MMs03598278 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 58 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 -1.3001 -0.7481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8982 -0.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 0.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4963 -0.7405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 0.0113 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0943 -0.7368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0965 -2.2368 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.3923 0.0151 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6924 -0.7330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6946 -2.2330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9094 -3.1129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4480 -4.5401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9480 -4.5423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4824 -3.1164 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.3901 1.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6881 2.2670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9882 1.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2861 2.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5863 1.5227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8842 2.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8820 3.7746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5819 4.5227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2839 3.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9838 4.5189 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.9821 5.7189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6859 3.7670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3857 4.5151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -18.1800 4.5265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5985 -1.0401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0401 0.5985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5985 1.0401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5301 -1.6685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0728 -1.6662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1282 -1.6647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6709 -1.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4235 0.9257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9662 0.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7263 -1.6609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2690 -1.6587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7925 1.2113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1012 0.3953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8745 -0.9396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0501 -2.7404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1547 -5.5099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2440 -5.5142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2086 1.3050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9780 2.6422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9899 0.3189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5880 0.3227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.9243 1.6761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5801 5.7227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.5784 5.5648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.2183 5.1280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.7815 3.4881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 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 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 17 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 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M END