MMs03339523 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 43 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 1.3044 -0.7406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3152 -2.2406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9024 -0.7219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9132 -2.2219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2176 -2.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5112 -2.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5004 -0.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8156 -2.9438 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.5563 -1.6394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 -4.2482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1200 -3.6844 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4136 -2.9251 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4136 -4.1251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4028 -1.4251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6964 -0.6658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6856 0.8342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3812 1.5748 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9792 1.5935 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9684 3.0935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7181 -3.6657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7289 -5.1656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5925 1.0435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0435 0.5925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5925 -1.0435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5894 1.2187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8783 -2.8293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2263 -4.1625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5353 -0.0957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1874 1.2374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1287 -4.8844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2226 -1.6420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9843 -0.3005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1150 -1.7904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8767 -0.4489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0228 1.0010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1684 3.1021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9598 4.2935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7685 3.0849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0117 -2.9063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0552 -3.4988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 42 43 1 0 0 0 0 M END