MMs01337766 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 67 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 1.5000 0.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2587 -1.2838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7587 -1.2737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7586 -1.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0174 -2.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5174 -2.5677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2586 -1.2434 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2485 0.2566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2687 -2.7434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7585 -1.2333 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5173 -2.5272 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.1173 -1.4880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7760 -3.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5348 -5.1253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0276 -5.2720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3493 -6.7371 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4489 -7.2178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0554 -7.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9339 -6.4997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5105 -6.9728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2085 -8.4421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3300 -9.4382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7534 -8.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0172 -2.5171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7760 -3.8111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7585 -1.2131 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2584 -1.2030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0172 -2.4969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5171 -2.4868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2584 -1.1827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4996 0.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9997 0.1011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2409 1.3951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2409 1.4153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0081 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0081 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2836 1.1904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6248 0.4281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8929 1.0655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5928 1.0837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6244 -3.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9244 -3.6109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3515 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8516 -3.0662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8620 -4.6088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8245 -4.3748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6133 -6.1759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0698 -8.8206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0884 -10.6137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6506 -9.7620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1515 -0.1779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4242 -3.5402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1241 -3.5220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4583 -1.1746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2761 2.0021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6339 2.4302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2058 0.7881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2841 0.8223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8338 2.4585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1976 2.0083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 41 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 37 1 0 0 0 0 35 36 1 0 0 0 0 36 59 1 0 0 0 0 36 60 1 0 0 0 0 36 61 1 0 0 0 0 37 62 1 0 0 0 0 37 63 1 0 0 0 0 37 64 1 0 0 0 0 M END