MMs01355481 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 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 -0.7587 -1.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0527 -0.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5175 -2.5879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5352 -2.0527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8393 -1.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1332 -2.0702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1231 -3.5702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8191 -4.3114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5251 -3.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4171 -4.3289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 -5.8289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7211 -3.5877 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0151 -4.3464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0050 -5.8464 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3192 -3.6052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6131 -4.3639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9172 -3.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9273 -2.1227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6333 -1.3640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3293 -2.1052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2313 -1.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2415 0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5455 0.8597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8395 0.1010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8294 -1.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5253 -2.1402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1435 0.8422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0352 -0.6070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 1.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5176 0.3035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7492 -0.0176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0879 0.0718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3562 -1.0528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0351 -2.2844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1245 -3.6231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4823 -3.1949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8474 -0.1115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1765 -1.4772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -5.5114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5181 -4.1456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7292 -2.3877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8356 -5.2780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3782 -5.2884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3200 -4.7531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1003 -3.4223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4109 -0.4500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8682 -0.4396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1461 -2.3056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9265 -0.9748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2063 0.7255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5536 2.0597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8645 -2.0060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5172 -3.3402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1787 0.2352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 41 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 42 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 M END