MMs01707462 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 0.4136 -1.4418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5097 -2.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3292 -3.8674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7711 -3.4538 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8232 -1.9547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0667 -1.1158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9619 0.3806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4150 -1.7732 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6584 -0.9342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5536 0.5621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7971 1.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1453 0.7437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2501 -0.7527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0067 -1.5916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5984 -1.4101 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.2558 -0.0618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9410 -2.7583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9467 -2.0675 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2710 -1.3631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3502 -2.4049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6928 -3.7532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2073 -3.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3888 1.5826 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1535 0.3309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3309 1.1535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1535 -0.3309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -2.5822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0811 -4.9951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4988 -2.9702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 1.0880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7132 2.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0905 -2.7887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5999 -0.3683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1902 -0.5916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0888 -1.4592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3679 -3.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8204 -4.1635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4026 -4.9176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0103 -3.6285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1656 -4.7439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 6 7 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 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END