MMs02718929 MOE2007 2D CORINA 3.40 0006 02.08.2006 30 31 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 -1.4999 0.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2391 1.3178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4782 2.6105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0217 2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7608 1.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7390 1.3304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4781 2.6356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4998 0.0376 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9998 0.0502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7389 1.3555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2388 1.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9997 0.0753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2606 -1.2300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7606 -1.2425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0215 -2.5478 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -10.4996 0.0878 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.5122 -1.4121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4871 1.5878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9996 0.1004 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5913 -1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1086 -1.0216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0695 3.6547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9608 1.2827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9086 -1.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1302 2.3896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8301 2.4122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8692 -2.2642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5909 1.1446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6083 -0.9338 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 29 1 0 0 0 0 20 30 1 0 0 0 0 M END