PUBCHEM-ZINC05197328 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 0 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 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.8220 -2.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -1.2680 -3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -1.3870 -3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -1.0540 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -0.5980 -1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -0.2480 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 0.0300 0.8370 N 0 3 0 0 0 0 0 0 0 0 0 0 4.2040 0.3750 1.9830 O 0 5 0 0 0 0 0 0 0 0 0 0 4.2520 -1.1800 -2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 0.1370 -2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 -1.8500 -4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -2.2170 -5.6480 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8400 -2.6740 -6.8130 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1930 -1.6280 -4.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -3.1330 -4.7270 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 0.5290 -0.3650 0.8850 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 -1.1000 -0.7320 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 -1.4050 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5410 -1.9830 -3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 0.3620 -3.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 0.9400 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9540 0.0460 -2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -1.0870 -4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -1.3580 -5.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -3.6750 -4.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -3.4040 -3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -3.3940 -5.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 3 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 3 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 M CHG 1 10 1 M CHG 1 11 -1 M CHG 1 15 1 M CHG 1 16 -1 M END