PUBCHEM-ZINC00717543 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.2690 1.4240 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -0.0360 -0.5780 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8460 -0.6130 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 -0.5730 -1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 0.0040 -1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 -0.4940 -2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -1.5690 -3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -2.1410 -3.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.6440 -2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -2.4720 -2.4960 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -1.4780 -3.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -1.5030 -5.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -0.7650 -5.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 0.0010 -5.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5910 0.0250 -4.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 -0.7140 -3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 -0.6390 -1.7040 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 0.2190 -2.6770 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -1.6220 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -1.7620 2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 0.2480 3.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 0.3980 1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -1.4220 5.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -1.6670 5.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -2.3140 4.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -2.6140 5.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 2.1040 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 1.5450 -1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 1.7560 -0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 0.8510 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -1.9670 -4.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -2.9860 -4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -2.1070 -5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -0.7970 -7.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7180 0.5700 -6.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4630 0.6170 -4.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -1.9580 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.2090 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 -2.8190 2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -1.2230 2.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 0.8410 3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 0.5640 4.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -0.1380 1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.4610 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 -0.5730 5.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -2.3300 5.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -2.3070 6.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -0.7260 6.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -0.1630 0.8750 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4890 0.3920 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -1.1900 3.6360 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3030 -1.7570 3.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 49 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 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 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 49 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 51 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 49 1 M CHG 1 51 1 M END