IFLAB-ZINC04006606 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.2830 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -0.2440 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -0.6820 1.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -1.8200 1.4650 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0840 -2.6490 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -2.3130 2.8900 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2010 -1.4800 3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -2.9240 2.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -2.3060 1.8490 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2940 -1.9130 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -1.1980 1.2850 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6050 -0.3470 1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.7020 -0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -3.2780 0.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 -4.1920 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 -4.9000 -0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -5.9230 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -6.1720 -1.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -5.4480 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -4.4940 0.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -5.7240 0.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 -6.5660 -2.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 -4.3930 -0.7200 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 -3.4420 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4290 -2.4360 0.5190 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -3.3470 3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -3.7040 4.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.8540 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 1.6200 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 1.6050 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 1.7120 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -6.4250 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 -5.2170 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -6.8690 -1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -4.2350 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -2.9240 3.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -4.3580 4.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -0.5090 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -1.9410 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -0.5450 -2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 35 1 0 0 0 0 26 36 1 0 0 0 0 27 37 1 0 0 0 0 28 38 1 0 0 0 0 28 39 1 0 0 0 0 28 40 1 0 0 0 0 M END