MMs01729626 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 -0.6057 1.3723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 1.5338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9826 0.3231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3768 -1.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8855 -1.2107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2798 -2.5830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2115 -2.7445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9574 -4.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3429 -5.4143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4256 -3.7387 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5871 -2.2474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2187 -1.6330 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8885 -1.5016 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8933 -0.0016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1947 0.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4866 -1.5098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1852 -2.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7928 0.7360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0894 -0.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3908 0.7278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7028 2.9060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -0.1292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1027 2.3408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1756 0.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0852 -2.0178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9882 -3.5515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7109 -0.2062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4864 1.1273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4263 1.6660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9690 1.6611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8934 -2.6388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6690 -1.3052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4109 -3.1725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9536 -3.1774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5670 1.6528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0243 1.6577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3151 -0.9349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8578 -0.9398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4281 0.1245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8958 3.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4913 -0.0098 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 42 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 M END