MMs03854995 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 1.2945 0.7579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2853 2.2579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8925 0.7737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2052 -1.4684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9107 -2.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6072 -1.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3127 -2.2421 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.5088 -2.2105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8032 -1.4526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1068 -2.1947 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1068 -0.9947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4012 -1.4368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7048 -2.1789 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7139 -3.6788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4195 -4.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1159 -3.6946 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9993 -1.4210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 0.0790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3028 -2.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5973 -1.4052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9009 -2.1473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1953 -1.3894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4989 -2.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6648 -3.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1338 -3.9252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8759 -2.6216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8655 -1.5130 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6063 1.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0356 -0.6063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6063 -1.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8852 1.9737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2316 0.6379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 -3.4262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0263 -0.5380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5689 -0.5286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6243 -0.5222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1670 -0.5128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8944 -3.4633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1312 -4.8039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1964 -5.3513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6537 -5.3606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5371 -3.0870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0798 -3.0776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8204 -0.4906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3630 -0.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1351 -3.0712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6778 -3.0618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4184 -0.4748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9611 -0.4654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7779 -4.4306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.6286 -5.0185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.0686 -2.4889 0.0000 H 0 0 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 2 0 0 0 0 2 4 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 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 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 M END