MMs01048635 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 60 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 0.7502 -1.2989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0004 -2.5981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5996 -1.5588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4996 -2.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2493 -3.8975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4991 -5.1964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2489 -6.4956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7489 -6.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4991 -5.1969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7493 -3.8978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7507 -3.8970 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2507 -3.8967 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2504 -2.3967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2509 -5.3967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7507 -3.8965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5004 -2.5973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0004 -2.5970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7507 -3.8960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0009 -5.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5009 -5.1954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0048 -6.3097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3750 -5.6993 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3750 -6.8993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2179 -4.2076 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3325 -3.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0204 -1.7365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7592 -3.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2263 -3.3548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7630 -4.7815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6742 -6.4491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0391 0.6002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6002 1.0391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0391 -0.6002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6693 -0.5274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6696 -2.0701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2914 -1.4165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6273 -2.1881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2991 -5.1962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6487 -7.5347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3487 -7.5352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6991 -5.1971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3495 -2.8586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1508 -4.9363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9003 -1.5582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6003 -1.5577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9011 -6.2347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0341 -7.0152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6050 -7.3488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0697 -2.5079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1842 -2.1556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4147 -3.5217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0244 -5.7273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8227 -5.3447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0743 -7.4884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7135 -7.0489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2740 -5.4098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 31 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 M END