MMs00999058 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.3054 -0.7389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9034 -0.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5014 -0.6945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5142 -2.1945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7939 0.0665 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0993 -0.6723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1121 -2.1723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4175 -2.9112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7101 -2.1501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6973 -0.6502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 0.0887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1199 -0.1745 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0119 -1.3804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1406 -2.6014 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5118 -1.3676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2507 -0.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7507 -0.0494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5117 -1.3420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7729 -2.6474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2729 -2.6602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5339 -3.9400 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 20.0117 -1.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5911 1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0443 0.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5911 -1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5419 -1.6647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0846 -1.6515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8188 0.9348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3615 0.9480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1399 -1.6425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6825 -1.6293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4168 0.9570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9594 0.9702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7837 1.2665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0781 -2.7811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4278 -4.1111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3817 1.2887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6419 0.9718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3418 0.9949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6818 -3.7045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6028 -0.2849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 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 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 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 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 43 1 0 0 0 0 25 44 1 0 0 0 0 M END