0  B8R0.4  CCCCCCCCCl PHBB_SC-05084 [0,0,0,0,0,0|1,0,2]=3
1  B8R0.4  CCCCCCCCI PHBB_SC-00129 [0,0,0,0,0,0|1,0,2]=3
2  B8R0.4  CCCCNCCCC PHBB_SC-05089 [0,0,0,0,0,0|2,0,2]=4
3  B7R0.1  C=CCCCCCC PHBB_SC-05229 [1,0,0,0,0,0|1,0,2]=4
4  B7R0.1  CCCCCCCI PHBB_SC-00341 [1,0,0,0,0,0|1,0,1]=3
5  B7R0.1  NCCCCCCN PHBB_NC-03013 [1,0,0,0,0,0|2,0,1]=4
6  B9R0.45  CCCCCCCCCBr PHBB_SC-00181 [0,1,0,0,0,0|1,0,2]=4
7  B9R0.45  CCCCCCCCCI PHBB_SC-04778 [0,1,0,0,0,0|1,0,2]=4
8  B9R0.45  CCCCCCCCCN PHBB_SC-07954 [0,1,0,0,0,0|1,0,2]=4
9  B9R0.45  NCCCCCCCCN PHBB_SC-12094 [0,1,0,0,0,0|1,0,2]=4
10  B9R0.46  CCCCCCC(=O)OC PHBB_SC-05069 [0,1,0,0,0,0|2,0,1]=4
11  B9R1.8  CCOC1CCC=CO1 PHBB_SC-03995 [0,0,0,1,0,0|3,0,0]=4
12  B9R1.8  NCCC1=CCCCC1 PHBB_SC-06201 [0,0,0,1,0,0|2,0,1]=4
13  B9R1.8  OCCC1CCCCN1 PHBB_NC-00490 [0,0,0,1,0,0|1,0,2]=4
14  B9R1.8  OCCN1CCNCC1 PHBB_SC-04935 [0,0,0,1,0,0|2,0,1]=4
15  B9R1.8  OCCN1CCOCC1 PHBB_SC-02774 [0,0,0,1,0,0|2,0,1]=4
16  B9R1.14  CCN1CCCC1CN PHBB_SC-04953 [0,0,0,1,0,0|2,0,1]=4
17  B9R1.15  CN1CCCCC1CO PHBB_SC-08393 [0,0,0,1,0,0|1,0,2]=4
18  B9R1.83  CCCCCCC1CO1 PHBB_SC-07935 [0,0,0,1,0,0|0,0,2]=3
19  B9R1.83  CCCCOCC1CO1 PHBB_SC-00124 [0,0,0,1,0,0|1,0,2]=4
20  B9R1.89  BrCC1OCCCCO1 PHBB_SC-00732 [0,0,0,1,0,0|2,0,1]=4
21  B6R0.6  BrCCCCCBr PHBB_SC-04921 [2,0,0,0,0,0|2,0,0]=4
22  B6R0.6  CCCCCCBr PHBB_SC-04802 [2,0,0,0,0,0|1,0,0]=3
23  B6R0.6  CCCCCCI PHBB_SC-05060 [2,0,0,0,0,0|1,0,0]=3
24  B6R0.6  CCCCCCN PHBB_SC-04051 [2,0,0,0,0,0|1,0,0]=3
25  B6R0.6  CCCCOC=O PHBB_SC-05072 [2,0,0,0,0,0|2,0,0]=4
26  B6R0.6  CCCNCCC PHBB_SC-05009 [2,0,0,0,0,0|1,0,1]=4
27  B6R0.6  CCOCCCN PHBB_SC-04954 [2,0,0,0,0,0|2,0,0]=4
28  B6R0.6  NCCCCCN PHBB_NC-02994 [2,0,0,0,0,0|2,0,0]=4
29  B6R0.6  NCCNCCO PHBB_SC-04079 [2,0,0,0,0,0|2,0,0]=4
30  B6R0.6  NCCOCCO PHBB_SC-05132 [2,0,0,0,0,0|2,0,0]=4
31  B6R0.6  NCCSCCO PHBB_SC-06478 [2,0,0,0,0,0|2,0,0]=4
32  B8R0.1  CCOC(=O)CCCCl PHBB_SC-05176 [1,1,0,0,0,0|2,0,0]=4
33  B8R0.6  CCCCCC(=O)CC PHBB_SC-04968 [1,1,0,0,0,0|0,0,1]=3
34  B8R0.7  CC(C)CNCCCO PHBB_SC-06894 [1,1,0,0,0,0|1,0,1]=4
35  B8R0.7  CCCCCCC(C)=O PHBB_SC-04965 [1,1,0,0,0,0|1,0,1]=4
36  B10R0.3  CC(C)=CCCC(C)CCO PHBB_NC-00148 [0,2,0,0,0,0|0,0,2]=4
37  B10R0.4  CCCCCCCCC(=O)O PHBB_SC-05232 [0,2,0,0,0,0|0,0,2]=4
38  B8R1.2  BrCC1CCCCO1 PHBB_SC-07896 [1,0,0,1,0,0|1,0,1]=4
39  B8R1.2  ClCC1CCCCO1 PHBB_SC-07949 [1,0,0,1,0,0|1,0,1]=4
40  B8R1.5  OC1CCCCC1O PHBB_SC-06981 [1,0,0,1,0,0|1,0,1]=4
41  B8R1.8  OCCN1CCCC1 PHBB_SC-02808 [1,0,0,1,0,0|1,0,1]=4
42  B8R1.22  O=C1CCCCCO1 PHBB_SC-04881 [1,0,0,1,0,0|1,0,1]=4
43  B10R1.377  OCCC1(O)CCCCC1 PHBB_NC-02264 [0,1,0,1,0,0|0,0,2]=4
44  B10R2.99  NCC1CC2C=CC1C2 PHBB_SC-03570 [0,0,0,2,0,0|1,0,0]=3