MMs00684514 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 38 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 0.7542 -1.2966 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2542 -1.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.2819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5084 -2.5834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0084 -2.5883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5157 -3.6949 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8841 -3.0803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7224 -1.5890 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1855 -3.8261 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4821 -3.0718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4773 -1.5719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7836 -3.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1519 -3.2031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1593 -4.3145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6592 -4.3096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4135 -5.6062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6677 -6.9077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1677 -6.9126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4135 -5.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9453 -5.3089 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.4590 -1.7348 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0373 0.6034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6034 1.0373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0373 -0.6034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3966 1.0470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0966 1.0558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4118 -3.6295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1895 -5.0261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2559 -3.2684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6135 -5.6023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2711 -7.9450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5711 -7.9537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 30 1 0 0 0 0 9 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 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 M END