MMs00679211 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 -0.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -1.3162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 -1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7399 -1.3505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9800 -2.6437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4801 -2.6323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7202 -3.9256 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 8.2399 -1.3619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9799 -2.6666 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0686 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4997 -0.0801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2398 -1.3848 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2596 1.2132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7595 1.2018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4996 -0.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9996 -0.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7594 1.1789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0194 2.4836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5194 2.4951 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.7793 3.7769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0091 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0091 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3006 1.1719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6307 0.3904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9078 1.0095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6077 0.9889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5721 -3.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4077 0.9752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6675 2.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8917 -1.1376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5916 -1.1581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9594 1.1698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8139 3.1690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3872 4.8115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7446 4.3848 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 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 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 31 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 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 33 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 23 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