MMs02519393 MOE2007 2D CORINA 3.40 0006 02.08.2006 81 84 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 -0.7444 1.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0112 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5112 2.5916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2556 1.2893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2668 3.8873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7668 3.8808 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5225 5.1766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0224 5.1701 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4224 4.1309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7780 6.4659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0337 7.7682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5337 7.7746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7893 9.0639 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2892 9.0574 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6892 10.0966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0336 7.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5336 7.7487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2892 9.0444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2779 6.4464 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5223 5.1507 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7223 5.1507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0224 5.1572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2667 3.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0111 2.5591 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7668 3.8679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2667 3.8484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7667 3.8419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5111 2.5396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0111 2.5331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7554 1.2309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2554 1.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0110 2.5202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2667 3.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7667 3.8289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0448 10.3532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3005 11.6555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0561 12.9512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3117 14.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0673 15.5493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3230 16.8516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8230 16.8581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0674 15.5623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8117 14.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6045 -1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9444 1.3075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5842 3.6399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4556 1.2841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0955 -1.0483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 4.3026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4803 5.0682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3966 5.5919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7359 6.3575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2360 6.0782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2393 6.8496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1938 10.1057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4689 7.5524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1352 7.1638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4779 6.4412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1291 5.7476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4594 5.3648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1623 2.8313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1373 3.4429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4700 2.6657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3817 2.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7143 1.3570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1509 0.1943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8509 0.1826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2110 2.5150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8711 4.8591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1712 4.8707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9607 9.5779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9674 11.1206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9720 12.1759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9787 13.7186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2673 15.5441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9275 17.8882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2275 17.8999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8674 15.5675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2072 13.2234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 46 1 0 0 0 0 2 3 2 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 48 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 49 1 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 51 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 53 1 0 0 0 0 9 54 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 12 13 1 0 0 0 0 12 55 1 0 0 0 0 12 56 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 57 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 37 1 0 0 0 0 18 19 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 60 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 66 1 0 0 0 0 30 67 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 68 1 0 0 0 0 33 34 1 0 0 0 0 33 69 1 0 0 0 0 34 35 2 0 0 0 0 34 70 1 0 0 0 0 35 36 1 0 0 0 0 35 71 1 0 0 0 0 36 72 1 0 0 0 0 37 38 1 0 0 0 0 37 73 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