MMs01726896 MOE2007 2D CORINA 3.40 0006 02.08.2006 87 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 1.2470 -0.8336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5925 -0.1705 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5532 0.4295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6909 1.3262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8395 -1.0042 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2469 -0.4853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6544 0.9583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1753 -1.6635 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3416 -2.9105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 -2.5030 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6741 -1.6050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3728 -0.2777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8717 -0.2191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6718 -1.4879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9731 -2.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4742 -2.8738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1707 -1.4294 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9708 -2.6981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4697 -2.6396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1684 -1.3123 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3683 -0.0435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8694 -0.1020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6673 -1.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4674 -2.5225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9662 -2.4640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6650 -1.1367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8648 0.1321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3660 0.0736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1638 -1.0781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.8626 0.2492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3614 0.3077 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 22.7614 1.3470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.2898 -0.8705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.6972 -0.3516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.6387 1.1472 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 24.1951 1.5547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.1192 1.3880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.0680 0.2262 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 29.5656 0.3109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.1089 -1.0873 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 28.9471 -2.0360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.6857 -1.2243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 26.1211 2.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.5924 2.8598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.0749 4.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.0861 5.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.6149 5.1158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.1324 3.6955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6611 3.4032 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 27.5686 6.8284 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6669 0.9976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9976 0.6669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6669 -0.9976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -1.7003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9564 -1.8015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8883 1.2475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7697 2.5236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4935 1.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7567 -4.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7327 0.7374 0.0000 H 0 0 0 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