PUBCHEM-ZINC05472181 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8450 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 -2.3770 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9750 -1.4890 0.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2780 -1.3110 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0470 -2.1090 -0.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3560 -3.3920 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6690 -3.8340 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9610 -5.1480 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9510 -6.0330 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6380 -5.6090 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3340 -4.2880 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -3.7900 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -4.5560 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2820 -7.4370 0.5850 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.4400 -7.8130 0.5550 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3960 -8.2170 0.8870 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.6600 -0.2410 -0.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6690 0.7580 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 2.0440 -1.1330 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -2.4910 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4640 -3.1520 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9850 -5.4890 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8520 -6.2990 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6020 0.4060 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8200 0.9570 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2950 2.3970 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 1.8460 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 2.8070 -1.0120 H 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 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END