MMs01256727 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 1.3970 -0.5463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5686 0.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -0.0068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8398 1.2461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9031 2.4176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4994 1.8888 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4494 3.8146 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9323 4.0401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8690 2.8685 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3228 1.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2595 0.2999 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.7424 0.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6791 -0.6463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1329 -2.0433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1621 -0.4209 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0988 -1.5924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5818 -1.3670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1280 0.0300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6110 0.2554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5477 -0.9162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0014 -2.3132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5184 -2.5386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9722 -3.9356 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 1.1176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1176 0.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -1.1176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7725 -1.5710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2977 -1.3392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4381 -1.1298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3694 5.1576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3588 1.6624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7956 1.1005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5991 0.6967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0456 -2.1676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4824 -2.7295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3787 0.9672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0480 1.3730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7341 -0.7359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7508 -3.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 11 2 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 M END