MMs03038530 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 55 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 0.5097 -1.4107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4572 -2.5575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9863 -1.6747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9532 -0.5279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4298 -0.7918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9395 -2.2026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9726 -3.3494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -3.0854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4161 -2.4665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4976 -1.4270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8203 -2.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2311 -1.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3779 -2.5915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1139 -4.0681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7032 -4.5778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5564 -3.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0705 -3.8162 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5046 -4.8744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7886 -2.0818 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.2983 -3.4925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2789 -0.6711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1993 -1.5721 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.6162 -0.1312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1154 -0.0823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6251 -1.4931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4409 -2.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2923 0.0588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4765 0.9796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1286 0.4078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4078 1.1286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1286 -0.4078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6494 -1.1002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3746 -1.7840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2307 -3.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4603 -3.3310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5454 0.6007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2033 0.1256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3804 -4.4780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7225 -4.0029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4422 -0.4434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0314 -4.8416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4920 -5.7591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4349 0.0800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7027 1.0657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9512 1.1064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2804 0.2052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7049 -0.9696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2586 -2.5122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6674 -3.3312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2725 -3.2790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1807 0.5110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 28 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 41 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 M END