PUBCHEM-ZINC06066766 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 0.0760 1.4450 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -0.0610 -0.0710 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0580 -0.4270 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -0.4200 1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -1.9200 1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -2.6640 0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -4.0630 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -4.7370 1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -4.0040 2.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -2.6050 2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -1.7600 3.7640 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -6.2230 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -6.8070 0.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -6.8470 2.8550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -6.3490 3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -8.3000 3.0290 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0190 -8.8200 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -8.7080 2.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 -8.5960 1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 -8.9340 1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4400 -10.1500 1.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -8.7350 4.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -7.8060 5.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -1.9910 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -2.5960 -1.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -0.6620 -0.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 1.9640 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 1.6840 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 1.8410 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 0.0320 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -0.0420 1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -4.6320 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -4.5060 3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7060 -8.0900 3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -9.7440 3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -9.2770 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 -7.5830 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 -7.9460 1.7220 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2050 -9.9340 4.5790 O 0 5 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 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 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 38 -1 M CHG 1 39 -1 M END