MMs00078412 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 1.3011 0.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8992 0.7393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9033 2.2393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4972 0.7322 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0953 0.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0285 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4315 -0.6285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3881 -1.5285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0871 -2.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0829 -3.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7901 -1.5214 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6934 0.7179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6975 2.2179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9986 2.9643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2955 2.2107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2914 0.7107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5966 2.9572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8936 2.2036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0994 2.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1035 3.7250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5971 1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0409 -0.5971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5971 -1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5323 1.6678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 1.6636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4223 -0.9314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9649 -0.9356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5705 -1.3234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7955 -2.6573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7492 -2.1185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6599 2.8207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0019 4.1643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3290 0.1079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9870 -1.2357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2908 1.1660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9312 1.6007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4965 3.2412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 3 0 0 0 0 M END