MMs01158468 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 1.4653 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4758 0.7877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9411 0.4668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9516 1.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4968 3.0048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4169 1.2545 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8169 0.2153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0186 -0.1195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5113 0.0282 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.8321 1.4934 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6807 0.6449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5377 2.2514 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3901 3.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6090 4.6183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0235 4.3626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8046 3.4884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 4.1069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2904 5.5996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5093 6.4738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8759 5.8553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0948 6.7295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9471 8.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2062 2.0951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3721 3.5859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7461 4.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9542 3.2985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7883 1.8077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4143 1.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2483 -0.2848 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.2567 1.1722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1722 0.2567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2567 -1.1722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0089 -1.4307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -0.9630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 1.4298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9321 1.8975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -0.4833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2609 -1.2948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9227 2.2942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4629 3.4075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1972 6.0944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3912 7.6680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1413 8.3404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8290 9.4164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7529 8.1041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4056 4.2972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8789 5.3803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0534 3.7799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7548 1.0965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 M END