0 B8R1.3 CN1CCC(O)CC1 28333 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.3 N[C@H]1CC[C@@H](N)CC1 24379 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.3 N[C@H]1CC[C@H](O)CC1 17269 [0,0,0,0,0,0|3,0,0]=3 3 B7R1.3 BrC1CCCCC1 26900 [1,0,0,0,0,0|3,0,0]=4 4 B7R1.3 BrC1CCCNC1 20113 [1,0,0,0,0,0|3,0,0]=4 5 B7R1.3 BrC1CCCOC1 20114 [1,0,0,0,0,0|2,1,0]=4 6 B7R1.3 CC1CCCCN1 24503 [1,0,0,0,0,0|3,0,0]=4 7 B7R1.3 C[C@@H]1CNCCN1 30719 [1,0,0,0,0,0|3,0,0]=4 8 B7R1.3 C[C@H]1CNCCN1 30718 [1,0,0,0,0,0|3,0,0]=4 9 B7R1.3 ClC1CCCCC1 26901 [1,0,0,0,0,0|3,0,0]=4 10 B7R1.3 ClC1CCCNC1 20123 [1,0,0,0,0,0|3,0,0]=4 11 B7R1.3 NC1CCCCC1 03599 [1,0,0,0,0,0|3,0,0]=4 12 B7R1.3 NC1CCCNC1 30331 [1,0,0,0,0,0|3,0,0]=4 13 B7R1.3 NC1CCCOC1 18227 [1,0,0,0,0,0|2,1,0]=4 14 B7R1.3 NC1CCCOC1 20873 [1,0,0,0,0,0|2,1,0]=4 15 B7R1.3 OC1CCCCC1 00484 [1,0,0,0,0,0|2,0,0]=3 16 B7R1.3 OC1CCCOC1 20872 [1,0,0,0,0,0|1,1,0]=3 17 B7R1.3 OC1CCNCC1 24505 [1,0,0,0,0,0|3,0,0]=4 18 B7R1.3 O[C@@H]1CCCNC1 29212 [1,0,0,0,0,0|2,0,0]=3 19 B7R1.3 O[C@H]1CCCNC1 29120 [1,0,0,0,0,0|2,0,0]=3 20 B7R1.2 CN1CCC(O)C1 26861 [0,0,0,0,1,0|3,0,0]=4 21 B6R0.6 NCCCCCO 15142 [1,0,1,0,0,0|2,0,0]=4 22 B6R0.6 OCCCCCO 01575 [1,0,1,0,0,0|1,1,0]=4 23 B6R1.1 C1CCNCC1 02351 [2,0,0,0,0,0|2,0,0]=4 24 B6R1.1 C1CNCCN1 06899 [2,0,0,0,0,0|2,0,0]=4 25 B6R1.1 C1CSCCN1 22053 [2,0,0,0,0,0|1,0,0]=3 26 B8R1.2 NOC1CCCCO1 31337 [1,1,0,0,0,0|1,1,0]=4 27 B8R1.4 NC1CCCC(O)C1 18017 [1,1,0,0,0,0|2,0,0]=4 28 B8R1.72 CC1(O)CCCNC1 26715 [1,1,0,0,0,0|2,0,0]=4 29 B10R1.119 OC1OC[C@@H](O)[C@@H](O)[C@@H]1O 00358 [0,2,0,0,0,0|1,1,0]=4 30 B10R1.119 OC1OC[C@@H](O)[C@H](O)[C@@H]1O 29250 [0,2,0,0,0,0|1,1,0]=4 31 B10R1.119 OC1OC[C@H](O)[C@@H](O)[C@H]1O 32325 [0,2,0,0,0,0|1,1,0]=4 32 B6R1.2 BrC1CCCC1 14052 [1,0,0,0,1,0|2,0,0]=4 33 B6R1.2 ClC1CCCC1 26772 [1,0,0,0,1,0|2,0,0]=4 34 B6R1.2 F[C@@H]1CCNC1 16524 [1,0,0,0,1,0|2,0,0]=4 35 B6R1.2 F[C@H]1CCNC1 16630 [1,0,0,0,1,0|2,0,0]=4 36 B6R1.2 N=C1CCCS1 02326 [1,0,0,0,1,0|1,0,1]=4 37 B6R1.2 NC1CCOC1 18225 [1,0,0,0,1,0|1,1,0]=4 38 B6R1.2 O=C1CCSC1 29785 [1,0,0,0,1,0|0,0,2]=4 39 B6R1.2 O[C@@H]1CCNC1 16552 [1,0,0,0,1,0|1,0,0]=3 40 B6R1.2 O[C@@H]1CCNC1 28168 [1,0,0,0,1,0|1,0,0]=3 41 B6R1.2 O[C@H]1CCNC1 16510 [1,0,0,0,1,0|1,0,0]=3