MMs01507198 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 59 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 1.5000 -0.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2418 -1.3132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7418 -1.3226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7581 1.2754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2581 1.2849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5163 2.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0377 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9905 -1.5377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0093 1.4623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0471 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2580 1.2471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7580 1.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 -0.0660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7416 -1.3603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2417 -1.3509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9998 -0.0754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7579 1.2189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7416 -1.3792 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3416 -0.3399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9834 -2.6735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2416 -1.3886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9834 -2.6923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2252 -3.9866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9670 -5.2903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4670 -5.2998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2252 -4.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4833 -2.7018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2415 -1.4075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2088 -6.6035 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0075 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0075 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6353 -2.3486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3352 -2.3656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3646 2.3109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5593 3.1821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9228 3.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4733 1.9951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1330 1.6647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4738 2.4276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5570 2.4208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8882 1.6410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3042 -1.5691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5258 -2.5407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1115 -1.7542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4426 -2.5339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4657 -2.3702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3769 -3.7089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0189 -3.2800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0252 -3.9791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3605 -6.3258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4251 -4.0130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2769 -2.0140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8480 -0.3720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2061 -0.8009 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 M END