MMs02560639 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 38 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 -1.5000 -0.0028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2476 -1.3033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4951 -2.6009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0049 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7524 -1.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2427 -3.9013 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9422 -4.6489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5431 -3.1538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9902 -5.2018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4902 -5.2046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3696 -6.4198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9034 -7.8455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7971 -5.9589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0090 -6.8429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3804 -6.2353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5400 -4.7439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9115 -4.1363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1233 -5.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9638 -6.5118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5923 -7.1193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4948 -4.4127 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.7999 -4.4589 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3742 -3.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9133 -2.5653 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1019 1.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4476 -1.3055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6068 -3.6362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9524 -1.2954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3883 -6.2399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8813 -8.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5705 -4.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0391 -2.9431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9332 -7.2189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4646 -8.3125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 24 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 23 1 0 0 0 0 15 16 1 0 0 0 0 15 32 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 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 M END