MMs00702858 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 51 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 1.4560 -0.3606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8717 -1.8018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8314 -2.8825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2471 -4.3237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7032 -4.6843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7434 -3.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3277 -2.1624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0927 -4.2591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8862 -5.7449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4094 -6.0076 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8851 -7.0870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4160 -3.5529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6893 -4.3457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0126 -3.6395 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2859 -4.4323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2359 -5.9315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6092 -3.7261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8826 -4.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2059 -3.8127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2559 -2.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9826 -1.5206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6593 -2.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3859 -1.4340 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4259 -0.2347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0626 -2.1403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7893 -1.3474 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.5792 -1.6072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6292 -0.1081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8525 -2.4001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1758 -1.6938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2885 1.1648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1648 0.2885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2885 -1.1648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3334 -2.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4149 -5.1882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 -1.2979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7507 -6.5771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6757 -2.6084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2175 -2.6598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8877 -5.2388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4296 -5.2902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8426 -5.7183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2245 -4.4470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0226 -0.3213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7409 -2.7525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2345 -1.1288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6108 -0.6352 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 M END