MMs01454803 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 65 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 0.7466 -1.3010 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4534 -1.3010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2466 -1.3050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9931 -2.6060 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2397 -3.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7397 -3.8991 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4603 -3.8991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0068 -2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0137 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4931 -2.6099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2397 -3.9109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2466 -1.3129 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8466 -0.2736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4931 -2.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9931 -2.6218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7465 -1.3247 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2465 -1.3287 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2426 -2.8287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2505 0.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7465 -1.3326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4931 -2.6336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9931 -2.6376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7465 -1.3405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9999 -0.0395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 -0.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7534 1.2575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2534 1.2536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9999 -0.0474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2465 -1.3445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0408 0.5973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5973 1.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0408 -0.5973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0413 -0.1226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8109 -1.1012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3663 -4.3164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0282 -5.0842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0513 -4.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6164 -6.2338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -5.7989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5408 0.5854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9027 1.0290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9796 -0.3105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6984 -3.8001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3644 -3.0253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7816 -3.8030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1197 -3.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1287 0.3837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7947 1.1586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7115 1.1615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3734 0.3936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8904 -3.6713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5904 -3.6784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9027 1.0052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0481 2.4359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3821 1.6611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9212 0.7215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9172 -0.8212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7466 -1.3168 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 62 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 16 62 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 20 62 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 33 1 0 0 0 0 28 29 1 0 0 0 0 28 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 58 1 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 M END