PUBCHEM-ZINC05592404 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -0.3220 1.7050 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 0.1940 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -0.5130 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 -2.0320 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 -2.6030 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 -3.9710 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 -4.8460 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 -6.2270 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 -6.7690 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2730 -5.8810 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 -4.4920 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0930 -3.5660 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4360 -4.0470 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3620 -2.8440 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -8.2360 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -9.0760 -0.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -10.3960 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 -10.5230 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8350 -8.9950 0.4820 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8320 -11.7770 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1930 -12.8610 0.2840 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7660 -11.4620 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 2.1910 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 2.0320 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 2.0520 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -0.1160 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -0.0970 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -0.1990 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -0.2190 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -2.3520 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -2.3320 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -4.4930 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -6.8870 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2800 -6.2830 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6340 -4.6610 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6200 -4.6250 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1730 -2.1990 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1870 -2.2350 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4090 -3.1570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 -12.0960 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -12.0820 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -11.0250 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0610 -11.7140 0.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 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 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 2 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M CHG 1 21 -1 M END