MMs01727406 MOE2007 2D CORINA 3.40 0006 02.08.2006 78 85 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 0.7421 1.3036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0158 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7263 3.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0316 5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5316 5.1869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2737 3.8834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5158 2.5889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2579 1.2853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7736 3.8742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5157 2.5707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7105 6.4996 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4895 6.4996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0474 7.7941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5474 7.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3053 9.0794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5632 10.3830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0632 10.3921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6947 9.0977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1947 9.1068 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5947 10.1460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9525 7.8123 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8011 8.6609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2105 6.5088 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8999 5.3496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2209 5.4002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 3.9311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5875 6.0186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4216 7.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9367 10.4104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4367 10.4195 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8367 11.4587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1788 11.7231 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7788 12.7623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6788 11.7322 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8788 11.7322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4367 10.4377 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0367 9.3985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6946 9.1342 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0946 8.0949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1946 9.1250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4525 7.8397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9524 7.8488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6945 9.1524 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2945 8.1132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9366 10.4468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1945 9.1615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0835 7.9534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5073 8.4256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4981 9.9255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0688 10.3804 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4209 13.0358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4209 13.0175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5736 11.4916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9402 10.8732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7744 9.3824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0429 0.5937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5937 -1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0429 -0.5937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9263 3.9089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1379 6.2225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4578 1.2780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5586 3.1643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1094 1.5278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4729 1.9770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 6.7421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5305 11.4350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5398 8.7036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6216 7.5167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3273 7.4224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6680 6.6592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7197 6.8099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4824 7.7261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4647 10.6368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8145 14.0713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0146 14.0604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3180 12.0121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1125 10.6165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 57 1 0 0 0 0 1 58 1 0 0 0 0 1 59 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 60 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 6 61 1 0 0 0 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