MMs00895986 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 0.7573 -1.2948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0146 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4854 -2.6065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -3.9097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4707 -5.2045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0292 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7719 -3.8928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2719 -3.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0292 -5.1792 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5292 -5.1707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2719 -3.8675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2865 -6.4655 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8865 -5.4263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5438 -7.7688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3011 -9.0636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8011 -9.0551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5438 -7.7519 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7865 -6.4571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0437 -7.7434 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0522 -9.2434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0353 -6.2435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5437 -7.7350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2134 -6.5078 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0358 0.6058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6058 1.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0358 -0.6058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0912 -1.5706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -3.9165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6351 -6.2319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0569 -2.7038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3972 -3.4676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4351 -6.2218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6202 -7.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6289 -8.5453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1758 -9.4803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5161 -10.2441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5994 -10.2380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9310 -9.4592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5714 -5.2765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9118 -6.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5505 -8.9350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7437 -7.7282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5370 -6.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 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 19 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 M END