MMs03239814 MOE2007 2D CORINA 3.40 0006 02.08.2006 28 29 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 -0.9943 1.1231 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -2.3930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3697 0.5245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7349 1.1461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8791 2.6391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9557 0.2746 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0479 0.7718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8114 -1.2185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4463 -1.8400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2254 -0.9686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7609 -1.2927 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0323 -2.0899 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3975 -1.4684 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.0869 -2.6275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5418 0.0247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9069 0.6463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1278 -0.2252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6184 -2.3398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4741 -3.8329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1944 0.1154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9169 -3.2844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3454 -0.0691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2417 1.1866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0512 2.1393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9835 -1.7183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9602 -2.4154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1433 2.6366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 12 1 0 0 0 0 1 21 1 0 0 0 0 2 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 11 2 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 M END