MMs02508736 MOE2007 2D CORINA 3.40 0006 02.08.2006 81 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 1.5000 0.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7948 0.7656 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3705 1.1899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7864 2.2656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0813 3.0228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3845 2.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3928 0.7801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 0.0229 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1064 -1.4771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8116 -2.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5083 -1.4916 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5083 -2.6916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2135 -2.2488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4012 -0.7199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6960 0.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9909 0.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9825 2.2946 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6793 3.0373 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6709 4.5373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9658 5.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2690 4.5518 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2773 3.0518 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3166 3.6518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5805 2.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8754 3.0663 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8670 4.5663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5638 5.3090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6326 1.7715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3754 3.0747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1181 4.3779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2606 6.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9741 3.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2857 1.5518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7427 1.3032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0067 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0067 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1961 2.1581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3697 3.3909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3048 3.9378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8475 3.9464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2870 -1.2621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5231 -2.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -3.1493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0453 -3.1579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -1.6547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 -1.7624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4438 -1.3141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9954 0.3227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9298 -0.8862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4725 -0.8776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4076 -0.3307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1715 1.0096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4903 4.3223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 5.6626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1893 6.2095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7320 6.2181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8143 1.3855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9688 1.8516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0499 4.3645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2711 5.6962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7873 6.2240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3300 6.2326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1147 1.4686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2384 0.7356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6685 2.3773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4606 6.0585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2539 7.2518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0606 6.0451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5799 2.7587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4921 4.0975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3683 4.8304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6915 0.5093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3283 0.9577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8799 2.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2607 1.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1369 2.3391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2931 0.6974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1326 1.7799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3326 1.7866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 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