MMs00300054 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 1.5000 -0.0108 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9000 1.0284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2593 1.2828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7593 1.2720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7405 -1.3260 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1405 -2.3653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2406 -1.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4811 -2.6305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9811 -2.6413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7405 -1.3477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7217 -3.9457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9624 -5.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7030 -6.5437 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2029 -6.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9436 -7.8589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9623 -5.2609 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2217 -3.9565 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4217 -3.9565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9810 -2.6629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2404 -1.3585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4997 -0.0757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2403 -1.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4810 -2.6737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7403 -1.3909 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 13.4809 -2.6954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4996 -0.0974 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.4624 -5.2285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0087 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0087 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1347 1.7013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4762 2.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5594 2.4552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8898 1.6742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4247 0.7322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4135 -0.8104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -1.7175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4404 -2.4985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0955 -7.5786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1623 -5.2696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6404 -1.3542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4073 0.9786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0735 -3.7173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4711 -4.0285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2624 -5.2198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4538 -6.4284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2591 1.2179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6666 2.2614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 42 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 43 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END