MMs00036151 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 61 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 1.2973 -0.7529 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2939 -2.2529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8954 -0.7588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1995 1.4882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9022 2.2412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6015 1.4941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5003 2.2353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5037 3.7353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7976 1.4823 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0983 2.2294 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0983 1.0294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2585 3.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7264 4.0294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4735 2.7286 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.0735 3.7679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4673 1.6162 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1567 0.4571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2143 0.3155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6823 0.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8424 2.1154 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.6910 1.2669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1432 2.8625 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.4405 2.1095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4371 0.6095 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7344 -0.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0352 0.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0386 2.1036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7412 2.8566 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.3393 2.8507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4995 4.3421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9674 4.6507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7144 3.3499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7082 2.2375 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6024 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0379 0.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6024 -1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0939 -2.2502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2912 -3.4529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4939 -2.2557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8927 -1.9588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2340 -0.6141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9049 3.4412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5636 2.0965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7949 0.2823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0585 3.7235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1358 4.9145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8050 -0.5697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8822 0.6213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1459 4.0625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7317 -1.3434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0730 0.0013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6095 5.1471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4580 5.7458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.9076 3.2218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 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 43 1 0 0 0 0 6 7 1 0 0 0 0 6 44 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 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 2 0 0 0 0 32 36 1 0 0 0 0 33 34 1 0 0 0 0 33 55 1 0 0 0 0 34 35 2 0 0 0 0 34 56 1 0 0 0 0 35 36 1 0 0 0 0 35 57 1 0 0 0 0 M END