MMs01683577 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 50 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 1.2960 0.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6041 -1.4895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8941 0.7657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 2.2657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1840 3.0209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4861 2.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4921 0.7762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7821 3.0314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0841 2.2866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3801 3.0419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3741 4.5419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6822 2.2971 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9782 3.0523 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.0174 3.6523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9721 4.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2802 2.3076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5762 3.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8783 2.3181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8843 0.8181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 0.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2863 0.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1864 0.0733 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.4416 -1.2287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9311 1.3754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.4884 -0.6714 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6042 1.0368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0368 -0.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6042 -1.0368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 1.6714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0636 1.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8464 2.8615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1792 4.2209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5338 0.1804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2009 -1.1790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3165 1.3643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8592 1.3705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6870 1.0971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1721 4.5572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9673 5.7523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7721 4.5475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5714 4.2628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9151 2.9222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5932 -1.1372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2495 0.2034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4933 -1.8714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5252 -0.0673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 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 40 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 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 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END