MMs03463478 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 41 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 1.2980 0.7518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2959 2.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0036 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5981 1.2036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6001 -1.4964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9002 -2.2446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8961 0.7554 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8944 1.9554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1982 -1.4928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4941 0.7590 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5334 1.3590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0922 0.7626 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6903 0.7662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3944 -1.4856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6944 -2.2338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9924 -1.4820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 0.0179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2925 -2.2303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5905 -1.4785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6014 1.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0384 -0.6014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6014 -1.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2588 1.3518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4959 2.2535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2943 3.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0959 2.2501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0241 -0.9095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5668 -0.9074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0906 1.9626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3560 -2.0871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6961 -3.4338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1920 -2.5169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6289 -0.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9891 -0.4401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3021 -2.2482 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.4921 2.2590 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5305 2.8604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4520 2.8575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 40 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 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 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 M CHG 1 39 -1 M END