MMs01404387 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 1.5000 0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2584 -1.2844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7584 -1.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5168 -2.5687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9157 -3.9430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0369 -4.9394 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9192 -6.1336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3310 -4.1809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0096 -2.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0060 -1.5946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5332 -0.1710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4752 -1.8969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4716 -0.7756 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9409 -1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4137 -2.5015 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8829 -2.8038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8793 -1.6825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4065 -0.2590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9373 0.0433 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7053 -4.7821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4505 -4.2644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0078 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0078 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2839 1.1902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6249 0.4275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0330 -3.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4970 -2.5261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2611 -3.9426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0547 -1.9244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2036 0.6380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2243 -5.8815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8047 -5.2630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1862 -3.6827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1934 -3.0923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2784 -4.5215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7076 -5.4365 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 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 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 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END