0 B5R0.1 CC(=O)NC#N 96e7b4266c4f58edb3348aa5d4644bfa [0,2,0,0,0,0|1,0,0]=3 1 B5R0.1 CC(C)OCF fea4e57e7bb4fa505ef4ea18bd2ede99 [0,2,0,0,0,0|1,0,1]=4 2 B5R0.1 CCOC(C)C e40579e838af0384b34ea3d488054b89 [0,2,0,0,0,0|1,0,1]=4 3 B5R0.3 CCN(C)C=O 60ddb02da2ac3e0bbf46f02c328ae40d [0,2,0,0,0,0|2,0,0]=4 4 B5R0.3 CCN(C)CO 992ae963459eb3513b2ca42228fd2ef7 [0,2,0,0,0,0|2,0,0]=4