MMs03079974 MOE2007 2D CORINA 3.40 0006 02.08.2006 68 69 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 1.3023 -0.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3089 -2.2443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9004 -0.7330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4984 -0.7216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0341 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7549 0.6341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0965 -0.7103 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0965 0.4897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8931 -2.1128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8902 -3.2105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3993 -4.6323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3804 -5.7629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8565 -5.4785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3458 -4.0615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3624 -2.9283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8210 -6.6218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2894 -6.4141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9028 -5.0587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0494 -3.8241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6926 -2.4727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1895 -2.3772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8907 -1.2261 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3855 -1.2615 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.2264 -1.5721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6205 0.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4309 1.2764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1965 0.1726 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1093 0.0523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6090 0.0824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3327 1.3962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3849 -1.2013 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7876 1.5340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5955 1.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0418 0.5955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5955 -1.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2631 -1.3443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1089 -2.2495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3141 -3.4443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5088 -2.2391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8227 0.9272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3654 0.9340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -1.6556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6757 -1.6488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2738 -1.6375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7311 -1.6442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7760 -1.6746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2120 -3.1007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2211 -4.8602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9882 -6.8970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5239 -3.8335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7551 -1.7944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2318 -7.6127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4560 -6.6953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8896 -5.7416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7516 -4.2104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1953 -4.6669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0715 -3.1287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1719 -0.6960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8617 1.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9736 0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2939 1.2380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0954 -1.7268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5846 -1.1772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7458 2.1295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1909 1.2227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 5 67 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 6 47 1 0 0 0 0 6 67 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 52 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 58 1 0 0 0 0 21 59 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 30 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 34 66 1 0 0 0 0 67 68 1 0 0 0 0 M END