MMs01182362 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 0.7547 1.2963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2547 1.2908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2453 -1.3072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7453 -1.3018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2452 -1.3182 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8452 -2.3574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4905 -2.6145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2358 -3.9162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7452 -1.3236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7547 1.2744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0328 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.6894 1.1263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8860 1.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3109 0.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3055 -0.7912 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8772 -1.2495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5276 1.5861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3763 3.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5930 3.9557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9611 3.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1125 1.8482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8957 0.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4806 1.2331 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1585 2.3377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8585 2.3279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5434 -1.8279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1415 -2.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2959 1.1661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6291 0.3899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3414 -2.3650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8490 1.7813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3781 2.2720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2818 3.5705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4719 5.1495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9345 4.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0168 -0.2229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9905 -2.6090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3867 -3.6460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 41 1 0 0 0 0 42 43 1 0 0 0 0 M END