PUBCHEM-ZINC06130603 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0880 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0730 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.1890 -2.6980 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.7750 2.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -4.2010 2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -4.7950 3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -6.2580 3.5990 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2400 -7.0240 3.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -6.7340 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -7.7500 3.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -9.0710 3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -9.3800 3.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -8.3610 3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -8.3260 3.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -9.0910 3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -7.0200 3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -6.5280 3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 -7.6440 3.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1660 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.8520 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6050 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -4.5460 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -4.5220 1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -4.4510 4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -4.4740 4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 -5.7090 3.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 -7.5220 3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8340 -9.8630 3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -10.4100 3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 -5.9760 4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 -5.8730 2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1840 -7.4010 3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 M CHG 1 12 1 M END