MMs00037967 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 61 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 -0.7495 1.2993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 2.5975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2505 1.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7505 1.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 2.5963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.5957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7505 1.2964 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7495 -1.3017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2495 -1.3023 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6495 -2.3415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1316 -0.0891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5580 -0.5532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5575 -2.0532 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5967 -1.4532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1307 -2.5161 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2822 -3.3647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1301 -4.0161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5565 -4.4802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4387 -3.2670 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7492 -4.4261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9387 -3.2676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6882 -4.5669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9377 -5.8657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1882 -4.5675 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.9377 -5.8669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1871 -7.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9366 -8.4649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4366 -8.4655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1871 -7.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4377 -5.8675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6871 -7.1674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1871 -7.1680 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 19.6866 -8.6674 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 19.6877 -5.6674 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.7485 3.8974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 5.1967 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6004 -1.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9495 1.2998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1014 3.6365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0996 -1.0401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9014 3.6358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6014 3.6347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1491 -2.3407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0926 0.5113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6202 1.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0680 -5.5763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5955 -5.0806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7886 -3.5285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9871 -7.1651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3362 -9.5039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0362 -9.5050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0381 -4.8285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 42 1 0 0 0 0 2 3 2 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 4 5 2 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 47 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 33 34 2 0 0 0 0 33 56 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 35 57 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 40 41 3 0 0 0 0 M END