PUBCHEM-ZINC06187827 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.8130 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.1320 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -2.0350 -0.7390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7990 -1.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -0.4830 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.3800 1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -3.3320 2.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -4.5730 0.7370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -5.7580 1.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -6.9110 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -8.1090 1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -9.3030 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -10.5470 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -10.4950 3.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -11.6640 3.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -12.8890 3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -12.9480 1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -11.7870 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -14.2620 1.2090 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1900 -14.3150 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -15.2880 1.8640 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2300 -14.3560 4.2030 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.5140 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.6120 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -6.9540 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -8.0660 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -9.3460 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -9.5410 3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -11.6260 5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -11.8350 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END