0 B7R0.1 C#CCCCCCC MCULE-4406928583 [0,0,0,0,0,0|3,0,1]=4 1 B7R0.1 C#CCCCN=N#N MCULE-5508443361 [0,0,0,0,0,0|3,0,1]=4 2 B7R0.1 C/C=C/CCCCC MCULE-6911363331 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.1 C/C=C\CCCCC MCULE-9470036254 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.1 C=CCCCCCC MCULE-6867393536 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.1 C=CCCCCNC MCULE-3676018759 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.1 C=CCCCCNC MCULE-9443600983 [0,0,0,0,0,0|3,0,1]=4 7 B7R0.1 C=CCCCN=C=S MCULE-8494947981 [0,0,0,0,0,0|1,0,1]=2 8 B7R0.1 C=COCCCCC MCULE-4024159480 [0,0,0,0,0,0|3,0,1]=4 9 B7R0.1 CC#CCCCCC MCULE-3651650902 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.1 CC=CCCCCC MCULE-7111489659 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.1 CCCCCC=CI MCULE-9964634818 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.1 CCCCCCC#N MCULE-7652123212 [0,0,0,0,0,0|3,0,1]=4 13 B7R0.1 CCCCCCC=O MCULE-5251820425 [0,0,0,0,0,0|2,1,1]=4 14 B7R0.1 CCCCCCCBr MCULE-8042829299 [0,0,0,0,0,0|3,0,1]=4 15 B7R0.1 CCCCCCCC MCULE-3248084959 [0,0,0,0,0,0|3,0,1]=4 16 B7R0.1 CCCCCCCCl MCULE-6286146566 [0,0,0,0,0,0|3,0,1]=4 17 B7R0.1 CCCCCCCF MCULE-9794868174 [0,0,0,0,0,0|3,0,1]=4 18 B7R0.1 CCCCCCCI MCULE-2930393920 [0,0,0,0,0,0|3,0,1]=4 19 B7R0.1 CCCCCCCN MCULE-1126747714 [0,0,0,0,0,0|3,0,1]=4 20 B7R0.1 CCCCCCCO MCULE-5882959353 [0,0,0,0,0,0|2,1,1]=4 21 B7R0.1 CCCCCCCS MCULE-3901364910 [0,0,0,0,0,0|2,0,2]=4 22 B7R0.1 CCCCCCNC MCULE-1828296852 [0,0,0,0,0,0|3,0,1]=4 23 B7R0.1 CCCCCCNN MCULE-5116098983 [0,0,0,0,0,0|4,0,0]=4 24 B7R0.1 CCCCCCNO MCULE-4175875706 [0,0,0,0,0,0|3,1,0]=4 25 B7R0.1 CCCCCCNO MCULE-8719557426 [0,0,0,0,0,0|3,1,0]=4 26 B7R0.1 CCCCCCOC MCULE-7148964901 [0,0,0,0,0,0|2,1,1]=4 27 B7R0.1 CCCCCCON MCULE-1836746134 [0,0,0,0,0,0|4,0,0]=4 28 B7R0.1 CCCCCCON MCULE-9566158736 [0,0,0,0,0,0|4,0,0]=4 29 B7R0.1 CCCCCN=C=O MCULE-6020523044 [0,0,0,0,0,0|1,1,0]=2 30 B7R0.1 CCCCCN=C=S MCULE-3433224152 [0,0,0,0,0,0|1,0,0]=1 31 B7R0.1 CCCCCN=N#N MCULE-3738662950 [0,0,0,0,0,0|3,0,0]=3 32 B7R0.1 CCCCCOC=O MCULE-2718009140 [0,0,0,0,0,0|2,1,1]=4 33 B7R0.1 CCCCCOCC MCULE-6346670527 [0,0,0,0,0,0|3,0,1]=4 34 B7R0.1 CCCCCON=O MCULE-8065075083 [0,0,0,0,0,0|3,1,0]=4 35 B7R0.1 CCCCCSC#N MCULE-8334022047 [0,0,0,0,0,0|3,0,1]=4 36 B7R0.1 CCOCCN=C=S MCULE-3401173404 [0,0,0,0,0,0|2,0,0]=2 37 B7R0.1 CCOCCN=N#N MCULE-5023136876 [0,0,0,0,0,0|4,0,0]=4 38 B7R0.1 CNCCCCCN MCULE-8023367999 [0,0,0,0,0,0|3,0,1]=4 39 B7R0.1 CNCCCCCO MCULE-2988249730 [0,0,0,0,0,0|2,1,1]=4 40 B7R0.1 CNCCCCCO MCULE-8033733525 [0,0,0,0,0,0|2,1,1]=4 41 B7R0.1 CNCCCCNC MCULE-4466243376 [0,0,0,0,0,0|4,0,0]=4 42 B7R0.1 CNCCCCOC MCULE-3203262011 [0,0,0,0,0,0|3,1,0]=4 43 B7R0.1 COCCCCC#N MCULE-5969342869 [0,0,0,0,0,0|2,1,1]=4 44 B7R0.1 COCCCCCBr MCULE-9843465236 [0,0,0,0,0,0|2,1,1]=4 45 B7R0.1 COCCCCCCl MCULE-6956815361 [0,0,0,0,0,0|2,1,1]=4 46 B7R0.1 COCCCCCN MCULE-2109050097 [0,0,0,0,0,0|2,1,1]=4 47 B7R0.1 COCCCCCO MCULE-6003118644 [0,0,0,0,0,0|1,2,1]=4 48 B7R0.1 COCCCCOC MCULE-3614881304 [0,0,0,0,0,0|3,1,0]=4 49 B7R0.1 COCCCN=C=O MCULE-9248091945 [0,0,0,0,0,0|0,2,0]=2 50 B7R0.1 COCCCN=C=S MCULE-6346177825 [0,0,0,0,0,0|0,1,0]=1 51 B7R0.1 CSCCCCC#N MCULE-5901122432 [0,0,0,0,0,0|2,0,1]=3 52 B7R0.1 CSCCCCCN MCULE-8771942873 [0,0,0,0,0,0|2,0,1]=3 53 B7R0.1 CSCCCCCO MCULE-3422729293 [0,0,0,0,0,0|1,1,1]=3 54 B7R0.1 CSCCCN=C=S MCULE-5722993536 [0,0,0,0,0,0|0,0,0]=0 55 B7R0.1 N#CCCCN=N#N MCULE-7621496379 [0,0,0,0,0,0|4,0,0]=4 56 B7R0.1 N#N=NCCCC=O MCULE-1592256561 [0,0,0,0,0,0|4,0,0]=4 57 B7R0.1 N#N=NCCCCBr MCULE-9830669876 [0,0,0,0,0,0|4,0,0]=4 58 B7R0.1 N#N=NCCCCF MCULE-4297137198 [0,0,0,0,0,0|4,0,0]=4 59 B7R0.1 N#N=NCCCCN MCULE-6258134369 [0,0,0,0,0,0|4,0,0]=4 60 B7R0.1 N#N=NCCCCN MCULE-7187588793 [0,0,0,0,0,0|4,0,0]=4 61 B7R0.1 N#N=NCCCCO MCULE-2102116751 [0,0,0,0,0,0|4,0,0]=4 62 B6R0.6 C#CCCCCC MCULE-7776756434 [1,0,0,0,0,0|2,0,1]=4 63 B6R0.6 C#CCCCNC MCULE-4472877921 [1,0,0,0,0,0|2,0,1]=4 64 B6R0.6 C#CCCCNC MCULE-9185657315 [1,0,0,0,0,0|2,0,1]=4 65 B6R0.6 C#CCCCOC MCULE-3174650949 [1,0,0,0,0,0|1,1,1]=4 66 B6R0.6 C#CCCN=C=S MCULE-6466177440 [1,0,0,0,0,0|0,0,2]=3 67 B6R0.6 C/C=C/CCCC MCULE-6900331316 [1,0,0,0,0,0|2,0,1]=4 68 B6R0.6 C/C=C\CCCC MCULE-8426867799 [1,0,0,0,0,0|2,0,1]=4 69 B6R0.6 C=CCCCCC MCULE-5868303078 [1,0,0,0,0,0|2,0,1]=4 70 B6R0.6 C=CCCCNC MCULE-6696525157 [1,0,0,0,0,0|2,0,1]=4 71 B6R0.6 C=CCCCNC MCULE-7417274044 [1,0,0,0,0,0|2,0,1]=4 72 B6R0.6 C=CCCN=C=S MCULE-4761371048 [1,0,0,0,0,0|0,0,2]=3 73 B6R0.6 C=COCCCC MCULE-2025922328 [1,0,0,0,0,0|2,0,1]=4 74 B6R0.6 CC#CCCCC MCULE-1899332515 [1,0,0,0,0,0|2,0,1]=4 75 B6R0.6 CC=CCCCC MCULE-7277981733 [1,0,0,0,0,0|2,0,1]=4 76 B6R0.6 CCCCCC#N MCULE-7596791521 [1,0,0,0,0,0|2,0,1]=4 77 B6R0.6 CCCCCC=O MCULE-6770578514 [1,0,0,0,0,0|1,1,1]=4 78 B6R0.6 CCCCCCBr MCULE-6022503394 [1,0,0,0,0,0|2,0,1]=4 79 B6R0.6 CCCCCCC MCULE-5817084747 [1,0,0,0,0,0|2,0,1]=4 80 B6R0.6 CCCCCCCl MCULE-3706149525 [1,0,0,0,0,0|2,0,1]=4 81 B6R0.6 CCCCCCF MCULE-4320903575 [1,0,0,0,0,0|2,0,1]=4 82 B6R0.6 CCCCCCI MCULE-1021236615 [1,0,0,0,0,0|2,0,1]=4 83 B6R0.6 CCCCCCN MCULE-2944455155 [1,0,0,0,0,0|2,0,1]=4 84 B6R0.6 CCCCCCN MCULE-6014217174 [1,0,0,0,0,0|2,0,1]=4 85 B6R0.6 CCCCCCN MCULE-6021451227 [1,0,0,0,0,0|2,0,1]=4 86 B6R0.6 CCCCCCO MCULE-4299150163 [1,0,0,0,0,0|1,1,1]=4 87 B6R0.6 CCCCCCS MCULE-5962964855 [1,0,0,0,0,0|1,0,2]=4 88 B6R0.6 CCCCCNC MCULE-8082703734 [1,0,0,0,0,0|1,0,2]=4 89 B6R0.6 CCCCCNN MCULE-5089668540 [1,0,0,0,0,0|2,0,1]=4 90 B6R0.6 CCCCCNN MCULE-7265120524 [1,0,0,0,0,0|2,0,1]=4 91 B6R0.6 CCCCCOC MCULE-3370181741 [1,0,0,0,0,0|1,1,1]=4 92 B6R0.6 CCCCCON MCULE-5372426564 [1,0,0,0,0,0|3,0,0]=4 93 B6R0.6 CCCCCON MCULE-8557641459 [1,0,0,0,0,0|3,0,0]=4 94 B6R0.6 CCCCCSC MCULE-6566108868 [1,0,0,0,0,0|1,0,1]=3 95 B6R0.6 CCCCN=C=O MCULE-3381327717 [1,0,0,0,0,0|0,1,0]=2 96 B6R0.6 CCCCN=C=S MCULE-3952129182 [1,0,0,0,0,0|0,0,0]=1 97 B6R0.6 CCCCN=N#N MCULE-4207638779 [1,0,0,0,0,0|2,0,0]=3 98 B6R0.6 CCCCNC=O MCULE-8821792924 [1,0,0,0,0,0|0,1,2]=4 99 B6R0.6 CCCCNCC MCULE-8816750429 [1,0,0,0,0,0|1,0,2]=4 100 B6R0.6 CCCCNOC MCULE-4265481432 [1,0,0,0,0,0|2,0,1]=4 101 B6R0.6 CCCCOC=O MCULE-4633421026 [1,0,0,0,0,0|1,1,1]=4 102 B6R0.6 CCCCOCC MCULE-5662731951 [1,0,0,0,0,0|2,0,1]=4 103 B6R0.6 CCCCOCCl MCULE-5282964693 [1,0,0,0,0,0|2,0,1]=4 104 B6R0.6 CCCCON=O MCULE-9992790020 [1,0,0,0,0,0|2,1,0]=4 105 B6R0.6 CCCCSC#N MCULE-4585387956 [1,0,0,0,0,0|2,0,1]=4 106 B6R0.6 CCCCSCC MCULE-4832924468 [1,0,0,0,0,0|2,0,1]=4 107 B6R0.6 CCCCSCCl MCULE-4907770015 [1,0,0,0,0,0|2,0,1]=4 108 B6R0.6 CCNCCSC MCULE-1736157320 [1,0,0,0,0,0|1,0,2]=4 109 B6R0.6 CCNCCSC MCULE-9369049891 [1,0,0,0,0,0|1,0,2]=4 110 B6R0.6 CNCCCC#N MCULE-2995077554 [1,0,0,0,0,0|2,0,1]=4 111 B6R0.6 CNCCCC#N MCULE-4831210709 [1,0,0,0,0,0|2,0,1]=4 112 B6R0.6 CNCCCCBr MCULE-4148452640 [1,0,0,0,0,0|2,0,1]=4 113 B6R0.6 CNCCCCBr MCULE-8686440557 [1,0,0,0,0,0|2,0,1]=4 114 B6R0.6 CNCCCCCl MCULE-1170786568 [1,0,0,0,0,0|2,0,1]=4 115 B6R0.6 CNCCCCCl MCULE-1726466829 [1,0,0,0,0,0|2,0,1]=4 116 B6R0.6 CNCCCCN MCULE-2542685963 [1,0,0,0,0,0|2,0,1]=4 117 B6R0.6 CNCCCCN MCULE-7925344560 [1,0,0,0,0,0|2,0,1]=4 118 B6R0.6 CNCCCCO MCULE-9264393637 [1,0,0,0,0,0|1,1,1]=4 119 B6R0.6 CNCCCNC MCULE-3840224541 [1,0,0,0,0,0|1,0,2]=4 120 B6R0.6 CNCCCOC MCULE-4057126907 [1,0,0,0,0,0|0,1,2]=4 121 B6R0.6 CNCCCOC MCULE-8552551858 [1,0,0,0,0,0|0,1,2]=4 122 B6R0.6 CNCCCSC MCULE-6553998750 [1,0,0,0,0,0|0,0,2]=3 123 B6R0.6 COCCCC#N MCULE-8739581354 [1,0,0,0,0,0|1,1,1]=4 124 B6R0.6 COCCCC=O MCULE-2055914202 [1,0,0,0,0,0|0,2,1]=4 125 B6R0.6 COCCCCBr MCULE-7500019583 [1,0,0,0,0,0|1,1,1]=4 126 B6R0.6 COCCCCCl MCULE-3863170338 [1,0,0,0,0,0|1,1,1]=4 127 B6R0.6 COCCCCN MCULE-9584631056 [1,0,0,0,0,0|1,1,1]=4 128 B6R0.6 COCCCCO MCULE-2543196930 [1,0,0,0,0,0|0,2,1]=4 129 B6R0.6 COCCCCO MCULE-8659106280 [1,0,0,0,0,0|0,2,1]=4 130 B6R0.6 COCCCNN MCULE-5097653856 [1,0,0,0,0,0|1,1,1]=4 131 B6R0.6 COCCCNN MCULE-7758841774 [1,0,0,0,0,0|1,1,1]=4 132 B6R0.6 COCCCOC MCULE-5003816236 [1,0,0,0,0,0|1,1,1]=4 133 B6R0.6 COCCCON MCULE-3859091617 [1,0,0,0,0,0|2,1,0]=4 134 B6R0.6 COCCCON MCULE-4419390097 [1,0,0,0,0,0|2,1,0]=4 135 B6R0.6 COCCN=C=O MCULE-7139432642 [1,0,0,0,0,0|0,2,0]=3 136 B6R0.6 COCCN=C=S MCULE-4661994491 [1,0,0,0,0,0|0,1,0]=2 137 B6R0.6 COCCN=N#N MCULE-2613703286 [1,0,0,0,0,0|2,1,0]=4 138 B6R0.6 CSCCCC=O MCULE-6353729217 [1,0,0,0,0,0|0,1,1]=3 139 B6R0.6 CSCCCCN MCULE-2391033479 [1,0,0,0,0,0|1,0,1]=3 140 B6R0.6 CSCCCCO MCULE-1045422424 [1,0,0,0,0,0|0,1,1]=3 141 B6R0.6 CSCCCON MCULE-2543326517 [1,0,0,0,0,0|2,0,0]=3 142 B6R0.6 CSCCCSC MCULE-6993538101 [1,0,0,0,0,0|1,0,1]=3 143 B6R0.6 CSCCN=C=O MCULE-4217751051 [1,0,0,0,0,0|0,1,0]=2 144 B6R0.6 CSCCN=C=S MCULE-4977130724 [1,0,0,0,0,0|0,0,0]=1 145 B6R0.6 CSCCN=N#N MCULE-6952720817 [1,0,0,0,0,0|2,0,0]=3 146 B6R0.6 N#CCCCCS MCULE-6284171080 [1,0,0,0,0,0|2,0,1]=4 147 B6R0.6 N#CCCN=C=S MCULE-2414909877 [1,0,0,0,0,0|1,0,1]=3 148 B6R0.6 N#N=NCCCBr MCULE-8162964491 [1,0,0,0,0,0|3,0,0]=4 149 B6R0.6 N#N=NCCCN MCULE-2473989674 [1,0,0,0,0,0|3,0,0]=4 150 B6R0.6 N#N=NCCCN MCULE-4660070204 [1,0,0,0,0,0|3,0,0]=4 151 B6R0.6 N#N=NCCCO MCULE-3148876760 [1,0,0,0,0,0|2,1,0]=4 152 B6R0.6 NCCCCCS MCULE-1813104379 [1,0,0,0,0,0|2,0,1]=4 153 B6R0.6 NCCCCCS MCULE-6081835870 [1,0,0,0,0,0|2,0,1]=4 154 B6R0.6 O=C=NCCCCl MCULE-4158367269 [1,0,0,0,0,0|1,1,0]=3 155 B6R0.6 S=C=NCCCBr MCULE-7952245386 [1,0,0,0,0,0|1,0,0]=2 156 B6R0.6 S=C=NCCCCl MCULE-9060296575 [1,0,0,0,0,0|1,0,0]=2 157 B6R0.6 SCCCCCS MCULE-4899719552 [1,0,0,0,0,0|1,0,2]=4 158 B8R0.1 CCOC(=O)CN=C=S MCULE-5376687416 [0,1,0,0,0,0|2,0,1]=4 159 B8R0.1 COC[C@@H](O)CN=[N+]=[N-] MCULE-2390473403 [0,1,0,0,0,0|2,1,0]=4 160 B8R0.1 COC[C@H](O)CN=[N+]=[N-] MCULE-1934525371 [0,1,0,0,0,0|2,1,0]=4 161 B8R0.4 CCCCCCCSC MCULE-5211260102 [0,1,0,0,0,0|2,0,1]=4 162 B8R0.4 CCCCCCN=C=O MCULE-6808788959 [0,1,0,0,0,0|1,1,0]=3 163 B8R0.4 CCCCCCN=C=S MCULE-6056221769 [0,1,0,0,0,0|1,0,0]=2 164 B8R0.4 CCCCCCN=N#N MCULE-6665514222 [0,1,0,0,0,0|3,0,0]=4 165 B8R0.4 CCCCCCSCC MCULE-1449428108 [0,1,0,0,0,0|2,0,1]=4 166 B8R0.4 CCOCCCN=C=O MCULE-3539600196 [0,1,0,0,0,0|0,2,0]=3 167 B8R0.4 CCOCCCN=C=S MCULE-4090032015 [0,1,0,0,0,0|0,1,0]=2 168 B8R0.4 COCCCCN=N#N MCULE-7799987267 [0,1,0,0,0,0|2,1,0]=4 169 B8R0.4 CSCCCCCC#N MCULE-8965259284 [0,1,0,0,0,0|2,0,1]=4 170 B8R0.4 CSCCCCCCN MCULE-3785645703 [0,1,0,0,0,0|2,0,1]=4 171 B8R0.4 CSCCCCCCO MCULE-1590282643 [0,1,0,0,0,0|1,1,1]=4 172 B8R0.4 CSCCCCCSC MCULE-3097194542 [0,1,0,0,0,0|1,0,2]=4 173 B8R0.4 CSCCCCN=C=S MCULE-2917152805 [0,1,0,0,0,0|0,0,0]=1 174 B8R0.4 N#N=NCCCCCBr MCULE-3861303017 [0,1,0,0,0,0|3,0,0]=4 175 B8R0.4 N#N=NCCCCCN MCULE-4346251964 [0,1,0,0,0,0|3,0,0]=4 176 B8R0.4 N#N=NCCCCCN MCULE-4601745002 [0,1,0,0,0,0|3,0,0]=4 177 B8R0.4 N#N=NCCCCCO MCULE-6037400215 [0,1,0,0,0,0|3,0,0]=4 178 B8R0.4 S=C=NCCCN=C=S MCULE-6760772338 [0,1,0,0,0,0|1,0,1]=3 179 B8R0.6 CNC(=O)CCN=C=S MCULE-8083154624 [0,1,0,0,0,0|1,0,1]=3 180 B8R0.6 COC(=O)CCCSC MCULE-7320944174 [0,1,0,0,0,0|3,0,0]=4 181 B8R0.6 COC(=O)CCN=C=O MCULE-8282687885 [0,1,0,0,0,0|0,2,1]=4 182 B8R0.6 COC(=O)CCN=C=S MCULE-4255379915 [0,1,0,0,0,0|0,1,1]=3 183 B8R0.7 CC(=O)CCCN=N#N MCULE-4708169857 [0,1,0,0,0,0|3,0,0]=4 184 B8R0.7 CCCCCOC(=S)[S-] MCULE-2950713727 [0,1,0,0,0,0|2,0,1]=4 185 B8R0.7 CCCCCOC(=S)[S-] MCULE-3707330245 [0,1,0,0,0,0|2,0,1]=4 186 B8R0.7 CN(C)CCCN=C=S MCULE-4865170281 [0,1,0,0,0,0|1,0,0]=2 187 B8R0.7 CN(C)CCCN=C=S MCULE-8859981874 [0,1,0,0,0,0|1,0,0]=2 188 B8R0.7 CN(C)CCCN=N#N MCULE-3975367688 [0,1,0,0,0,0|3,0,0]=4 189 B8R0.7 CNCCCNC(=S)S MCULE-3322917565 [0,1,0,0,0,0|1,0,2]=4 190 B8R0.7 COCCCNC(=S)N MCULE-6009717743 [0,1,0,0,0,0|0,1,2]=4 191 B8R0.7 CS(=O)CCCN=C=S MCULE-6842585846 [0,1,0,0,0,0|0,0,1]=2 192 B8R0.7 CSCCCCC(=O)O MCULE-4498129620 [0,1,0,0,0,0|1,1,1]=4 193 B8R0.7 CSCCCOC(=O)C MCULE-4403232519 [0,1,0,0,0,0|1,1,1]=4 194 B8R0.7 FC(F)OCCN=C=S MCULE-5570652143 [0,1,0,0,0,0|3,0,0]=4 195 B8R1.2 CNC1CCCSC1 MCULE-1133400404 [0,0,0,1,0,0|3,0,0]=4 196 B8R1.2 CNC1CCCSC1 MCULE-7973096065 [0,0,0,1,0,0|3,0,0]=4 197 B8R1.2 CSC1CCCCC1 MCULE-5570458252 [0,0,0,1,0,0|2,0,1]=4 198 B8R1.2 CSC1CCCNC1 MCULE-3462764875 [0,0,0,1,0,0|3,0,0]=4 199 B8R1.2 CSC1CCCNC1 MCULE-6182151720 [0,0,0,1,0,0|3,0,0]=4 200 B8R1.2 CSC1CCNCC1 MCULE-1011005935 [0,0,0,1,0,0|1,0,2]=4 201 B8R1.2 CSC1CCNCC1 MCULE-8269276198 [0,0,0,1,0,0|1,0,2]=4 202 B8R1.2 NCC1CCCSC1 MCULE-1894328803 [0,0,0,1,0,0|2,0,1]=4 203 B8R1.2 NNC1CCCSC1 MCULE-2745263925 [0,0,0,1,0,0|3,0,0]=4 204 B8R1.2 NNC1CCCSC1 MCULE-3788828042 [0,0,0,1,0,0|3,0,0]=4 205 B8R1.2 O=CC1CCCSC1 MCULE-8369808876 [0,0,0,1,0,0|1,1,1]=4 206 B8R1.2 OCC1CCCSC1 MCULE-1730158244 [0,0,0,1,0,0|1,1,1]=4 207 B8R1.2 S=CN1CCCCC1 MCULE-9360358622 [0,0,0,1,0,0|1,0,2]=4 208 B8R1.5 CC1=NCCCN1C MCULE-1598225464 [0,0,0,1,0,0|2,0,1]=4 209 B8R1.5 CN1CCCNC1=S MCULE-2262321761 [0,0,0,1,0,0|1,0,2]=4 210 B8R1.8 CSCC1CCCN1 MCULE-9005961775 [0,0,0,1,0,0|2,0,1]=4 211 B8R1.8 CSCC1CCNC1 MCULE-1989958063 [0,0,0,1,0,0|1,0,2]=4 212 B8R1.8 CSCC1CCNC1 MCULE-3540635891 [0,0,0,1,0,0|1,0,2]=4 213 B8R1.8 N#N=NC1CCCC1 MCULE-7440565286 [0,0,0,1,0,0|3,0,0]=4 214 B8R1.8 N#N=NC1CCNC1 MCULE-2864670090 [0,0,0,1,0,0|3,0,0]=4 215 B8R1.8 N#N=NC1CCNC1 MCULE-6548419955 [0,0,0,1,0,0|3,0,0]=4 216 B8R1.8 N#N=NC1CCOC1 MCULE-2406326031 [0,0,0,1,0,0|2,1,0]=4 217 B8R1.8 N#N=NC1CCSC1 MCULE-2171003967 [0,0,0,1,0,0|2,0,0]=3 218 B8R1.8 NCCC1CCSC1 MCULE-3085969507 [0,0,0,1,0,0|2,0,1]=4 219 B8R1.8 NNCC1CCSC1 MCULE-3678130042 [0,0,0,1,0,0|3,0,0]=4 220 B8R1.8 NNCC1CCSC1 MCULE-6316390593 [0,0,0,1,0,0|3,0,0]=4 221 B8R1.8 O=C=NC1CC=CC1 MCULE-9103636427 [0,0,0,1,0,0|1,1,1]=4 222 B8R1.8 O=C=NC1CCCC1 MCULE-6237253816 [0,0,0,1,0,0|1,1,0]=3 223 B8R1.8 O=C=NC1CCOC1 MCULE-3657755611 [0,0,0,1,0,0|0,2,0]=3 224 B8R1.8 S=C=NC1CCCC1 MCULE-6629793875 [0,0,0,1,0,0|1,0,0]=2 225 B8R1.8 S=C=NC1CCOC1 MCULE-3048938228 [0,0,0,1,0,0|0,1,0]=2 226 B8R1.8 [N-]=[N+]=N[C@@H]1CCOC1 MCULE-6760892835 [0,0,0,1,0,0|2,1,0]=4 227 B8R1.8 [N-]=[N+]=N[C@H]1CCOC1 MCULE-6288795472 [0,0,0,1,0,0|2,1,0]=4 228 B8R1.10 N#N=NCC1CCC1 MCULE-6075319285 [0,0,0,1,0,0|3,0,0]=4 229 B8R1.10 N#N=NCC1CNC1 MCULE-7010197952 [0,0,0,1,0,0|3,0,0]=4 230 B8R1.10 N#N=NCC1CNC1 MCULE-9867268121 [0,0,0,1,0,0|3,0,0]=4 231 B8R1.10 S=C=NCC1CCC1 MCULE-5869114369 [0,0,0,1,0,0|1,0,0]=2 232 B8R1.11 CSC1CCCC1N MCULE-2843614842 [0,0,0,1,0,0|2,0,1]=4 233 B8R1.22 CC1CSCCCN1 MCULE-1217955281 [0,0,0,1,0,0|1,0,2]=4 234 B8R1.22 CC1CSCCCN1 MCULE-1651941633 [0,0,0,1,0,0|1,0,2]=4 235 B8R1.22 NC1=NCCCCC1 MCULE-2757008672 [0,0,0,1,0,0|2,0,1]=4 236 B8R1.22 NC1=NCCCCC1 MCULE-7781415779 [0,0,0,1,0,0|2,0,1]=4 237 B8R1.22 S=C1CCCCCN1 MCULE-6573611309 [0,0,0,1,0,0|1,0,2]=4 238 B5R0.2 C#CCCCC MCULE-5706969297 [2,0,0,0,0,0|1,0,1]=4 239 B5R0.2 C#CCN=C=S MCULE-2170246025 [2,0,0,0,0,0|0,0,2]=4 240 B5R0.2 C=CCCCC MCULE-4750698031 [2,0,0,0,0,0|1,0,1]=4 241 B5R0.2 C=CCN=C=S MCULE-3404572895 [2,0,0,0,0,0|0,0,2]=4 242 B5R0.2 CCCC=NO MCULE-7364375780 [2,0,0,0,0,0|0,1,1]=4 243 B5R0.2 CCCCC#N MCULE-4015236167 [2,0,0,0,0,0|1,0,1]=4 244 B5R0.2 CCCCC=O MCULE-4736782822 [2,0,0,0,0,0|0,1,1]=4 245 B5R0.2 CCCCCBr MCULE-8513521912 [2,0,0,0,0,0|1,0,1]=4 246 B5R0.2 CCCCCC MCULE-3465692202 [2,0,0,0,0,0|1,0,1]=4 247 B5R0.2 CCCCCCl MCULE-4412759460 [2,0,0,0,0,0|1,0,1]=4 248 B5R0.2 CCCCCF MCULE-6399883281 [2,0,0,0,0,0|1,0,1]=4 249 B5R0.2 CCCCCI MCULE-4590300793 [2,0,0,0,0,0|1,0,1]=4 250 B5R0.2 CCCCCN MCULE-3371742982 [2,0,0,0,0,0|1,0,1]=4 251 B5R0.2 CCCCCN MCULE-4371067300 [2,0,0,0,0,0|1,0,1]=4 252 B5R0.2 CCCCCN MCULE-6547961798 [2,0,0,0,0,0|1,0,1]=4 253 B5R0.2 CCCCCN MCULE-7483248760 [2,0,0,0,0,0|1,0,1]=4 254 B5R0.2 CCCCCO MCULE-8714292632 [2,0,0,0,0,0|0,1,1]=4 255 B5R0.2 CCCCCS MCULE-5476379340 [2,0,0,0,0,0|0,0,2]=4 256 B5R0.2 CCCCNC MCULE-9321610906 [2,0,0,0,0,0|0,0,2]=4 257 B5R0.2 CCCCNN MCULE-6681305566 [2,0,0,0,0,0|1,0,1]=4 258 B5R0.2 CCCCNN MCULE-6890760890 [2,0,0,0,0,0|1,0,1]=4 259 B5R0.2 CCCCNN MCULE-7362497327 [2,0,0,0,0,0|1,0,1]=4 260 B5R0.2 CCCCNN MCULE-8463623644 [2,0,0,0,0,0|1,0,1]=4 261 B5R0.2 CCCCNO MCULE-1911206569 [2,0,0,0,0,0|0,1,1]=4 262 B5R0.2 CCCCNO MCULE-3820646216 [2,0,0,0,0,0|0,1,1]=4 263 B5R0.2 CCCCOC MCULE-9814272675 [2,0,0,0,0,0|0,1,1]=4 264 B5R0.2 CCCCON MCULE-7582349983 [2,0,0,0,0,0|2,0,0]=4 265 B5R0.2 CCCCON MCULE-8175627798 [2,0,0,0,0,0|2,0,0]=4 266 B5R0.2 CCCCSC MCULE-2799775567 [2,0,0,0,0,0|0,0,1]=3 267 B5R0.2 CCCN=C=O MCULE-9014468293 [2,0,0,0,0,0|0,1,0]=3 268 B5R0.2 CCCN=C=S MCULE-7947940355 [2,0,0,0,0,0|0,0,0]=2 269 B5R0.2 CCCSSC MCULE-3127072032 [2,0,0,0,0,0|1,0,1]=4 270 B5R0.2 CNCCCBr MCULE-3376600253 [2,0,0,0,0,0|2,0,0]=4 271 B5R0.2 CNCCCBr MCULE-6212326106 [2,0,0,0,0,0|2,0,0]=4 272 B5R0.2 CNCCCCl MCULE-1007719210 [2,0,0,0,0,0|2,0,0]=4 273 B5R0.2 CNCCCCl MCULE-6146901643 [2,0,0,0,0,0|2,0,0]=4 274 B5R0.2 CNCCCF MCULE-7647417887 [2,0,0,0,0,0|2,0,0]=4 275 B5R0.2 CNCCCN MCULE-1736081896 [2,0,0,0,0,0|1,0,1]=4 276 B5R0.2 CNCCCO MCULE-9530478547 [2,0,0,0,0,0|1,1,0]=4 277 B5R0.2 CNCCSC MCULE-2812984399 [2,0,0,0,0,0|0,0,2]=4 278 B5R0.2 CNCCSC MCULE-2942435951 [2,0,0,0,0,0|0,0,2]=4 279 B5R0.2 COCCCBr MCULE-6489536401 [2,0,0,0,0,0|1,1,0]=4 280 B5R0.2 COCCCCl MCULE-9192274624 [2,0,0,0,0,0|1,1,0]=4 281 B5R0.2 COCCCF MCULE-5055725246 [2,0,0,0,0,0|1,1,0]=4 282 B5R0.2 COCCCI MCULE-9111605439 [2,0,0,0,0,0|1,1,0]=4 283 B5R0.2 COCCCN MCULE-1421362990 [2,0,0,0,0,0|0,1,1]=4 284 B5R0.2 COCCCN MCULE-4783132205 [2,0,0,0,0,0|0,1,1]=4 285 B5R0.2 COCCCO MCULE-4041418048 [2,0,0,0,0,0|0,2,0]=4 286 B5R0.2 COCCCS MCULE-2371333731 [2,0,0,0,0,0|0,1,1]=4 287 B5R0.2 COCCSC MCULE-5362054021 [2,0,0,0,0,0|1,0,1]=4 288 B5R0.2 COCN=C=O MCULE-6951734265 [2,0,0,0,0,0|0,2,0]=4 289 B5R0.2 COCN=C=S MCULE-8646619442 [2,0,0,0,0,0|0,1,0]=3 290 B5R0.2 CSCCC#N MCULE-5755086116 [2,0,0,0,0,0|0,0,2]=4 291 B5R0.2 CSCCC=O MCULE-6273241704 [2,0,0,0,0,0|0,1,1]=4 292 B5R0.2 CSCCCBr MCULE-8399851816 [2,0,0,0,0,0|1,0,0]=3 293 B5R0.2 CSCCCCl MCULE-1829120476 [2,0,0,0,0,0|1,0,0]=3 294 B5R0.2 CSCCCN MCULE-1030938424 [2,0,0,0,0,0|0,0,1]=3 295 B5R0.2 CSCCCN MCULE-4664984921 [2,0,0,0,0,0|0,0,1]=3 296 B5R0.2 CSCCCO MCULE-9232413185 [2,0,0,0,0,0|0,1,0]=3 297 B5R0.2 CSCCCS MCULE-8405766359 [2,0,0,0,0,0|0,0,1]=3 298 B5R0.2 CSCCON MCULE-9125601960 [2,0,0,0,0,0|1,0,1]=4 299 B5R0.2 CSSCCN MCULE-7065189564 [2,0,0,0,0,0|1,0,1]=4 300 B5R0.2 CSSCCN MCULE-8654200268 [2,0,0,0,0,0|1,0,1]=4 301 B5R0.2 FCCN=C=S MCULE-4106769677 [2,0,0,0,0,0|1,0,0]=3 302 B5R0.2 NCCCCS MCULE-4353910418 [2,0,0,0,0,0|1,0,1]=4 303 B5R0.2 NCCCCS MCULE-9812416858 [2,0,0,0,0,0|1,0,1]=4 304 B5R0.2 NOCCCS MCULE-2063976508 [2,0,0,0,0,0|2,0,0]=4 305 B5R0.2 NOCCCS MCULE-3464018652 [2,0,0,0,0,0|2,0,0]=4 306 B5R0.2 O=C=NCCBr MCULE-9707894644 [2,0,0,0,0,0|1,1,0]=4 307 B5R0.2 O=C=NCCCl MCULE-8919918461 [2,0,0,0,0,0|1,1,0]=4 308 B5R0.2 OCCCCS MCULE-8169490949 [2,0,0,0,0,0|0,1,1]=4 309 B5R0.2 S=C=NCCBr MCULE-9583896675 [2,0,0,0,0,0|1,0,0]=3 310 B5R0.2 S=C=NCCCl MCULE-3919932972 [2,0,0,0,0,0|1,0,0]=3 311 B5R0.2 SCCCCS MCULE-6695609899 [2,0,0,0,0,0|0,0,2]=4 312 B7R0.3 CCC(C)CN=C=S MCULE-2028313910 [1,1,0,0,0,0|0,0,0]=2 313 B7R0.3 CCC(O)CN=N#N MCULE-2314271585 [1,1,0,0,0,0|2,0,0]=4 314 B7R0.3 CNC(C)CCSC MCULE-2095620023 [1,1,0,0,0,0|0,0,2]=4 315 B7R0.3 COC(=O)CN=C=S MCULE-6944178765 [1,1,0,0,0,0|0,1,1]=4 316 B7R0.3 CSCCC(N)CO MCULE-1688371230 [1,1,0,0,0,0|0,1,1]=4 317 B7R0.3 CSCCC(O)C#N MCULE-3484786988 [1,1,0,0,0,0|1,0,1]=4 318 B7R0.3 CSCCC(O)CN MCULE-3835830442 [1,1,0,0,0,0|1,0,1]=4 319 B7R0.3 CSCC[C@@H](N)CO MCULE-2764794918 [1,1,0,0,0,0|0,1,1]=4 320 B7R0.3 CSCC[C@@H](N)CO MCULE-7120101109 [1,1,0,0,0,0|0,1,1]=4 321 B7R0.3 CSCC[C@H](N)CN MCULE-6460179286 [1,1,0,0,0,0|1,0,1]=4 322 B7R0.3 CSCC[C@H](N)CO MCULE-6014525130 [1,1,0,0,0,0|0,1,1]=4 323 B7R0.3 CSCC[C@H](N)CO MCULE-9216326176 [1,1,0,0,0,0|0,1,1]=4 324 B7R0.3 S=C=NCC(Br)CBr MCULE-6838558537 [1,1,0,0,0,0|1,0,0]=3 325 B7R0.4 CC(C)CCN=C=O MCULE-2154901803 [1,1,0,0,0,0|0,1,0]=3 326 B7R0.4 CC(C)CCN=C=S MCULE-4875828479 [1,1,0,0,0,0|0,0,0]=2 327 B7R0.4 CC(C)CCN=N#N MCULE-1481672811 [1,1,0,0,0,0|2,0,0]=4 328 B7R0.4 CCCCCC(=S)N MCULE-7633089850 [1,1,0,0,0,0|1,0,1]=4 329 B7R0.4 CCCCNC(=S)N MCULE-7448930772 [1,1,0,0,0,0|0,0,2]=4 330 B7R0.4 CCCCOC(=S)[S-] MCULE-2197583773 [1,1,0,0,0,0|1,0,1]=4 331 B7R0.4 CCCCOC(=S)[S-] MCULE-3219674247 [1,1,0,0,0,0|1,0,1]=4 332 B7R0.4 CN(C)CCN=C=O MCULE-3911246186 [1,1,0,0,0,0|1,1,0]=4 333 B7R0.4 CN(C)CCN=C=S MCULE-4164009112 [1,1,0,0,0,0|1,0,0]=3 334 B7R0.4 COCCCC(=S)N MCULE-5066867181 [1,1,0,0,0,0|0,1,1]=4 335 B7R0.4 CSCCCC(=O)O MCULE-2126637794 [1,1,0,0,0,0|0,1,1]=4 336 B7R0.4 CSCCNC(=S)N MCULE-1778031613 [1,1,0,0,0,0|0,0,2]=4 337 B7R0.7 CCCC(C)N=C=O MCULE-9843542105 [1,1,0,0,0,0|0,1,0]=3 338 B7R0.7 CCCC(C)N=C=S MCULE-8776201078 [1,1,0,0,0,0|0,0,0]=2 339 B7R0.7 CCOC(=O)N=C=S MCULE-1259119752 [1,1,0,0,0,0|1,0,1]=4 340 B7R0.7 COCC(C)N=C=O MCULE-5875044784 [1,1,0,0,0,0|0,2,0]=4 341 B7R0.7 COCC(C)N=C=S MCULE-1397440898 [1,1,0,0,0,0|0,1,0]=3 342 B7R0.7 CSCC(N)CCO MCULE-2899374338 [1,1,0,0,0,0|0,1,1]=4 343 B7R0.7 CSCC(O)CNN MCULE-9232488868 [1,1,0,0,0,0|1,0,1]=4 344 B9R0.5 CCCCCC(C)N=C=S MCULE-1027041999 [0,2,0,0,0,0|1,0,0]=3 345 B9R0.5 CCCCC[C@@H](C)N=C=S MCULE-3380937652 [0,2,0,0,0,0|1,0,0]=3 346 B9R0.5 CCCCC[C@@H](C)N=C=S MCULE-7325784502 [0,2,0,0,0,0|1,0,0]=3 347 B9R0.5 CCCCC[C@H](C)N=C=S MCULE-8259893543 [0,2,0,0,0,0|1,0,0]=3 348 B9R0.5 CCCCC[C@H](C)N=C=S MCULE-9555596106 [0,2,0,0,0,0|1,0,0]=3 349 B9R0.5 CCOC(=O)CCN=C=S MCULE-7398251181 [0,2,0,0,0,0|0,1,1]=4 350 B9R0.18 S=C=NCC(Cl)CCCCl MCULE-5357526955 [0,2,0,0,0,0|1,0,0]=3 351 B9R0.2 CC(C)OCCCN=C=S MCULE-3210772384 [0,2,0,0,0,0|0,1,0]=3 352 B9R0.2 CN(C)CCCCN=C=S MCULE-4425938109 [0,2,0,0,0,0|1,0,0]=3 353 B9R0.2 CS(=O)/C=C/CCN=C=S MCULE-2975884029 [0,2,0,0,0,0|0,0,2]=4 354 B9R0.2 CS(=O)C=CCCN=C=S MCULE-8174494101 [0,2,0,0,0,0|0,0,2]=4 355 B9R0.2 CS(=O)CCCCN=C=S MCULE-7206975951 [0,2,0,0,0,0|0,0,1]=3 356 B9R0.2 C[S@@](=O)CCCCN=C=S MCULE-3889489260 [0,2,0,0,0,0|0,0,1]=3 357 B9R0.2 C[S@@](=O)CCCCN=C=S MCULE-9247002197 [0,2,0,0,0,0|0,0,1]=3 358 B9R0.2 C[S@](=O)CCCCN=C=S MCULE-8405135516 [0,2,0,0,0,0|0,0,1]=3 359 B9R0.45 CCCCCCCN=C=O MCULE-8681396809 [0,2,0,0,0,0|1,1,0]=4 360 B9R0.45 CCCCCCCN=C=S MCULE-2877179378 [0,2,0,0,0,0|1,0,0]=3 361 B9R0.45 COCCOCCN=C=O MCULE-4634703711 [0,2,0,0,0,0|0,2,0]=4 362 B9R0.45 CSCCCCCN=C=S MCULE-1776201124 [0,2,0,0,0,0|0,0,0]=2 363 B9R0.45 S=C=NCCCCN=C=S MCULE-5682397369 [0,2,0,0,0,0|1,0,1]=4 364 B9R0.46 COC(=O)CCCN=C=S MCULE-8254687973 [0,2,0,0,0,0|0,1,0]=3 365 B9R0.46 CSCCCNC(=S)NN MCULE-3205624186 [0,2,0,0,0,0|0,0,2]=4 366 B9R0.46 CSCCCNC(=S)NN MCULE-9365401873 [0,2,0,0,0,0|0,0,2]=4 367 B9R0.47 CN(C)C(=O)CCN=C=S MCULE-9213407251 [0,2,0,0,0,0|1,0,1]=4 368 B9R0.50 CCN(CC)CCN=C=S MCULE-6659021456 [0,2,0,0,0,0|2,0,0]=4 369 B9R0.38 CS(=O)(=O)CCCN=C=S MCULE-9159537030 [0,2,0,0,0,0|0,0,1]=3 370 B9R0.38 CS(=O)(=O)NCCN=C=S MCULE-8661176564 [0,2,0,0,0,0|1,0,1]=4 371 B9R0.38 C[Si](C)(Cl)CCCN=C=O MCULE-3381837359 [0,2,0,0,0,0|1,1,0]=4 372 B7R1.1 CNC1CCSC1 MCULE-1603222229 [1,0,0,1,0,0|0,0,2]=4 373 B7R1.1 CNC1CCSC1 MCULE-5376977039 [1,0,0,1,0,0|0,0,2]=4 374 B7R1.1 CNC1CCSC1 MCULE-9789640029 [1,0,0,1,0,0|0,0,2]=4 375 B7R1.1 CSC1CCNC1 MCULE-8160363271 [1,0,0,1,0,0|0,0,2]=4 376 B7R1.1 CSC1CCNC1 MCULE-8993526132 [1,0,0,1,0,0|0,0,2]=4 377 B7R1.1 CS[C@@H]1CCNC1 MCULE-5068595479 [1,0,0,1,0,0|0,0,2]=4 378 B7R1.1 CS[C@@H]1CCNC1 MCULE-7615711516 [1,0,0,1,0,0|0,0,2]=4 379 B7R1.1 CS[C@@H]1CCNC1 MCULE-8265640185 [1,0,0,1,0,0|0,0,2]=4 380 B7R1.1 CS[C@@H]1CCNC1 MCULE-9548332479 [1,0,0,1,0,0|0,0,2]=4 381 B7R1.1 N#CC1CCSC1 MCULE-6188837269 [1,0,0,1,0,0|1,0,1]=4 382 B7R1.1 NCC1CCSC1 MCULE-6868901477 [1,0,0,1,0,0|1,0,1]=4 383 B7R1.1 NNC1CCSC1 MCULE-2826177760 [1,0,0,1,0,0|1,0,1]=4 384 B7R1.1 NNC1CCSC1 MCULE-3433599716 [1,0,0,1,0,0|1,0,1]=4 385 B7R1.1 O=CC1CCSC1 MCULE-1282848613 [1,0,0,1,0,0|0,1,1]=4 386 B7R1.1 OCC1CCSC1 MCULE-2226132734 [1,0,0,1,0,0|0,1,1]=4 387 B7R1.3 NC1=NCCCC1 MCULE-1020722938 [1,0,0,1,0,0|1,0,1]=4 388 B7R1.3 NC1=NCCCC1 MCULE-9735306041 [1,0,0,1,0,0|1,0,1]=4 389 B7R1.3 NC1=NCCCS1 MCULE-2157831645 [1,0,0,1,0,0|1,0,1]=4 390 B7R1.3 NC1=NCCCS1 MCULE-7522126566 [1,0,0,1,0,0|1,0,1]=4 391 B7R1.3 NC1=NCCSC1 MCULE-4272591822 [1,0,0,1,0,0|1,0,1]=4 392 B7R1.3 NC1CCCSC1 MCULE-5361360271 [1,0,0,1,0,0|1,0,1]=4 393 B7R1.3 NC1CCCSC1 MCULE-5652416535 [1,0,0,1,0,0|1,0,1]=4 394 B7R1.3 O=C1CCCSC1 MCULE-1649390503 [1,0,0,1,0,0|0,1,1]=4 395 B7R1.3 O=S1CCCSC1 MCULE-5552019770 [1,0,0,1,0,0|1,1,0]=4 396 B7R1.3 OC1CCCSC1 MCULE-1448781710 [1,0,0,1,0,0|0,1,1]=4 397 B7R1.3 S=C1CCCCC1 MCULE-6072375043 [1,0,0,1,0,0|1,0,1]=4 398 B7R1.3 S=C1CCCCN1 MCULE-2004608075 [1,0,0,1,0,0|0,0,2]=4 399 B7R1.3 S=C1NCCCS1 MCULE-8898215455 [1,0,0,1,0,0|0,0,2]=4 400 B7R1.4 CN1CCCC1=S MCULE-1990879544 [1,0,0,1,0,0|1,0,1]=4 401 B7R1.5 CC1CC1N=C=O MCULE-2439771505 [1,0,0,1,0,0|0,1,0]=3 402 B7R1.6 N#N=NC1CCC1 MCULE-5083325681 [1,0,0,1,0,0|2,0,0]=4 403 B7R1.6 NCCC1CSC1 MCULE-5034757527 [1,0,0,1,0,0|1,0,1]=4 404 B7R1.6 O=C=NC1CCC1 MCULE-9904450065 [1,0,0,1,0,0|0,1,0]=3 405 B7R1.6 S=C=NC1CCC1 MCULE-1836653193 [1,0,0,1,0,0|0,0,0]=2 406 B7R1.7 N#N=NCC1CC1 MCULE-9861179079 [1,0,0,1,0,0|2,0,0]=4 407 B7R1.7 O=C=NCC1CC1 MCULE-8504006885 [1,0,0,1,0,0|0,1,0]=3 408 B7R1.7 S=C=NCC1CC1 MCULE-9057933373 [1,0,0,1,0,0|0,0,0]=2 409 B7R1.8 CSC1CCC1=O MCULE-3892720319 [1,0,0,1,0,0|0,1,1]=4 410 B7R1.24 C1CNCCSC1 MCULE-3091366568 [1,0,0,1,0,0|0,0,2]=4 411 B7R1.24 C1CNCCSC1 MCULE-7881506212 [1,0,0,1,0,0|0,0,2]=4 412 B9R1.8 N#N=NC1CCSCC1 MCULE-2341042476 [0,1,0,1,0,0|2,0,0]=4 413 B9R1.8 O=C=NC1CC=CCC1 MCULE-2372103248 [0,1,0,1,0,0|1,1,0]=4 414 B9R1.8 O=C=NC1CCCCC1 MCULE-9865756478 [0,1,0,1,0,0|1,1,0]=4 415 B9R1.8 O=C=NC1CCCCO1 MCULE-4345839369 [0,1,0,1,0,0|1,1,0]=4 416 B9R1.8 O=C=NC1CCOCC1 MCULE-4026066000 [0,1,0,1,0,0|0,2,0]=4 417 B9R1.8 S=C=NC1CCCCC1 MCULE-5106041105 [0,1,0,1,0,0|1,0,0]=3 418 B9R1.8 S=C=NC1CCOCC1 MCULE-1906454450 [0,1,0,1,0,0|0,1,0]=3 419 B9R1.12 O=C=NCC1CCCC1 MCULE-2979729006 [0,1,0,1,0,0|1,1,0]=4 420 B9R1.12 O=C=NCC1CCCO1 MCULE-4246797711 [0,1,0,1,0,0|1,1,0]=4 421 B9R1.12 S=C=NCC1CCCO1 MCULE-8950126434 [0,1,0,1,0,0|1,0,0]=3 422 B9R1.12 S=C=NCC1CCOC1 MCULE-1587756025 [0,1,0,1,0,0|0,1,0]=3 423 B9R1.33 O=C1OCCC1N=C=S MCULE-8241692884 [0,1,0,1,0,0|0,1,1]=4