MMs01654046 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 44 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 1.2998 0.7486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3015 2.2486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0028 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6373 -0.6028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8979 0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8995 2.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 0.7430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9494 -1.5003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4163 -1.8138 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1677 -0.5156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1652 0.6002 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6596 -0.3604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2712 1.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7632 1.1645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6435 -0.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0320 -1.4197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5400 -1.5749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5965 -1.5028 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2966 -2.2514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 -3.7514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0016 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5989 1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5199 -0.2994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5989 -1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2606 1.3486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5015 2.2473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3028 3.4486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1015 2.2499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7256 1.6631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2683 1.6614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0568 -2.3023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5669 1.9809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2524 2.2602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8371 0.0741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7363 -2.3913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0507 -2.6706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -2.1039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5995 -0.4614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5209 -1.1994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6027 -2.5386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 21 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 M END