MMs01358552 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 48 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 1.5000 -0.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2411 -1.3143 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4823 -2.6082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0176 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7411 -1.3244 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7309 -2.8244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7513 0.1755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2411 -1.3346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2410 -1.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4822 -2.6489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9822 -2.6387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4783 -3.7704 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8527 -3.1696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7061 -1.6768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1467 -3.9284 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4508 -3.1872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4609 -1.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7650 -0.9461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0590 -1.7049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0488 -3.2048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7447 -3.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7345 -5.4460 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 13.7752 0.5539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4813 1.3127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0081 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0041 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2996 1.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6304 0.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6072 -3.0263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -3.7885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0136 -1.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2176 -2.5899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0258 -3.7980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4069 1.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1069 0.9843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3752 -3.6738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1385 -5.1283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4258 -1.0802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1022 -1.1119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0839 -3.8119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0793 1.2951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0874 2.4950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 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 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 45 46 1 0 0 0 0 M END