MMs01156939 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 51 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 0.0043 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2926 -2.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3055 -2.2463 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2662 -2.8463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3097 -3.7463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6023 -1.4926 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9035 -2.2389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9078 -3.7389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2004 -1.4852 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3519 -0.6366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3529 0.0071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8193 0.3231 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5730 -0.9738 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1730 0.0654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5725 -2.0914 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8885 -3.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3164 -4.0171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7767 -4.5646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0927 -6.0309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9809 -7.0378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0652 -1.1263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6792 -2.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1714 -2.6474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0496 -1.4314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4356 -0.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9434 0.0897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3294 1.4583 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0034 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8956 -1.2162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3301 -2.8567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6897 -3.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1097 -3.7497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3132 -4.9463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5097 -3.7429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5989 -0.2926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 0.0036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2241 1.2001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1379 -3.5487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6653 -5.0173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1754 -6.1483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0914 -7.8433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7864 -7.9272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9766 -3.4677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6626 -3.7423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2434 -1.5534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1382 0.9100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 M END