MMs02188264 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 54 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 0.0021 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3022 -2.2482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3042 -3.7482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0063 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0083 -6.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3084 -6.7482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3105 -8.2482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6106 -8.9964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9086 -8.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9065 -6.7446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6064 -5.9964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6043 -4.4964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9023 -3.7446 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2024 -4.4928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2045 -5.9928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5004 -3.7410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2446 -6.5913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9498 -4.1272 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6392 -5.2863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3360 -2.6778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8866 -2.2915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1348 -0.9935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8339 -2.5972 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2339 -1.5579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3734 -3.9968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2090 -4.9424 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.8283 -3.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3786 -5.1101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6491 -1.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9662 -0.0025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0017 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -1.2933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4068 -2.6282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0338 -3.9014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0301 -6.6014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2721 -8.8496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6123 -10.1964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9486 -8.8431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4257 -6.4439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9007 -2.5446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1202 -4.7958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9923 -3.3400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5364 -2.4679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4880 -5.9143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1828 -6.0008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2693 -4.3059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1471 -1.4144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7993 -0.4071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 50 51 1 0 0 0 0 M END