MMs01659632 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 47 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 1.3017 0.7454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8997 0.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4978 0.7271 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4978 -0.4729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5031 2.2271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0959 0.7179 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6939 0.7088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0458 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9850 -1.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6833 -2.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3870 -1.5366 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2814 -2.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2761 -3.8004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5725 -4.5549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8742 -3.8095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8795 -2.3095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5831 -1.5550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 -0.0550 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 18.1706 -4.5641 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5963 1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0413 -0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5963 -1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5336 1.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0763 1.6619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8235 -0.9257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3662 -0.9311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1316 1.6582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6743 1.6528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4215 -0.9348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9642 -0.9403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7031 2.2229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5073 3.4271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3031 2.2313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0196 -0.9440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5623 -0.9494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1001 1.9179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4514 -3.2132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9088 -3.2077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2348 -4.3967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5683 -5.7549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9208 -1.7132 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 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 M END