MMs02511312 MOE2007 2D CORINA 3.40 0006 02.08.2006 79 80 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 1.4872 0.1955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4001 -0.9948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8873 -0.7993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8002 -1.9896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2874 -1.7941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2003 -2.9843 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0411 -3.2949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6875 -2.7889 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3769 -3.9480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2618 -1.4032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7490 -1.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3234 0.1780 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6339 1.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8106 0.3734 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5000 -0.7857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5266 1.6915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0014 1.4178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1969 -0.0694 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.1969 -1.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8429 -0.7149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5149 -0.7855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7941 -0.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1121 -0.7180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3913 0.0654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7093 -0.6506 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 21.7093 0.5494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.9885 0.1329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3065 -0.5832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5020 -2.0704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.9768 -2.3441 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 27.1768 -2.3441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.6929 -1.0260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.6606 0.0623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.9343 1.5371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.6223 -3.6981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7483 -2.1501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4105 1.3682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6003 -3.9791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6259 -4.3700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1564 1.1898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1898 -0.1564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1564 -1.1898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1266 1.3400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5517 0.7493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3355 -1.5486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7607 -2.1393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5267 0.3452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9518 -0.2455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7356 -2.5434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1608 -3.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9268 -0.6496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3519 -1.2402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0903 -1.1432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3144 -0.2043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6964 -2.4066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9205 -1.4677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4180 2.1509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8677 2.8420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0958 2.6141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2010 1.4489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7677 -1.7244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3099 -1.6844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9991 0.8969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5413 0.9370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3649 -1.6570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9071 -1.6170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5963 0.9644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1385 1.0044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.1935 1.0318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.7357 1.0718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.6314 -2.8962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.5391 -4.2145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.1387 -4.7813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.7055 -3.1817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7250 -2.7769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2207 1.2118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7901 -3.8228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3562 -5.3222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 44 1 0 0 0 0 2 45 1 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