ASINEX-ZINC04719281 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -0.6910 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -2.1400 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -2.7440 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1520 -2.3940 -1.2330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 -3.2180 -2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -4.2320 -2.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -2.9010 -3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 -3.7220 -4.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2930 -3.3800 -5.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0390 -2.2400 -5.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 -1.3800 -4.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4880 -1.7170 -3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -0.8740 -2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3400 0.2860 -2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9930 0.6060 -3.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9110 -0.1970 -4.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0180 2.1930 -3.8660 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -1.2610 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -0.5530 -0.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -2.4640 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -2.4730 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -3.8280 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 -2.3500 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -4.6300 -4.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 -4.0300 -6.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5410 -1.9990 -6.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4230 0.9400 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4270 0.0780 -5.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 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 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 34 1 0 0 0 0 21 22 2 0 0 0 0 M END