MMs01867853 MOE2007 2D CORINA 3.40 0006 02.08.2006 69 73 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 1.3037 -0.7418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3132 -2.2418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9018 -0.7255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4998 -0.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7846 1.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4809 2.2908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1866 1.5326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0789 2.3071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0695 3.8071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3827 1.5653 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6770 2.3235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6675 3.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9618 4.5816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2656 3.8398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5598 4.5979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5504 6.0979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2467 6.8397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9524 6.0816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5493 8.3089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0401 8.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6588 7.1086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9807 1.5817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2750 2.3398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 0.0817 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2939 -0.6601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3033 -2.1601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6070 -2.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7732 -4.3927 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.8865 -5.2012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2423 -4.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0005 -5.9896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5005 -5.9802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2423 -4.6764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4841 -3.3821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9842 -3.3916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9735 -2.2832 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5935 1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 0.5935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5935 -1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2645 -1.3418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1132 -2.2493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3207 -3.4418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5131 -2.2342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8209 0.9307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3636 0.9404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5073 -1.9091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8371 -0.5444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4734 3.4908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1436 2.1261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3902 0.3654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6245 4.4169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2693 3.2398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6028 4.0045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9094 6.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7832 9.6472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1790 8.8530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9547 -0.5248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6972 0.4701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4769 -0.8611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1202 -1.9591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9000 -3.2903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4070 -7.0326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1070 -7.0156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4423 -4.6689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0776 -2.3392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 44 1 0 0 0 0 3 45 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 48 1 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 51 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 52 1 0 0 0 0 11 53 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 54 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 56 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 31 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 31 32 1 0 0 0 0 31 40 2 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 66 1 0 0 0 0 36 37 1 0 0 0 0 36 67 1 0 0 0 0 37 38 2 0 0 0 0 37 68 1 0 0 0 0 38 39 1 0 0 0 0 38 69 1 0 0 0 0 39 40 1 0 0 0 0 M END