 377 B8R1.1 CC1=CN=C(S1)CN Z994267440 [0,2,0,0,0,0|0,0,2]=4 378 B8R1.1 CC1=CSC(=N1)NN Z57980667 [0,2,0,0,0,0|0,0,2]=4 379 B8R1.1 CC1=NN=C(S1)CN Z1198280045 [0,2,0,0,0,0|1,0,1]=4 380 B8R1.1 CCC1=CN=C(S1)N Z851799002 [0,2,0,0,0,0|0,0,2]=4 381 B8R1.1 CCC1=CSC(=N1)N Z1263824431 [0,2,0,0,0,0|0,0,2]=4 382 B8R1.1 CCC1=NN=C(S1)N Z57052870 [0,2,0,0,0,0|1,0,1]=4 383 B8R1.1 CCC1COC(=N1)N Z3231924235 [0,2,0,0,0,0|0,1,0]=3 384 B8R1.1 CNC1=NC(=CS1)C Z48860943 [0,2,0,0,0,0|0,0,2]=4 385 B8R1.1 CNC1=NC(=NS1)C Z1203731956 [0,2,0,0,0,0|1,0,1]=4 386 B8R1.1 CNC1=NC(=O)CS1 Z1203731442 [0,2,0,0,0,0|0,0,1]=3 387 B8R1.1 CNC1=NC=C(S1)C Z3333486563 [0,2,0,0,0,0|0,0,2]=4 388 B8R1.1 CNC1=NN=C(S1)C Z274417684 [0,2,0,0,0,0|1,0,1]=4 389 B8R1.1 CNC1=NN=C(S1)S Z90662867 [0,2,0,0,0,0|1,0,1]=4 390 B8R1.1 CSC1=NN=C(S1)N Z18452635 [0,2,0,0,0,0|1,0,1]=4 391 B8R1.1 CSC1=NSC(=N1)N Z96092037 [0,2,0,0,0,0|1,0,1]=4 392 B8R1.1 N#CC1=CN=C(S1)N Z1203159774 [0,2,0,0,0,0|0,0,2]=4 393 B8R1.1 NC1=NC(=CS1)CCl Z234904524 [0,2,0,0,0,0|0,0,2]=4 394 B8R1.1 NC1=NC(=CS1)CO Z2092371345 [0,2,0,0,0,0|0,0,2]=4 395 B8R1.1 NC1=NN=C(S1)CO Z600620432 [0,2,0,0,0,0|1,0,1]=4 396 B8R1.1 NCC1=CN=C(S1)N Z2989210641 [0,2,0,0,0,0|0,0,2]=4 397 B8R1.1 NCC1=CSC(=N1)N Z1263820281 [0,2,0,0,0,0|0,0,2]=4 398 B8R1.1 NCC1=NN=C(S1)N Z3234882069 [0,2,0,0,0,0|1,0,1]=4 399 B8R1.1 NCC1=NN=C(S1)S Z4201725041 [0,2,0,0,0,0|1,0,1]=4 400 B8R1.1 NCC1=NSC(=N1)N Z4202899873 [0,2,0,0,0,0|1,0,1]=4 401 B8R1.7 CC(N)C1=NC=CS1 Z803082278 [0,2,0,0,0,0|0,0,2]=4 402 B8R1.7 CC(N)C1=NCCN1 Z2754060679 [0,2,0,0,0,0|1,0,0]=3 403 B8R1.7 CC(N)C1=NN=CS1 Z4435730071 [0,2,0,0,0,0|1,0,1]=4 404 B8R1.7 N=C(N)C1=NC=CS1 Z1198733885 [0,2,0,0,0,0|0,0,2]=4 405 B8R1.7 NC(=O)C1=NC=CS1 Z1198177216 [0,2,0,0,0,0|0,0,2]=4 406 B8R1.7 O=C(O)C1=CCCS1 Z1205451212 [0,2,0,0,0,0|2,0,0]=4 407 B8R1.8 CCNC1=NC=CS1 Z86243266 [0,2,0,0,0,0|0,0,2]=4 408 B8R1.8 CCNC1=NN=CS1 Z1082872548 [0,2,0,0,0,0|1,0,1]=4 409 B8R1.8 CNCC1=NC=CS1 Z802607826 [0,2,0,0,0,0|0,0,2]=4 410 B8R1.8 CNCC1=NN=CS1 Z4663887855 [0,2,0,0,0,0|1,0,1]=4 411 B8R1.8 N#CNC1=NN=CS1 Z1198155469 [0,2,0,0,0,0|1,0,1]=4 412 B8R1.8 NCCC1=NC=CS1 Z2724334997 [0,2,0,0,0,0|0,0,2]=4 413 B8R1.8 NCCC1=NN=CS1 Z3067374940 [0,2,0,0,0,0|1,0,1]=4 414 B8R1.8 NCCC1CCCS1 Z2681242377 [0,2,0,0,0,0|1,0,1]=4 415 B8R1.11 CSC1=NCCN1C Z1269243967 [0,2,0,0,0,0|2,0,0]=4 416 B8R1.11 N#CC1=C(CCC1)N Z221425808 [0,2,0,0,0,0|2,0,0]=4 417 B8R1.52 CC1(CCCS1)CN Z1268152236 [0,2,0,0,0,0|1,0,1]=4 418 B8R1.18 CC1=C(SC(=N1)N)Br Z3235015630 [0,2,0,0,0,0|0,0,2]=4 419 B8R1.18 CC1=C(SC(=N1)N)C Z48847528 [0,2,0,0,0,0|0,0,2]=4 420 B8R1.18 CC1CC(=NN1C)N Z1623872195 [0,2,0,0,0,0|2,0,0]=4 421 B8R1.18 CC1CN(C(=N)S1)C Z56872057 [0,2,0,0,0,0|0,0,2]=4 422 B8R1.18 CC1SC(=NC1=O)N Z57104427 [0,2,0,0,0,0|0,0,1]=3 423 B8R1.18 CN1N=C(SC1=O)N Z1203580580 [0,2,0,0,0,0|1,0,1]=4 424 B8R1.51 CC1(CN=C(N1)N)C Z1262644333 [0,2,0,0,0,0|1,0,0]=3 425 B8R1.51 CC1(COC(=N1)N)C Z1198155525 [0,2,0,0,0,0|0,1,0]=3 426 B6R1.11 N=C(N)C1CC1 Z935140732 [0,0,1,1,0,0|1,0,0]=3 427 B6R1.1 C1=NCCCN1 Z1198163087 [0,0,1,1,0,0|1,0,0]=3 428 B8R2.2 NC12CSCC1C2 Z5976232934 [0,0,0,1,0,1|1,0,1]=4 429 B8R1.22 NC1CCCSCC1 Z3102941972 [0,0,0,0,0,2|1,0,1]=4 430 B8R1.22 NC1CSCCSC1 Z4628238517 [0,0,0,0,0,2|1,0,1]=4 431 B8R1.22 O=C1CCSCCN1 Z1198315286 [0,0,0,0,0,2|1,0,1]=4