MMs01077087 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 -1.3007 -0.7472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -2.2472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0066 -3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2941 -2.2528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2974 -0.7528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0057 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5948 1.5057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8987 -0.7415 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 0.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1929 1.5114 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.4968 -0.7358 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 0.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0949 -0.7301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3923 0.0227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3890 1.5227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6864 2.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9871 1.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9903 0.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6930 -0.7244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0026 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3445 -2.8449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 -2.8551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9014 -1.9415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4994 -1.9358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0209 0.9346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5635 0.9380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3256 -1.6510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8682 -1.6477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3485 2.1205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9130 3.1931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4557 3.1965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3950 2.6570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1693 1.3226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1717 0.2394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4032 -1.0983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9236 -1.6454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4663 -1.6420 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 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 25 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 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END