MMs03131131 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 51 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 1.2995 -0.7492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3004 -2.2492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0016 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5972 1.5016 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6364 0.9016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2977 2.2508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0009 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8957 2.2524 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8565 2.8524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8948 3.7524 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8948 4.9524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5953 4.5016 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5561 5.1016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2968 3.7508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0027 4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5944 6.0016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1934 4.5032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1952 1.5032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4938 2.2539 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4938 1.0539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7933 1.5047 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7933 2.7047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0919 2.2555 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1311 2.8555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0910 3.7555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7915 4.5047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4929 3.7539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7906 6.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0892 6.7555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3914 1.5063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0937 -0.7445 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8429 0.5550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3445 -2.0440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5994 1.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0396 0.5994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5994 -1.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6377 -0.5978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2973 2.8508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0687 2.8320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 2.8311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0416 3.8994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5548 6.6009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1927 5.7032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1299 4.3562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4303 2.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4911 6.7539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3932 -1.4937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3939 -2.6937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4904 7.9539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 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 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 32 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 31 47 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 2 0 0 0 0 33 49 1 0 0 0 0 48 51 1 0 0 0 0 49 50 1 0 0 0 0 M END