MMs03949161 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 -0.2424 -1.4803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8126 -2.5465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1246 -3.8794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3557 -3.6370 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5825 -2.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9154 -1.4662 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.1777 -2.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5106 -1.5885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5812 -0.0902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7729 -2.3989 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1058 -1.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1764 -0.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5093 0.4755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7716 -0.3348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7010 -1.8332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3681 -2.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2975 -4.0195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9646 -4.7075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1042 -2.3633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6491 -3.7609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1319 -3.9877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0697 -2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5248 -1.4195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0420 -1.1927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2185 0.0610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1842 -0.1940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 1.1842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1842 0.1940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9988 -2.3650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6638 -4.9515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3639 -3.1585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9049 -3.2311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7164 -3.5975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1666 0.4358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5658 1.6742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5150 -5.7738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8983 -5.2579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4142 -3.6412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8988 -4.6974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5678 -5.1057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2559 -2.9985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2750 -0.4830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 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 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 M END