MMs01158731 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 1.3734 -0.6032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5824 0.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9558 -0.3187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1649 0.5691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0006 2.0601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5383 -0.0341 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6897 -0.8826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8575 -1.4997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3500 -1.6490 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9533 -0.2757 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5533 -1.3149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8335 0.7224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9828 2.2150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3500 2.8320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7649 3.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3976 2.4736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1797 3.3491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3290 4.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6962 5.4587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9142 4.5831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 5.7172 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.4189 0.0436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4282 -1.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8938 -0.7468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3502 0.6821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3409 1.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8752 1.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8158 1.0013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8251 -0.1084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2722 2.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2814 1.3205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4826 1.0987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0987 0.4826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4826 -1.0987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7073 -1.6014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2408 -1.4325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7151 1.1138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2485 1.2828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0872 -1.5114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6647 -1.6312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8635 -2.6997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2782 1.2795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0859 2.8555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8156 6.6527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0079 5.0767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0631 -2.2092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7012 -1.6346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7060 2.9348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0678 2.3602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9374 -0.9158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6325 -0.9961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7128 0.6991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4153 2.0651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6372 3.5733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1290 2.7953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5368 0.1480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4539 1.5759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0260 2.4930 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 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 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 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 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