0  B29R4.610556834  CCC1=CC(=C(C=C1O)O)C2=NNC(=C2C3=CC4=C(C=C3)OCCO4)C Molport-000-424-874 [0,0,0,0,0,0|0,0,2]=2
1  B28R4.62641442  CCC1=CC(=C(C=C1O)O)C2=NNC=C2C3=CC4=C(C=C3)OCCO4 Molport-000-218-922 [1,0,0,0,0,0|0,0,2]=3
2  B30R4.365327255  CCC1=CC(=C(C=C1OC)O)C2=NNC(=C2C3=CC4=C(C=C3)OCCO4)C Molport-000-218-923 [0,1,0,0,0,0|0,0,2]=3
3  B30R4.488019736  CCCC1=CC(=C(C=C1O)O)C2=NNC(=C2C3=CC4=C(C=C3)OCCO4)C Molport-000-424-873 [0,1,0,0,0,0|0,0,2]=3
4  B29R4.610643416  CCC1=CC(=C(C=C1OC)O)C2=NNC=C2C3=CC4=C(C=C3)OCCO4 Molport-000-218-863 [1,1,0,0,0,0|0,0,2]=4
5  B31R4.999903078  CCC1=CC(=C(C=C1OC)O)C2=NNC(=C2C3=CC4=C(C=C3C)OCCO4)C Molport-019-855-527 [0,2,0,0,0,0|0,0,2]=4