IFLAB-ZINC04279518 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 38 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7100 -0.0490 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -2.0210 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -2.6040 -1.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -0.0160 -3.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.3860 -4.8410 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8590 -0.3170 -4.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 0.3660 -6.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 0.6270 -7.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 0.6450 -8.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 0.8920 -9.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 0.9100 -10.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 0.6800 -10.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 0.4330 -9.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 0.4210 -8.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 0.7030 -12.5840 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 1.7020 -4.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -2.3810 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -2.3020 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -3.5700 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -0.9810 -3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 0.7360 -3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 1.1310 -6.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -0.6130 -6.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 1.0700 -9.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 1.1020 -11.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 0.2540 -9.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 0.2330 -7.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 2.3810 -4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.1130 -2.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -0.7560 -2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 37 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 19 36 1 0 0 0 0 37 38 1 0 0 0 0 M END