PUBCHEM-ZINC00345363 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 0.0210 1.5900 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 0.0830 0.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5740 -0.1280 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -0.4930 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -0.1820 -1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 0.3770 -2.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 -0.5830 -1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2010 -1.3190 -0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5380 -1.6690 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2010 -1.2880 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5390 -0.5540 -2.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2000 -0.2070 -2.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1960 -0.1780 -4.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -0.5300 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -0.9340 2.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 1.9820 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 2.1250 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.8400 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -1.5860 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -0.1020 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7180 -1.6380 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0650 -2.2420 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2420 -1.5710 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 0.3650 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1630 -0.4280 -4.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7170 0.3530 -4.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 -0.5550 1.0630 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 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 14 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 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 12 2 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 M CHG 1 27 -1 M END