MMs00454397 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 66 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 -0.8494 -1.2364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3484 -2.6502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5382 -3.5636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6556 -5.0590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0093 -5.7051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2457 -4.8557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1283 -3.3603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7746 -2.7143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3488 -1.2759 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2622 -0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6885 1.2998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7493 -0.2822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3231 -1.6681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8102 -1.8642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7236 -0.6744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1499 0.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6627 0.9076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2107 -0.8705 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.1267 -7.2005 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4804 -7.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -3.0759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1778 -2.0432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8273 -0.5847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6161 -2.4689 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 -1.4362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3535 0.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1423 -1.8619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9666 -3.9274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8788 -4.9602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4049 -4.3531 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7554 -5.8116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 -6.8444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1937 -6.2373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9891 -0.6795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6795 0.9891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9891 0.6795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6665 -5.7385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3287 -5.3725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1174 -2.6808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5924 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2692 -2.9730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8806 1.6634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2037 2.0164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9973 -6.7635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5634 -8.3633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9636 -8.9295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5548 -4.1500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0547 -3.7895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5525 -0.5876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5203 0.3027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0731 1.1891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1867 -0.2581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8017 -3.0125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2930 -2.2025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4829 -0.7112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2752 -3.5269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 -6.9707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8413 -5.9741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7973 -7.6706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4937 -7.7146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8531 -7.3880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3444 -6.5779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5343 -5.0867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 20 21 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 M END