0 B5R0.1 COC[C@@H](C)N 3696 [1,0,0,0,0,0|3,0,0]=4 1 B7R0.2 CC[C@@H](C)CC(=O)O 911 [0,1,0,0,0,0|2,0,0]=3 2 B7R0.2 CC[C@H](C)CC(=O)O 916 [0,1,0,0,0,0|2,0,0]=3 3 B7R0.16 CC(C)[C@@H](O)C(=O)O 4139 [0,1,0,0,0,0|2,0,0]=3 4 B6R0.3 CC[C@H](O)C(=O)O 3680 [1,1,0,0,0,0|2,0,0]=4 5 B6R0.7 CC(C)(C)C(N)=O 213 [0,1,0,0,1,0|1,0,0]=3 6 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O 4121 [0,2,0,0,0,0|2,0,0]=4 7 B8R0.27 CC(C)(C)[C@@H](O)C(=O)O 4582 [0,2,0,0,0,0|2,0,0]=4 8 B6R1.2 N=C1CCCS1 2998 [1,0,0,1,0,0|1,1,0]=4 9 B8R1.51 CC1(C)C=CC(=O)C1 2961 [0,0,0,1,0,1|1,0,0]=3