MMs00658842 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 57 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 1.3455 -0.6631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6728 0.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7475 -1.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0845 -2.3562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5999 -2.1413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7832 -3.6834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2821 -3.7419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9809 -5.0692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1808 -6.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8796 -7.6653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0795 -8.9341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5807 -8.8756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8819 -7.5484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -6.2795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9832 -4.9523 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4798 -5.1277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1785 -6.4550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2798 -3.8589 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7787 -3.9173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7070 -2.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1144 -3.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0560 -4.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6124 -5.1643 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.3614 -2.4242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7069 -3.0873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9539 -2.2536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8554 -0.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5099 -0.0937 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2629 -0.9274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2994 -1.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8455 -0.9267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3458 -0.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9383 1.2228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5304 1.0764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0764 0.5304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5304 -1.0764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8446 1.2234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9301 -0.8071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9222 -2.7269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0787 -7.7121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6386 -9.9960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9406 -9.8907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6828 -7.5016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7208 -2.7970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9985 -5.4994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7857 -4.2847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0303 -2.7840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8529 -0.0898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1865 -0.3970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0931 1.5488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6122 2.3776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7834 0.8967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 34 51 1 0 0 0 0 34 52 1 0 0 0 0 34 53 1 0 0 0 0 M END