MMs01762085 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 -0.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2448 -1.3080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7448 -1.3140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4896 -2.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9896 -2.6220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7448 -1.3259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2448 -1.3319 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2388 -2.8319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2507 0.1681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7447 -1.3379 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4896 -2.6399 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9895 -2.6459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8664 -3.8629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5487 -5.3289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6594 -6.3370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0878 -5.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4055 -4.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2948 -3.4051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3008 -1.9051 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8761 -1.4359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4182 -0.0075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3417 -7.8030 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0048 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0048 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2963 1.1766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6292 0.3999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8855 -3.6528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5854 -3.6636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6041 1.0129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9041 1.0237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3489 -0.3011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4059 -5.6952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9764 -6.6857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5482 -4.0469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2744 -1.2036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 M END