MMs01646926 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 60 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 1.2974 0.7529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2941 2.2529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5915 3.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5882 4.5057 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2875 5.2528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0099 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3106 5.2471 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3139 6.7471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6146 7.4943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0165 7.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0191 8.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2842 6.7528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5816 7.5057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 4.4943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9086 5.2414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 4.4886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0066 3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8856 5.2586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8823 6.7586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1862 4.5114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3463 3.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8142 2.7113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5614 4.0120 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5552 5.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8639 6.5924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2894 7.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5981 8.5270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4811 9.5282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0556 9.0616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7469 7.5937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2338 2.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6023 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0379 -0.6023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6023 -1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7103 -0.3739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4787 0.9638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1128 2.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8812 3.3796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 1.8790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7728 3.2167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8346 3.5767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3773 3.5733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1393 6.1624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 6.1590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8083 5.5265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2439 3.8863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6038 3.4507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0445 2.3977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5137 2.7011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1830 6.2581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7385 8.9003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7281 10.7026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1620 9.8626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6065 7.2203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4289 2.9038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3438 1.2089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0387 1.1238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 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 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 2 0 0 0 0 19 21 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 32 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 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 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END