MMs00039553 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 42 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 -1.4294 -0.4547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4387 -1.9547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -2.4270 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8742 -1.2189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6576 -2.8289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -4.3216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0241 -2.2103 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2431 -3.0845 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2039 -3.6845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2524 -4.5844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6818 -5.0392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5559 -3.8202 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6668 -2.6122 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.8259 -2.3016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0562 -1.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9198 -0.1845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4312 -0.5642 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7565 -1.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8945 -0.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3098 -0.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5871 -2.2623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4492 -3.2395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0339 -2.7426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0548 -3.8790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6530 -5.2546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.4478 0.1891 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.3779 1.1390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3959 0.2566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0741 -1.2264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1422 -1.0161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0582 -4.4664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0101 -5.7597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2005 -6.1384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7247 -5.6327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4776 0.6349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6727 0.8881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7194 -2.6598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6710 -4.4188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M END