MMs01545257 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 0.8415 1.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1868 2.5913 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8939 3.9142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1457 4.9955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4954 4.3409 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2898 2.8550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3711 1.8154 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8121 2.2319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8933 1.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5336 -0.2639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3343 1.6089 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4156 0.5692 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.2641 -0.2793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0558 -0.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8566 0.9858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9378 -0.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2163 2.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3798 4.1198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4194 3.0385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 3.6932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5635 5.1790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0868 5.4427 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9934 0.6732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6732 -0.9934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9934 -0.6732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7029 0.4063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8138 1.9450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2837 3.3093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7814 2.9394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6221 2.7738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2208 -1.1748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7681 -2.0520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8909 -0.5992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0157 1.2964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7696 0.8111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8028 -0.8856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1061 -0.9189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0513 2.7298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5041 3.6070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3813 2.1542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2085 1.8572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8273 3.1275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4285 6.0107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 M END