PUBCHEM-ZINC00579972 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -1.7340 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -2.4150 -0.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 -2.2560 -0.4740 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4190 -2.3030 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -1.3190 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 -3.6340 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5330 -4.7090 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 -5.9740 -0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -6.1640 -2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 -5.0890 -2.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -3.8240 -2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 -7.5180 -2.7930 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.5670 -8.4650 -2.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -7.6860 -3.9420 O 0 5 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 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 0.0330 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -0.3220 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -1.2720 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9750 -1.6970 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 -4.5610 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 -6.8140 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -5.2380 -3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -2.9830 -2.9730 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 4 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END