MMs02459870 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 67 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 0.1722 1.4901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5488 2.0860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7531 1.1918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5809 -0.2983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2043 -0.8942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9448 -0.9225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9600 0.1818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2235 1.4885 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7229 2.5796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4239 -0.1452 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1133 1.0139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6465 0.7238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8508 -0.1703 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6994 -1.0189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3726 -1.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2417 -2.8146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8727 -1.5765 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8575 -2.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3936 -2.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2821 0.2784 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4336 1.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4865 -0.6157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7091 0.2533 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.0196 -0.9058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1730 -0.0737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1881 1.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5521 0.4064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9286 1.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1330 0.1081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9608 -1.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5842 -1.9779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3799 -1.0837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9095 -1.3804 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4101 -2.4716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7394 2.4619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2755 2.7889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2603 1.6846 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7604 1.7001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8913 2.9227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1012 -0.4767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7913 2.2054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6865 3.2781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0666 -2.0862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8528 1.6239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4586 1.6073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8685 -3.3272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3965 -3.7887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2036 -2.5085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3393 -3.5526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6744 -1.4992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2802 -1.5158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0664 2.1943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2342 0.5848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9243 -2.0973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4465 -3.1700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9294 2.6166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7937 3.6607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7365 3.8968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2644 3.4353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 41 1 0 0 0 0 2 3 2 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 43 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 44 1 0 0 0 0 7 8 2 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 38 1 0 0 0 0 26 27 2 0 0 0 0 26 34 1 0 0 0 0 27 28 1 0 0 0 0 27 36 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 32 2 0 0 0 0 31 55 1 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 36 57 1 0 0 0 0 36 58 1 0 0 0 0 37 38 1 0 0 0 0 37 59 1 0 0 0 0 37 60 1 0 0 0 0 38 39 1 0 0 0 0 39 40 2 0 0 0 0 M END