MMs02408085 MOE2007 2D CORINA 3.40 0006 02.08.2006 78 82 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 1.3020 0.7449 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3079 2.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 0.7346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1902 -1.5205 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8882 -2.2654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5921 -1.5102 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3148 0.9788 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7101 2.3515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2177 2.2006 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7808 0.6611 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1808 -0.3781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8994 1.6604 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7480 2.5089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1955 0.9053 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.0440 0.0568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8778 -0.5607 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2778 -1.5999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3855 -0.7116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8771 -1.6794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4080 -3.1041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5682 1.5100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7783 0.6235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6156 -0.8676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1510 1.2282 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3024 2.0767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3136 2.7194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6864 3.3241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8964 2.4376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2691 3.0423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4318 4.5334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2218 5.4199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8490 4.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8045 5.1381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9672 6.6293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3610 0.3418 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.1983 -1.1494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8256 -1.7541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4084 -2.0359 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.2457 -3.5270 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.4557 -4.4135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2930 -5.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5031 -6.7911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8758 -6.1864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0385 -4.6952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8284 -3.8088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7485 3.1528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5959 1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0416 -0.5959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5959 -1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5079 2.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3126 3.4448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1079 2.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8835 -3.4654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3142 3.3883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6197 -0.7367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9344 -2.2469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2074 -3.9990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6984 2.7029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1162 2.6404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0279 3.8849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7663 1.2447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2371 2.3331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3519 6.6128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8810 5.5244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1601 6.4991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0973 7.8222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7743 6.7594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4592 0.8255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5065 -1.5521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1949 -6.3884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3729 -7.9840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8438 -6.8956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1366 -4.2115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9586 -2.6159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6542 3.6452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 50 1 0 0 0 0 1 51 1 0 0 0 0 1 52 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 53 1 0 0 0 0 3 54 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 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0 0 0 45 74 1 0 0 0 0 46 47 2 0 0 0 0 46 75 1 0 0 0 0 47 48 1 0 0 0 0 47 76 1 0 0 0 0 48 77 1 0 0 0 0 49 78 1 0 0 0 0 M END