PUBCHEM-ZINC05141269 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 0.1110 1.4670 -0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 0.0500 -0.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -0.5300 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 0.1780 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -0.5000 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -1.8950 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -2.6070 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -1.9350 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -2.5570 -0.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -3.9400 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9230 -2.6270 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5230 -2.9030 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1440 -4.3390 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3540 -5.2800 -2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4620 -4.6120 -1.6260 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1920 -3.9250 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9760 -2.9930 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7520 -4.7190 -2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2970 -5.9990 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6010 -6.1760 -2.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3890 -5.0650 -3.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8810 -3.7830 -2.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5740 -3.6130 -2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9910 -1.9830 -2.3300 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -14.9940 -5.2780 -3.6710 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 1.7510 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 1.8280 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 1.9390 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4140 1.2600 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0750 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -3.6900 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -4.5380 -0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -4.2380 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -4.1380 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -3.5660 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6020 -2.0250 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7860 -1.9820 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8090 -3.4670 -1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2710 -4.8880 -2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3570 -3.4940 -3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6350 -5.6050 -3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0730 -6.1750 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0540 -3.3550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9860 -4.6850 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1720 -2.1500 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6940 -2.6200 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7070 -6.8840 -2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9910 -7.1810 -2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4950 -2.9180 -3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7770 -3.7500 -1.0600 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.5810 -4.5460 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END