MMs01694443 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.0049 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3064 -2.2457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -1.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2966 0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2917 2.2542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5883 3.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8897 2.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8946 0.7627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3113 -3.7457 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.2917 -2.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5932 -1.5085 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8897 -2.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1912 -1.5170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 -0.0170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4878 -2.2712 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7893 -1.5254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9510 -0.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4192 0.2729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1649 -1.0286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1576 -2.1400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0412 0.5966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6441 -2.0881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8139 3.9252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3566 3.9302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2965 3.3917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0722 2.0582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5173 -3.1710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -3.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1154 -3.1794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6581 -3.1845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4839 -3.4712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7893 -2.7254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7510 -0.0303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8294 1.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0521 1.4154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5170 0.7574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1381 -0.3264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9650 -1.9230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5542 -3.1773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1261 -2.8485 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 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 33 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 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 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M END