MMs01727068 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 -0.0108 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0284 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2828 -2.2593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5872 -1.5186 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8808 -2.2780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 -3.7779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1852 -1.5373 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1852 -2.7373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4788 -2.2966 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7832 -1.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0769 -2.3153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0661 -3.8153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3597 -4.5746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6641 -3.8340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6749 -2.3340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3813 -1.5747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3152 -2.2406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 -3.7406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6088 -1.4813 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7549 0.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2198 0.3340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9791 -0.9596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9835 -2.0815 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1426 -2.3921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3059 -3.5465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1984 -4.5581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0086 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 0.0043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5049 -3.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0475 -3.1841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3960 -0.0460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2046 1.1626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 -0.0287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4702 -3.4966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0769 -1.1153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8858 -3.5984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6475 -4.9399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5817 -5.4883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1244 -5.4994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0664 -4.9645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8473 -3.6341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8551 -2.5509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0934 -1.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6165 -0.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1592 -0.6610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1549 0.0073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6208 1.2041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8408 1.4726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3125 0.8300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9448 -0.2473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7885 -1.8456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7358 -3.9997 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 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 14 19 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 56 1 0 0 0 0 M CHG 1 56 -1 M END