MMs00450547 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 60 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 0.7468 -1.3009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2468 -1.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2468 -1.3118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4937 -2.6090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9937 -2.6054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2405 -3.9026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9874 -5.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7468 -1.3155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0219 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7531 1.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0063 2.5762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2531 1.2717 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0063 2.5689 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.6063 3.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5063 2.5652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2531 1.2644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6397 -0.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7520 -1.1109 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.6236 -2.3040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0528 -0.3640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7445 1.1040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8617 2.1049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2871 1.6379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5954 0.1700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4783 -0.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2594 3.8697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7594 3.8734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0126 5.1670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2658 6.4678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0407 0.5975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5975 1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0407 -0.5975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4025 1.0334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1025 1.0268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0911 -3.6497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9467 -5.8009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5848 -6.2441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 -4.6060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5356 -2.4967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8735 -1.7286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3733 0.3949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7112 1.1630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5974 -1.0626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8506 0.2310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3008 3.7475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6349 2.9729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4653 -0.3511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6150 3.2793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1808 2.4387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7358 -0.2036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7249 -2.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3065 7.0653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6683 7.5085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2251 5.8703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 47 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 48 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 30 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 24 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 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 M END