MMs02990822 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 39 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 0.7581 1.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0162 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4838 2.6074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2419 1.3130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2257 3.9110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7257 3.9204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4676 5.2241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7095 6.5184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9675 5.2334 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7094 6.5371 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.3094 5.4978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9514 7.8314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6933 9.1351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9352 10.4294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1933 9.1444 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7868 10.1874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4965 8.6267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2094 6.5464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9513 7.8501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9675 5.2521 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4675 5.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2255 3.9671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4836 2.6634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5935 -1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 1.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6226 3.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4418 1.3205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1064 -1.0261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0955 4.3144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4267 5.0941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5740 4.1979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0369 7.0544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0273 8.5970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3740 4.2091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2517 6.4418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5925 5.6788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7255 3.9764 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 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 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 M CHG 1 39 -1 M END