PUBCHEM-ZINC06092853 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 0.0380 1.2030 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -0.1940 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -1.0020 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.3670 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 1.0300 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 1.8300 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 3.3340 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 3.9930 1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 6.1470 2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 7.6760 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 7.6780 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 6.1460 0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 9.8060 2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 10.4710 1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 11.1840 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 11.8700 0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9050 13.0930 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1040 13.7690 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3080 13.2180 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3220 11.9970 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1210 11.3220 0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7860 14.0460 -0.2700 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -2.5180 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -3.0140 0.1090 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8680 1.7860 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -0.6630 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 -0.9730 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 1.4750 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 3.5820 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 3.7300 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 3.6820 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 3.7500 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 5.8580 3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 5.7120 3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 7.9650 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 8.1120 3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 8.1010 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 7.9710 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 5.7250 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4150 5.8530 1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 10.1370 3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 10.0450 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0260 10.3960 2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 11.3090 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 13.5400 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0890 14.7200 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2610 11.5590 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 10.3630 1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 5.5300 1.3990 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5680 5.7100 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 8.2890 2.1100 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8340 8.0940 2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 -3.1750 0.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 49 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 51 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 51 1 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 23 24 1 0 0 0 0 23 53 2 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 24 -1 M CHG 1 49 1 M CHG 1 51 1 M END