MMs00826686 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 47 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 1.3727 0.6046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5827 -0.2819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9555 0.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1182 1.8139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1655 -0.5638 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1262 -1.1638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5382 0.0408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7482 -0.8457 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1210 -0.2411 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1210 -1.4411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4387 1.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9311 1.3757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6863 2.6717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5357 0.0030 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4170 -0.9963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5678 -2.4887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0017 -0.3148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0098 0.7959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4758 0.4782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4839 1.5889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9499 1.2712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4077 -0.1573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3996 -1.2680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9336 -0.9502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4837 1.0982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0982 -0.4837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4837 -1.0982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7057 1.6021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2393 1.4348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8712 1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4048 0.8709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2458 1.3551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4435 2.4249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5477 -1.4256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0168 -0.9547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9947 1.4359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4638 1.9067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1177 2.7316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7564 2.1597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5805 -0.4115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7658 -2.4107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1271 -1.8388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9045 -2.5386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0027 -2.0549 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9707 -2.7642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 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 45 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 M END