MMs01344413 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 59 0 0 0 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 1.3008 0.7469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8989 0.7407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9025 2.2407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6052 2.9938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3044 2.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0072 3.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.2033 2.9876 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5005 2.2345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 0.7345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8014 2.9814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0986 2.2283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3994 2.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4030 4.4752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6967 2.2221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9975 2.9690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2948 2.2159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2912 0.7159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 -0.0372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8892 0.7097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8928 2.2097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5956 2.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1865 -0.0434 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 18.9396 1.2538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4334 -1.3407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.4837 -0.7965 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.7846 -0.0496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0818 -0.8027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0782 -2.3027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7774 -3.0496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4801 -2.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5975 1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0407 -0.5975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5975 -1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5952 -1.2062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9367 0.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6081 4.1938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2062 4.1876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0322 3.9025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5749 3.8988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9231 1.3047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4658 1.3010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2284 3.8901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7710 3.8864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2505 0.1183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5855 -1.2372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9335 2.8072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5984 4.1628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0154 0.8714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5581 0.8678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.4949 0.3239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.2631 -1.0139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5465 -3.9707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0038 -3.9670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2989 -2.0853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0670 -3.4232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 39 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 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 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 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 M END