0  B33R2.4054562761  CC[C@H](C)C(=O)O[C@H]1C[C@@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H](O)C[C@@H](O)CC(=O)NC#N)O 95ab272b6aacaf4d27348d3e94a44dcf [0,2,0,0,0,0|1,0,0]=3
1  B33R2.4054562761  CC[C@H](C)C(=O)O[C@H]1C[C@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H](O)C[C@@H](O)CC(=O)NC#N)C 42ecfd26fa13338601f8cbc52bdf9959 [0,2,0,0,0,0|2,0,0]=4