MMs02654759 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 1.3112 -0.7286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4924 -2.2176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9645 -2.5054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6931 -1.1942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6713 -0.0961 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1821 -1.0130 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0836 -2.2119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4960 -3.5920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5726 -2.0307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4741 -3.2296 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8865 -4.6097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6876 -5.5112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0677 -6.0987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9631 -3.0483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8645 -4.2473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5506 -1.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6492 -0.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2367 0.9108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7257 1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6272 -0.1068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0396 -1.4870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1162 0.0744 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5829 1.0489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0489 0.5829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5829 -1.0489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6139 -3.0351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6522 0.0911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2230 -0.8827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6424 -1.4870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0456 -4.9203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8108 -4.6918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0330 -6.5169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2660 -6.1628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7966 -7.2677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4580 -0.6143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5156 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1958 2.1962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7608 -2.4461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 2 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 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 39 1 0 0 0 0 M END