Amb2589070 OpenBabel05082504382D 20 22 0 0 0 0 0 0 0 0999 V2000 5.1573 3.1495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3233 2.6680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3233 1.7049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1573 1.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1573 0.2604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3233 -0.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4893 0.2604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4893 1.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5734 -0.0372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8532 0.6021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9267 0.3011 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -1.3032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3745 -1.0022 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5213 -1.6044 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1989 -0.9650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1128 -1.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5888 -2.1058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5518 -2.1122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1018 -2.9366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 8 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 13 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 16 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 M END > www.ambinter.com > Amb2589070 > 287.38 $$$$