MMs03031685 MOE2007 2D CORINA 3.40 0006 02.08.2006 29 29 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 0.0108 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0500 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3152 -2.2406 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6088 -1.4813 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 5.2068 -1.4626 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 3.8916 0.7780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4896 0.7967 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7303 2.0903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 -0.4969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7832 1.5560 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2828 -2.2593 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0421 -0.9657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5235 -3.5529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0086 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3238 -3.4406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9218 -3.4219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2503 -2.0551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 1.9780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5545 0.6112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8268 0.9635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7746 2.7560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5764 -3.0186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -2.4261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 1 0 0 0 0 4 21 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 22 1 0 0 0 0 7 8 1 0 0 0 0 7 23 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 24 1 0 0 0 0 10 25 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 26 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 28 1 0 0 0 0 28 29 1 0 0 0 0 M END