MMs03168143 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 53 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 0.0014 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2512 -1.2969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5024 -2.5967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7512 -1.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0042 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7512 -1.2927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7488 1.3054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2488 1.3068 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 2.6065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2463 3.9049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4976 2.6079 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8976 1.5687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2463 3.9077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4951 5.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2439 6.5058 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.4927 7.8041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2488 1.3096 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7488 1.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4976 2.6108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 0.0127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0000 0.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7512 -1.2842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0024 -2.5840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7537 -3.8823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2537 -3.8809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0024 -2.5812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2512 -1.2828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0011 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0011 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 -2.4775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8792 -1.7049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8990 1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6208 1.7147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9560 2.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8498 0.2681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1663 3.1372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1649 4.6799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5766 4.4338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5751 5.9765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5313 8.4051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8917 8.8428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4540 7.2031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6498 0.2698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7905 1.1957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1272 0.4256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8024 -2.5851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1546 -4.9221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8546 -4.9196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2024 -2.5800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8502 -0.2430 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 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 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 47 1 0 0 0 0 23 48 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 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 M END