PUBCHEM-ZINC05605866 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.6300 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.0140 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.1360 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4650 -2.5310 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -2.6400 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -4.1650 -1.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -4.7340 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6610 -3.8310 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 -2.5750 0.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8950 -3.9710 2.3890 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -5.2500 2.9520 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8840 -6.2370 2.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2060 -5.3740 4.1460 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -2.2600 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -2.2610 -1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -4.4720 -2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -4.5540 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1570 -4.0590 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -5.7090 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -1.9950 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9870 -3.1850 2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 -4.8830 0.2970 N 0 0 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 27 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END