MMs01168798 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 56 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 1.2948 0.7573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2864 2.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5812 3.0145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5728 4.5145 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5336 3.9145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2696 5.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2612 6.7572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8677 5.2717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8593 6.7717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1709 4.5290 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4657 5.2863 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5049 5.8863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4573 6.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7689 4.5436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7773 3.0436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0637 5.3008 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3670 4.5581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5321 3.0672 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0010 2.7636 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7438 4.0668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7338 5.1759 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2346 4.2319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8371 5.6056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3279 5.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2164 4.5622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6140 3.1885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1231 3.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5024 1.9799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6058 1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0359 -0.6058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6058 -1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7115 -0.3681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4754 0.9722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1058 2.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8697 3.3826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 1.8892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7618 3.2295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8655 4.1273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0867 5.4589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4612 6.7639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2545 7.9571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0613 6.7504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1776 3.3290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6573 6.7930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4506 7.9862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2573 6.7795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0570 6.5008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1263 6.5725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8099 6.8697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4091 4.6943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6412 1.9244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5356 1.2692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2132 1.0131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4693 2.6907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 8 43 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 44 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END