PUBCHEM-ZINC02552755 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 0.1780 1.5020 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -0.0280 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -0.5420 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -2.0720 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -2.5530 0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 -3.8990 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0450 -4.4320 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 -5.7970 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 -6.6460 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 -6.1060 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 -4.7400 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 -8.1100 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 -8.5780 0.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -8.9280 0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -10.3170 0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -11.1040 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -12.5660 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -13.4160 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -14.7820 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -15.3150 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 -14.4740 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 -13.1070 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -16.6620 -0.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -17.3350 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -16.7270 1.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -18.8110 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 -19.5130 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -20.8910 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -21.5800 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -20.8920 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -19.5120 2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -18.5740 3.6380 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 1.8690 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 1.8730 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 1.8550 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.3800 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -0.3980 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -0.1900 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -0.1720 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -2.4250 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -2.4430 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 -3.7750 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2210 -6.2100 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -6.7590 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -4.3220 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -8.5540 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -10.6880 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -13.0030 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -15.4390 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 -14.8920 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -12.4540 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 -18.9770 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6230 -21.4350 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -22.6600 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -21.4360 3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 M END