MMs00245948 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 60 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 0.7519 1.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0038 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2519 1.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2519 1.2913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5038 2.5915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0038 2.5937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7519 1.2891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6354 2.5013 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0613 2.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0591 0.5357 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6318 0.0743 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2761 2.9156 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2369 3.5156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1215 4.4076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3363 5.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7057 4.6754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8603 3.1834 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6455 2.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2297 2.5712 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.6176 1.2018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8419 3.9407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5992 1.9591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2341 0.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3116 -0.5394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7541 -0.1280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1191 1.3269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0417 2.3705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8823 3.6128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1246 2.7722 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 16.6400 4.4534 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 18.7229 4.8551 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.0383 0.6015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6015 -1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0383 -0.6015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4481 1.2979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0439 3.1965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5946 3.6382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0363 1.9996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3985 -1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0985 -1.0467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1053 3.6298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4054 3.6338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9675 4.0785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5970 5.4869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4743 6.1224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0088 6.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9978 5.8393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9027 4.5899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9730 1.3096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5075 1.4686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0801 0.1751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0196 -1.7033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6161 -0.9629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2731 1.6559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 M END