MMs02457737 MOE2007 2D CORINA 3.40 0006 02.08.2006 66 70 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 1.4997 0.0287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8896 0.5929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8557 -0.5545 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4557 0.4847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0629 -1.8279 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2144 -2.6765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6069 -1.4675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0290 -2.9754 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0682 -3.5754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4188 -2.4112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3117 -0.9150 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3509 -1.5150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4592 0.0511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1962 1.5279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8696 -0.4596 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0170 0.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4274 -0.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5749 0.9620 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9853 0.4513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2482 -1.0255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1327 1.4174 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5431 0.9067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8060 -0.5701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2164 -1.0807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3639 -0.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1009 1.3621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6906 1.8728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6686 -4.4314 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2787 -4.9957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3859 -6.4918 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8419 -6.8523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6347 -5.5789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1338 -5.6287 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8402 -6.9520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0475 -8.2254 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6126 -9.2840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5483 -8.1755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7556 -9.4489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7703 1.3394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0229 1.1998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1998 -0.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0229 -1.1998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0799 -1.6410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0965 1.2763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6153 1.5468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8291 -1.0444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3479 -0.7739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3645 2.1434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9224 2.5988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2325 2.0658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6060 -0.5721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5996 -1.7522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6182 -2.1210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1370 -1.8505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9656 -1.1529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4908 0.2977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3009 1.3641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3074 2.5443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7700 2.6426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2888 2.9130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -4.3615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0396 -6.9919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8189 1.9229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1868 2.3880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2782 0.7559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 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 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 29 33 1 0 0 0 0 30 31 2 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 38 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 35 63 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 38 39 2 0 0 0 0 40 64 1 0 0 0 0 40 65 1 0 0 0 0 40 66 1 0 0 0 0 M END