PUBCHEM-ZINC06761089 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 1 0 0 0 0 0999 V2000 0.0220 1.5130 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.0140 0.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3480 -0.4600 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -0.5100 -1.1180 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9900 -1.5960 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 0.0850 -1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 1.5260 -1.1820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5730 1.8490 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 2.0370 0.0980 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4490 3.1320 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 1.5840 1.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 0.8240 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5750 2.0090 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 1.5370 -2.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 0.5720 -2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.2450 -2.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 1.9610 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 1.8130 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 3.1010 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2090 1.6200 -0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -0.6670 -3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.4490 -0.1490 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6380 -0.2590 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 0.0510 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -1.4580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 17 1 0 0 0 0 1 18 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 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 16 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 16 21 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 M CHG 1 22 1 M END