Isovalerylalanine.mol Mrv1652305271900172D 12 11 0 0 0 0 999 V2000 1.6500 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 0.3572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -0.3572 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4125 -1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0625 0.3572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0625 -1.0717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 1.0717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0625 -1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0625 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 1 3 1 0 0 0 0 3 4 1 6 0 0 0 1 5 2 0 0 0 0 1 6 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 2 7 1 0 0 0 0 M END