PUBCHEM-ZINC04259730 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -1.9010 1.3310 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7410 -0.1600 -1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -0.9400 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -2.3050 -1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -2.9010 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 -2.1090 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -0.7440 -0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -4.3630 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 -5.0590 -1.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -4.9250 -1.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -6.2820 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -7.0090 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -8.3890 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -9.0560 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -8.3470 -2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -6.9520 -2.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -6.1890 -3.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -4.8950 -3.7960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -4.1780 -4.9980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -2.8300 -4.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.2350 -3.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -2.0780 -6.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -0.6800 -6.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 0.0180 -7.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -0.6640 -8.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -2.0540 -8.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -2.7600 -7.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 0.0280 -9.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -0.7360 -10.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 0.1960 -12.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -0.0150 -13.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -10.9450 -1.4270 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 1.5700 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.8240 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6860 1.6790 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 -0.4770 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -2.9120 -1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -2.5640 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -0.1290 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -6.4960 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -8.9510 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -8.8700 -3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -6.7060 -4.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -4.6520 -5.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -0.1500 -5.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 1.0980 -7.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -2.5800 -9.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -3.8400 -7.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -1.3490 -11.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -1.3800 -10.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 1.0380 -12.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -0.8570 -13.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 0.6530 -14.0580 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 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 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 M END