MMs02514559 MOE2007 2D CORINA 3.40 0006 02.08.2006 81 82 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 1.5000 0.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2427 1.3117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2573 -1.2864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5146 -2.5896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3292 -5.1944 0.0000 H 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 -0.7281 -3.9013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7427 -1.3032 0.0000 N 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 1.5292 -5.1876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7719 -3.8760 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5292 -5.1708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3292 -5.1708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7865 -6.4740 0.0000 C 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 6.0438 -7.7603 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 6.0584 -10.3584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5584 -10.3668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8011 -9.0720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0291 -5.1623 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7718 -3.8591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0145 -2.5643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2718 -3.8506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0145 -2.5474 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5145 -2.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2571 -1.2357 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2717 -3.8338 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8717 -2.7945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5291 -5.1370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7717 -3.8253 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5290 -5.1201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7863 -6.4234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0290 -5.1117 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.4290 -6.1509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7717 -3.8084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2717 -3.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0143 -2.4968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5143 -2.4883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2716 -3.7831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5289 -5.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0289 -5.0948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7716 -3.7747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0068 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0068 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 1.0477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2852 0.7175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8368 2.3543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2001 1.9058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1722 -0.5099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1809 -2.0525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4456 -0.7819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9427 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -2.8334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8629 -5.7078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8716 -7.2505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6379 -6.7178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0010 -9.0484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6642 -11.3942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9643 -11.4094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6011 -9.0788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6350 -6.1982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0701 -5.0336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8368 -4.0527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4086 -1.5116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0078 -4.8399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9349 -6.1796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5717 -5.7311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3659 -2.7827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6418 -3.4044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9734 -2.6255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4085 -1.4609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1085 -1.4457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1348 -6.1222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4348 -6.1374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3657 -2.7321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1922 -7.4491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7863 -6.4065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.9863 -6.3997 0.0000 H 0 0 0 0 0 0 0 0 0 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