MMs03506982 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 57 0 0 1 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 0.7566 1.2952 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3566 0.2560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0133 2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5867 3.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4867 2.6057 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8867 1.5665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 3.9086 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8300 4.9478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 3.9162 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9300 3.9162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4867 2.6211 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0867 1.5818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7433 1.3182 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1433 0.2790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2433 1.3105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 0.0230 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7566 -1.2798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9866 2.6287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5813 3.6710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4734 5.2191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6733 5.2252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4734 5.2038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0681 6.2460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7699 3.8932 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2699 3.8856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0133 2.5827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0265 5.1807 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8674 5.4913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4235 6.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5433 7.5521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8385 6.7955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5171 4.2101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2566 1.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0361 0.6053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6053 -1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0361 -0.6053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7989 -1.8745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1619 -2.3221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7143 -0.6852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1752 4.9355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3812 5.9595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7231 7.5286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6556 8.3596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2536 8.5193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3322 7.8892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9778 6.4189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6212 3.4117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3155 3.3142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4130 5.0084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9577 -0.6100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5946 -1.0576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0422 0.5793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5191 5.3299 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.6782 5.6405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 25 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 55 1 0 0 0 0 30 31 1 0 0 0 0 30 43 1 0 0 0 0 30 44 1 0 0 0 0 31 32 1 0 0 0 0 31 45 1 0 0 0 0 31 46 1 0 0 0 0 32 47 1 0 0 0 0 32 48 1 0 0 0 0 32 55 1 0 0 0 0 33 49 1 0 0 0 0 33 50 1 0 0 0 0 33 51 1 0 0 0 0 33 55 1 0 0 0 0 34 35 1 0 0 0 0 35 52 1 0 0 0 0 35 53 1 0 0 0 0 35 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END