MMs00550882 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 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 1.4928 -0.1472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1117 -1.5136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6044 -1.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4783 -0.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8594 0.9248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3666 1.0720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 -0.5888 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9676 0.5323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6463 1.9975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3418 -0.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6360 0.6894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9398 -0.0523 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2340 0.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2243 2.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5185 2.9644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8224 2.2227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8320 0.7228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5378 -0.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1358 -0.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1455 -1.5189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1166 2.9811 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.1946 -1.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7294 -1.8830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3157 -2.5582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1178 1.1942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1942 0.1178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1178 -1.1942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4126 -2.4889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0995 -2.7539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5585 1.9001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8715 2.1651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6282 1.8893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9475 -1.2522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1813 2.7993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5108 4.1643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5455 -1.2356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5185 -3.4552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2126 -3.3554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1129 -1.6613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4300 0.7394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4731 0.1461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 41 42 1 0 0 0 0 M END