MMs01439579 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 1.5000 -0.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2444 -1.3088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7443 -1.3153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4887 -2.6175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9887 -2.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7443 -1.3283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2443 -1.3348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9887 -2.6370 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4886 -2.6435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2330 -3.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4774 -5.2416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7330 -3.9523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4774 -5.2546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9773 -5.2611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7330 -3.9653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2330 -3.9718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9773 -5.2741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2217 -6.5699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7217 -6.5634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9661 -7.8591 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 19.4773 -5.2806 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0052 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0052 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2967 1.1762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6294 0.3990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8842 -3.6542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5842 -3.6659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6044 1.0106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9045 1.0223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3842 -3.6737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2854 -1.4609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6180 -2.2380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3480 -5.6601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6806 -6.4373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1375 -2.9235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8375 -2.9352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8172 -7.6117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 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 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 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 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 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 M END