MMs01727301 MOE2007 2D CORINA 3.40 0006 02.08.2006 88 93 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 1.2184 0.8749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5853 0.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7338 -1.2354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1008 -1.8530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3191 -0.9781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1706 0.5145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8037 1.1322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5443 1.1170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8003 2.2894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5418 -0.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7846 -1.2981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5274 -2.6013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0274 -2.6096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0418 -0.0115 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4418 1.0277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7990 1.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2989 1.2750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6989 2.3143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0417 -0.0281 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.6417 -1.0674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2845 -1.3230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5417 -0.0364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2989 1.2584 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.8989 2.2977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5561 2.5616 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9561 3.6008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0561 2.5699 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.6561 1.5307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3133 3.8731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0705 5.1679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8133 3.8814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0705 5.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3133 3.8565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8132 3.8482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7989 1.2501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5417 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7845 -1.3479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0416 -0.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7844 -1.3645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2844 -1.3728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0416 -0.0780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5416 -0.0863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2844 -1.3894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5272 -2.6843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0272 -2.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2700 -3.9875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.5128 -5.2823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7843 -1.3977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.5271 -2.7009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2987 1.2086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.5560 2.5118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 0.9747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9747 -0.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -0.9747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7591 -1.9353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2196 -3.0471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6849 2.3263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3975 -3.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7292 -3.7842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8125 -3.7902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1527 -3.0262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6736 1.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0139 2.4639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4099 -1.7397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0696 -2.5036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3268 -1.2170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6670 -0.4531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1131 5.7788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4763 6.2271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0280 4.5903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8066 2.6482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0132 3.8415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8199 5.0481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6474 0.9745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1787 -2.4004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4474 0.9646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4215 -3.7119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4769 -4.6766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9071 -6.3182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.5487 -5.8881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.4846 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