MMs03225648 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 1.3006 0.7472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3038 2.2472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5949 -1.5055 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6341 -0.9055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2943 -2.2527 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2550 -2.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2911 -3.7527 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2911 -4.9527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5885 -4.5055 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6278 -5.1055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8892 -3.7582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8923 -2.2582 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9316 -2.8582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1930 -1.5110 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4904 -2.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7910 -1.5165 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8303 -0.9165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0885 -2.2693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7563 0.5857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5854 -6.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8828 -6.7582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8803 -7.9582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0095 -4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0475 -3.8978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0032 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0437 -2.0978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5978 1.0405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0405 -0.5978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5978 -1.0405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6386 0.5923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7171 -3.1814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2598 -3.1846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3152 -3.1869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8579 -3.1901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -5.7946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1726 -7.1322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3891 -1.5220 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.9869 -2.5625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4296 -0.9242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7913 -0.4815 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 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 20 1 0 0 0 0 18 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 M CHG 1 40 1 M END