MMs01852953 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 0.7593 -1.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2592 -1.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0185 -2.5765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2778 -3.8809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7779 -3.8916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0186 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4814 -2.6087 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0215 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2592 -1.2614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2406 1.3366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7405 1.3473 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4812 2.6517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9812 2.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7219 3.9668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1913 3.6654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3985 4.5558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7731 3.9555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9406 2.4649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7334 1.5745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3587 2.1748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9928 1.5549 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9626 5.2604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4626 5.2497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7219 3.9453 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0349 0.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6074 1.0349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0349 -0.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2185 -2.5679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8853 -4.9158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1853 -4.9351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3925 1.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 1.7389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4405 2.5198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2645 5.7483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7389 4.6678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0403 1.9847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8674 0.3820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8552 6.2846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 26 2 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 M END