0  B22R3.12627361  CCCCOC1c2ccccc2CSc3c1cccc3 7a_100025745337_100000210211 [0,0,0,0,0,0|2,1,1]=4
1  B22R3.12627361  CCCCSC1c2ccccc2CCc3c1cccc3 62a_100000210211_100000031795 [0,0,0,0,0,0|3,0,1]=4
2  B21R3.590114  CCCSC1c2ccccc2CCc3c1cccc3 62a_100000210303_100000031795 [1,0,0,0,0,0|2,0,1]=4
3  B21R2.14087  CCCCC=Cc1ccccc1C#Cc2ccccc2 271570a_100016275911_100010200916 [0,0,1,0,0,0|2,0,1]=4
4  B21R2.14087  CCCCC=Cc1ccccc1OCc2ccccc2 271570a_100016275911_100000151716 [0,0,1,0,0,0|1,0,0]=2
5  B21R2.14087  CCCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000210326 [0,0,1,0,0,0|2,0,1]=4
6  B21R2.14087  CCCCCSc1ccccc1OCc2ccccc2 62a_100000210326_100000151716 [0,0,1,0,0,0|2,0,1]=4
7  B21R3.8069667  CCCC=Cc1c2ccccc2cc3c1cccc3 271570a_100016258520_100000185772 [0,0,0,0,1,0|1,0,2]=4
8  B21R3.8069667  CCCC=Cc1c2ccccc2nc3c1cccc3 271570a_100016258520_100000044299 [0,0,0,0,1,0|2,0,1]=4
9  B21R3.8069667  CCCCNc1c2ccccc2cc3c1cccc3 34a_100009882017_100000210210 [0,0,0,0,1,0|2,0,1]=4
10  B21R3.8069667  CCCCSc1c2ccccc2cc3c1cccc3 62a_100000210211_100000185772 [0,0,0,0,1,0|2,0,1]=4
11  B21R3.8069667  CCCCSc1c2ccccc2nc3c1cccc3 62a_100000044299_100000210210 [0,0,0,0,1,0|3,0,0]=4
12  B21R3.8069667  CSCCSc1c2ccccc2cc3c1cccc3 62a_100000212216_100000185772 [0,0,0,0,1,0|2,0,1]=4
13  B20R2.3566  CCCC=Cc1ccccc1OCc2ccccc2 271570a_100016258520_100000151716 [1,0,1,0,0,0|0,0,0]=2
14  B20R2.3566  CCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000210210 [1,0,1,0,0,0|1,0,1]=4
15  B20R2.3566  CCCCSc1ccccc1OCc2ccccc2 62a_100000210211_100000151716 [1,0,1,0,0,0|1,0,1]=4
16  B22R2.1877  CCCCCC(=O)c1ccccc1COc2ccccc2 1458a_100000272412_100000210326 [0,1,1,0,0,0|1,0,1]=4
17  B22R2.1877  CCCCCC(=O)c1ccccc1OCc2ccccc2 1458a_100000183716_100000210326 [0,1,1,0,0,0|1,0,1]=4
18  B22R2.8330  CCCCC=Cc1cc(ccc1OCc2ccccc2)C 271570a_100016275911_100000151733 [0,1,1,0,0,0|1,0,0]=3
19  B22R2.8330  CCCCC=Cc1cc(ccc1OCc2ccccc2)F 271570a_100016275911_200000151671 [0,1,1,0,0,0|1,0,0]=3
20  B22R2.16649  CCCCC=Cc1ccccc1OCc2ccc(cc2)F 271570a_100016275911_200000151720 [0,1,1,0,0,0|1,0,0]=3
21  B22R2.26026  CCCCC=Cc1ccc(cc1OCc2ccccc2)F 271570a_100016275911_100012355265 [0,1,1,0,0,0|1,0,0]=3
22  B22R2.26331  CCCCCC=Cc1ccccc1OCc2ccccc2 271570a_100000062253_100000151716 [0,1,1,0,0,0|1,0,0]=3
23  B22R2.26331  CCCCCC=Cc1cccnc1OCc2ccccc2 271570a_100000062253_200011465151 [0,1,1,0,0,0|2,0,0]=4
24  B22R2.26331  CCCCCC=Cc1ncccc1OCc2ccccc2 271570a_100000062253_100011501402 [0,1,1,0,0,0|2,0,0]=4
25  B22R2.150303  CCCCC(=Cc1cccnc1OCc2ccccc2)Br 271570a_206741709834_200011465151 [0,1,1,0,0,0|2,0,0]=4
26  B22R2.150303  CCCCC(=Cc1ncccc1OCc2ccccc2)Br 271570a_206741709834_100011501402 [0,1,1,0,0,0|2,0,0]=4
27  B22R2.191292  CCCCC=Cc1ccccc1OCc2ccccc2C 271570a_100016275911_100000151724 [0,1,1,0,0,0|1,0,0]=3
28  B22R3.2033379  CCCCC(=O)c1c2ccccc2cc3c1cccc3 1458a_100000610644_100000210211 [0,1,0,0,1,0|1,0,1]=4
29  B22R3.15927150  CCCCC=Cc1c2ccccc2nc3c1cccc3 271570a_100016275911_100000044299 [0,1,0,0,1,0|2,0,0]=4
30  B22R3.3704  C1=C(CCCC1)c2ccccc2OCc3ccccc3 271570a_100000062251_100000151716 [0,0,1,1,0,0|1,0,0]=3
31  B22R3.74185  C(=C1CCCC1)c2ccccc2OCc3ccccc3 271570a_100010378317_100000151716 [0,0,1,1,0,0|1,0,0]=3
32  B20R2.16905  CCCCC=Cc1ccccc1Cc2ccccc2 271570a_100016275911_200011216382 [0,0,1,0,1,0|1,0,0]=3
33  B20R2.16905  CCCCC=Cc1ccccc1Oc2ccccc2 271570a_100016275911_100000049502 [0,0,1,0,1,0|1,0,0]=3
34  B20R3.368533  CCCCc1c2ccccc2cc3c1cccc3 271570a_100020621405_100000185772 [1,0,0,0,1,0|0,0,2]=4
35  B20R3.368533  CCCSc1c2ccccc2cc3c1cccc3 62a_100000210303_100000185772 [1,0,0,0,1,0|1,0,1]=4
36  B22R2.8833  CCCCC=Cc1ccccc1CNCc2ccccc2 271570a_100016275911_200000195884 [0,0,1,0,0,1|2,0,0]=4