MMs00248512 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 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 1.2964 0.7546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 2.2546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5874 3.0092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8891 2.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8944 0.7639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1854 3.0185 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4871 2.2731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4925 0.7731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7835 3.0277 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7443 3.6277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7782 4.5277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0745 5.2823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3762 4.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3816 3.0369 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0852 2.2823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6833 2.2916 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9379 0.9899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4286 3.5933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9850 1.5462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2813 2.3008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5830 1.5554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 0.0554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2920 -0.6992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8901 -0.6899 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.0522 -2.1811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5205 -2.4878 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.2659 -1.1861 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.2582 -0.0750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5821 4.5092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6037 1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0371 -0.6037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6037 -1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2497 2.8509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6023 -1.1908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5998 -1.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2375 -0.5778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7924 1.0598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1812 4.2185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5972 4.3151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3637 5.6539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2999 6.1988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8426 6.2043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7826 5.6660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5587 4.3328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3171 1.3603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8598 1.3658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2771 3.5008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6201 2.1591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2963 -1.8992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9532 -0.5575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1632 -2.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 4.5135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5778 5.7092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3821 4.5049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 32 1 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 M END