MMs00328571 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 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 1.3040 -0.7413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -2.2413 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3140 -3.4413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0299 -4.4999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -2.9827 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 -2.2240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2160 -2.9654 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 -4.1653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5100 -2.2068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8140 -2.9481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -0.7068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -0.7241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1861 1.5345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0981 -0.6895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1080 -2.1895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4120 -2.9308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7060 -2.1722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6961 -0.6722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5931 1.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0432 0.5931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5931 -1.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7069 0.3890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4871 -0.9419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3860 1.5425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1781 2.7345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9861 1.5265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0166 0.9659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5593 0.9762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5904 -2.4929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4200 -4.1308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7492 -2.7653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7313 -0.0653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3841 1.2691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 -2.2586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3193 -2.8655 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 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 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 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 39 40 1 0 0 0 0 M END