MMs02013842 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 37 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 0.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2519 -1.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5039 -2.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0039 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7481 -1.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2481 -1.3024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1279 -2.5172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5552 -2.0558 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5574 -0.5558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1315 -0.0902 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7723 0.3240 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1417 -0.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2963 -1.7801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3565 0.5917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7259 -0.0204 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0356 -1.4881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0302 -2.6013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5272 -1.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1393 -0.2777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0261 0.7277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1851 2.2192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2558 -3.8938 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7519 -1.2934 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6016 1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0984 1.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5946 -3.6382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7554 -3.6579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6486 1.5176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4946 1.4266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0290 1.5856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2759 -2.8205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6679 -2.0196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1776 -0.8793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8461 0.6921 0.0000 H 0 0 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 M END