MMs02957569 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 39 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 0.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5073 -2.5938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0073 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7463 -1.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2463 -1.3054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1246 -2.5214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5525 -2.0619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5567 -0.5619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1314 -0.0943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7727 0.3164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1413 -0.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4424 0.4487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6034 1.9401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5543 -0.5581 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9404 -1.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6867 -3.2279 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4490 -1.7657 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.0224 -0.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0230 -1.3679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4911 -1.0602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7536 -1.2885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5073 -2.5854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6029 1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0971 1.0452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1103 -3.6314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5897 -3.6390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7505 -3.6616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5213 -2.7700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6506 1.5101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5760 0.8635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0419 0.3826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5554 -2.7932 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 0.0161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3559 -3.6872 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 23 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 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 29 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 23 24 2 0 0 0 0 23 35 1 0 0 0 0 34 37 1 0 0 0 0 35 36 1 0 0 0 0 M END