PUBCHEM-ZINC05820115 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.0080 1.5290 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 0.1570 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -0.8590 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -2.2370 -1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -3.2510 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -4.6280 -1.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -4.8990 -2.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 -5.5480 -1.7830 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -6.9610 -2.2190 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2110 -7.4980 -1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -7.1790 -3.7490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9770 -6.3120 -4.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 -8.0470 -3.6330 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 -7.7310 -2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 -8.0270 -1.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -8.9780 -4.6880 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6050 -9.8930 -4.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -9.1990 -5.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -8.4060 -4.3820 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -8.5150 -6.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -10.6900 -5.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 -8.5580 -5.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7310 -7.3230 -5.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 1.4900 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 1.9140 -1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 2.2390 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 -0.1840 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 0.2370 -2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -0.5100 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -0.9320 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -2.5860 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.1650 -2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 -2.9170 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -3.3420 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -5.2470 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -8.9570 -7.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -8.6310 -7.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -7.4420 -6.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -11.1910 -4.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -10.8550 -6.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -11.1930 -6.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0030 -9.5140 -6.2230 O 0 5 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 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 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 20 1 0 0 0 0 18 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 M CHG 1 42 -1 M END