MMs00037965 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 62 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 1.3024 -0.7441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9005 -0.7322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1893 1.5237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8868 2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5912 1.5118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4849 2.2796 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7873 1.5355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0829 2.2915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3854 1.5474 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3854 2.7474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5490 0.0564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0176 -0.2488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7616 1.0536 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3616 0.0144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7529 2.1638 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4423 3.3229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4969 3.4662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9656 3.1610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1292 1.6700 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.9777 2.5185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4316 0.9259 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7272 1.6818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7204 3.1818 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.0160 3.9377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3184 3.1937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3253 1.6937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0297 0.9378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.6277 0.9496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6346 -0.5504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9370 -1.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2326 -0.5385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2258 0.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9233 1.7055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5214 1.7174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8170 2.4733 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5953 1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 0.5953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5953 -1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 -1.9322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2381 -0.5715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8813 3.4677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5492 2.1071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4794 3.4796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3490 0.0509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4290 -1.1376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0856 4.3550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1656 3.1665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4371 -0.2741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0105 5.1377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3549 3.7984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5981 -1.1551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9425 -2.4944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.2746 -1.1338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9178 2.9055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 44 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 47 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 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 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 55 1 0 0 0 0 34 35 1 0 0 0 0 34 56 1 0 0 0 0 35 36 2 0 0 0 0 35 57 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 37 58 1 0 0 0 0 38 39 3 0 0 0 0 M END