MMs00513989 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 0.8372 -1.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -2.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0152 -3.8366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5117 -3.7338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1709 -2.3865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3337 -1.1419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2587 0.0390 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9294 1.1929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6676 -0.4758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6133 -1.9748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7942 -2.8998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1857 -2.3396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3665 -3.2646 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7580 -2.7045 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1978 -1.3130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3182 -4.0959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1495 -2.1443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3601 -0.6592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7516 -0.0990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9325 -1.0240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7218 -2.5091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3303 -3.0693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1197 -4.5544 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.9622 1.3861 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9122 0.3614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9957 0.6698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6698 0.9957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9957 -0.6698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0192 -2.6742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4878 -4.9145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1815 -4.7295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9014 -3.7016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4288 -3.9183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5510 -1.3212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0785 -1.5378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1980 -4.4527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4154 0.0808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0456 -0.5759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6665 -3.2491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5820 -0.6343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9079 1.0312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2424 1.3571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 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 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 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 26 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END