MMs02429179 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 53 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 0.7565 -1.2953 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3565 -0.2561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2564 -1.2878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0129 -2.5831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0149 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0224 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8999 1.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2435 1.3252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7434 1.3326 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4870 2.6354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9869 2.6429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7305 3.9456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2304 3.9531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9869 2.6578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2434 1.3551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7434 1.3476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2564 -1.2729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5129 -2.5756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0129 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -2.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2435 -1.3102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2306 -3.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7305 -3.9157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4741 -5.2185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9740 -5.2260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7176 -6.5287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9611 -7.8240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4611 -7.8165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7176 -6.5138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0362 0.6052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6052 1.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0362 -0.6052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3948 1.0512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1138 1.7300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4460 2.5080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3573 3.0402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6895 3.8182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1253 4.9819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8253 4.9953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1869 2.6638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8486 0.3188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1486 0.3054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6181 -3.6343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5281 -2.7330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8602 -3.5109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5792 -4.1897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9175 -6.5347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5559 -8.8662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8559 -8.8528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5176 -6.5078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7564 -1.2654 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 52 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 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 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 M CHG 1 52 -1 M END