MMs01272818 MOE2007 2D CORINA 3.40 0006 02.08.2006 34 35 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 -0.0126 -1.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2801 -2.2608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3179 -2.2390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3305 -3.7389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6358 -4.4780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9285 -3.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9159 -2.2171 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6106 -1.4781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2086 -1.4562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5139 -2.1953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5265 -3.6952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8066 -1.4344 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1119 -2.1734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1245 -3.6734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4298 -4.4124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7225 -3.6515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7099 -2.1516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4046 -1.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3919 0.0874 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -13.0278 -4.3906 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0101 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2964 -4.3477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6459 -5.6779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9728 -4.3083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6005 -0.2781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4295 -0.5435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9722 -0.5305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7965 -0.2344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0903 -4.2821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4399 -5.6124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7440 -1.5428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 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 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 28 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 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 1 8 1 M END