MMs01128110 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 1.4473 -0.3941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5123 0.6622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1299 2.1127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9596 0.2681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4914 -1.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9897 -1.0621 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3838 0.3852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1291 1.2073 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7863 0.9170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9482 -0.0317 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7075 -1.5122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7588 -2.6741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2393 -2.9148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3507 0.5002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5914 1.9807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5126 -0.4486 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9152 0.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1558 1.5638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5584 2.0957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7203 1.1470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4796 -0.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0770 -0.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6414 -1.2823 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.3153 1.1578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1578 0.3153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3153 -1.1578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8337 -2.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1725 1.9482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6952 1.7006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9075 -1.5122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7116 -2.0881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3635 -3.8071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4182 -2.6906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2554 -4.1147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3201 -1.6330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2264 2.3228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7509 3.2801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8423 1.5724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8845 -2.0499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 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 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 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 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 40 1 0 0 0 0 M END