MMs01050759 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 47 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 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0027 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 -0.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8979 0.7459 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9371 1.3459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8995 2.2459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1993 2.9946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2008 4.4946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9026 5.2459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6028 4.4973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6012 2.9973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3014 2.2486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0031 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1946 -1.5054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 0.7432 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7927 -1.5081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0909 -2.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3907 -1.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0940 0.7405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0956 2.2405 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.5965 -1.5027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3821 -2.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8441 -3.8102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3441 -3.8117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8091 -2.3856 0.0000 S 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 -1.0399 -0.5989 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 6.2379 2.3935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2407 5.0935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9038 6.4459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5642 5.0984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4972 1.9432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7528 -2.1070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0897 -3.4595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4293 -2.1119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4322 0.5881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2412 -2.0111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1378 -4.7803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0484 -4.7833 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 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 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 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 28 2 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 M END