MMs01653082 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 59 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 1.2952 0.7565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8933 0.7696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0262 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4913 0.7827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4838 2.2827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0894 0.7958 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5565 -1.4386 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0252 -1.7431 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7687 -0.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7594 0.6693 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0639 2.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9441 3.1362 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.9833 3.7362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0934 4.6287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7200 5.2319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7220 4.1122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4785 2.8169 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2597 -0.2760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0031 1.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4719 0.7223 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.3596 1.5297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6362 -0.7687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2690 -1.3857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1197 -2.8782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3376 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7049 -3.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8541 -1.6442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6052 1.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0362 -0.6052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6052 -1.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5193 1.6719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 1.6797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8313 -0.9100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 -0.9023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1173 1.6850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 1.6927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2021 -1.1738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0274 -0.8839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5701 -0.8761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1787 1.6942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6946 3.1590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2684 4.3851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4585 5.7718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3148 6.2742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7457 5.9324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9145 4.9999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7547 3.4019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5095 2.1206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0259 -3.3718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2182 -4.9478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6792 -3.8372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9479 -1.1506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 M END