MMs02714579 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 63 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 0.8532 -1.2337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3482 -1.1117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2014 -2.3454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5596 -3.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0645 -3.8232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2114 -2.5895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4128 -4.9349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9162 -6.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1088 -7.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3426 -6.4068 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4749 -6.8041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9124 -4.9698 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9174 -8.7477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5332 -9.3257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3405 -8.4161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -6.9283 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4928 -7.5283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3393 -6.0186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5308 -4.5309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6619 -3.6212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -4.1993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2375 -5.6870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0448 -6.5967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6216 -6.2650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8143 -5.3554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1985 -5.9334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3899 -7.4211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7741 -7.9992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9668 -7.0895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7753 -5.6018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3911 -5.0237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1997 -3.5360 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.2387 -3.2896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0472 -1.8019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0436 -8.9941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4278 -9.5721 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3417 -10.8135 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 0.6826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6826 0.9870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -0.6826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8617 -0.0271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3974 -2.2478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8078 -4.3655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9847 -2.6871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6381 -4.0685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5087 -2.4310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -7.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9739 -7.2752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 -7.0783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4358 -8.1489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9273 -9.1894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0741 -7.5519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7294 -4.8740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -1.9550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 -0.6117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2374 -1.6487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2344 -11.2759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2959 -11.5412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 2 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 34 35 1 0 0 0 0 35 55 1 0 0 0 0 35 56 1 0 0 0 0 35 57 1 0 0 0 0 36 37 3 0 0 0 0 38 58 1 0 0 0 0 38 59 1 0 0 0 0 M END