MMs00172072 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2954 -0.7563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8934 -0.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8861 -2.2690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0254 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4914 -0.7818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8015 1.4618 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5061 2.2182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2034 1.4746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 2.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1115 3.7055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3995 1.4491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7728 2.0525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7710 0.9329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2710 0.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0147 -0.3771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2583 -1.6725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7583 -1.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0147 -0.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5490 -0.0434 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.0919 3.5182 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6051 1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0363 0.6051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6051 -1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5195 -1.6718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0622 -1.6794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7156 -1.6972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2583 -1.7048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1990 -1.1678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9769 0.1644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 3.1337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7393 3.1412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0207 1.2720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7985 2.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8761 1.9618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2146 -0.3830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8532 -2.7146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1532 -2.7014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 M END