MMs01556742 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.3756 -0.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7004 -2.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1935 -2.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7915 -0.8305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 0.1634 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -0.5057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7069 0.9249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2694 -1.6115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7338 -1.2867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7473 -2.3926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2964 -3.8232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2117 -2.0678 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2252 -3.1736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6896 -2.8489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1406 -1.4183 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1271 -0.3124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6627 -0.6372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6050 -1.0935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6185 -2.1993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0829 -1.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5338 -0.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5204 0.6619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0559 0.3371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9982 -0.1192 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.4784 1.1005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1005 0.4784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4784 -1.1005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9053 -2.9612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8026 -3.2400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2745 -0.1781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7459 -0.6419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2132 -3.8185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6845 -4.2823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7421 -4.0477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8794 -3.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1391 0.3324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6678 0.7962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4729 -0.4807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6102 0.5617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2577 -3.3438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8937 -2.7592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8811 1.8064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2452 1.2218 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 M END