MMs00985579 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 61 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 0.7610 -1.2926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2609 -1.2799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0219 -2.5725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -3.8779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -3.8906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 -5.1705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 -5.3146 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8613 -6.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5687 -7.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4455 -6.5460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4246 -9.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2368 -7.3776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4428 -6.4857 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5508 -5.2797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3347 -7.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6488 -5.5937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0242 -6.1922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1937 -7.6826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2302 -5.3002 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6057 -5.8987 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.2951 -4.7396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7751 -7.3891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1506 -7.9876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3566 -7.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1871 -5.6052 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.3462 -5.9158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8117 -5.0068 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.6602 -4.1582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6422 -3.5164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3931 -4.7133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0341 0.6088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6088 1.0341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0341 -0.6088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8521 -0.2356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2219 -2.5623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1919 -4.9349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1779 -2.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2301 -8.9179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3093 -10.2277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6190 -9.1485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5742 -8.3781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1070 -8.2039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7785 -4.7675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3114 -4.5932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0947 -4.1079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5774 -7.3156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4947 -8.5559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4880 -8.9881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0208 -8.8138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8918 -8.1697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5072 -6.7551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8346 -3.3808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5067 -2.3240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4499 -3.6519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1067 -5.6781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3579 -3.9997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6796 -3.7485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 32 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END