MMs02386316 MOE2007 2D CORINA 3.40 0006 02.08.2006 80 84 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 1.3047 -0.7402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -2.2401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9027 -0.7205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1847 1.5392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5007 -0.7009 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6521 -1.5494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6778 -2.1904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1492 -2.4822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8486 -1.1106 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4486 -2.1498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8576 -0.0944 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2509 1.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6360 1.6322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6191 0.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2254 -0.7652 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7135 -0.7189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8965 -1.6689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9896 -0.0657 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.9910 0.9525 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3850 2.3160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7638 2.6773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7535 1.6445 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.6021 0.7960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3614 0.2734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2094 2.0057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6246 3.4471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0804 3.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5838 4.5273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9233 2.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5963 -1.4448 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.2857 -2.6040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2129 -1.7919 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1736 -2.3919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7990 -3.2337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3434 -3.5961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8406 -4.3130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4267 -5.7548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6398 -2.5223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2285 -3.9648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0947 -2.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1383 -3.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7021 0.8621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5921 1.0437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0437 0.5921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5921 -1.0437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1383 -1.6456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6809 -1.6339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4779 -2.2068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5687 -3.3854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8087 -3.6329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2637 -2.9269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0573 1.4084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1655 2.4817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8010 2.2090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9397 0.4596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3424 -2.0704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1912 2.4383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2926 3.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2684 3.7702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2607 3.0135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4438 -0.9238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5548 0.1477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4480 5.3599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7513 5.3915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1517 4.1111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7661 2.8603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4962 2.4275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0804 1.1519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2733 -5.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0956 -6.9082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5802 -6.0859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2763 -4.0697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9731 -4.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0003 -2.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4673 1.7865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7777 1.6273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9369 -0.0623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 2 3 2 0 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