PUBCHEM-ZINC05830592 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8150 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.5530 0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -2.3880 2.5190 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5600 -2.0380 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.9400 3.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -2.7140 4.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -0.5410 4.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 0.2370 3.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -0.1400 5.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 1.2360 5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 1.5040 7.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -3.8510 2.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 -4.5020 1.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 -3.8770 1.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 -6.0070 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 -6.4820 0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 -6.7580 1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8560 -7.1940 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6870 -7.3540 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 -7.0780 -1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 -6.6470 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 1.4060 5.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 1.9080 5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 0.8320 7.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 2.5370 7.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 1.3340 6.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -4.3510 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 -6.4230 2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -6.3360 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 -6.6330 2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8120 -7.4090 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5110 -7.6940 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 -7.2030 -2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -6.4360 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 15 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 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 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 M END