MMs03219686 MOE2007 2D CORINA 3.40 0006 02.08.2006 31 31 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 1.2976 -0.7525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2948 -2.2525 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2544 -2.8505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5924 -3.0049 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5531 -3.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8928 -2.2574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1904 -3.0099 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4909 -2.2624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4938 -0.7624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0918 -0.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0890 -2.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7885 -3.0148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7856 -4.5148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7971 1.4852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5895 -4.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -5.2525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 1.0381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0381 0.6020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -1.0381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1232 -1.3367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6659 -1.3396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4557 -0.1604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1322 -0.1693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1271 -2.8693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8237 -5.1168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8374 2.0832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8871 -5.2574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8848 -6.4574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 30 31 1 0 0 0 0 M END