PUBCHEM-ZINC02824753 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.0240 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.4550 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 4.9800 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 5.3940 -1.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 6.7010 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 7.5380 -0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 7.1150 -2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 8.4220 -2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0620 8.8380 -3.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3350 10.1940 -3.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1710 10.5750 -4.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7390 9.6200 -5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4740 8.2760 -5.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6350 7.8800 -4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6360 10.0380 -6.7610 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.8720 11.2190 -6.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1380 9.2000 -7.4890 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.5250 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.0040 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.3960 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.4700 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.3560 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.1230 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 3.0090 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 5.3120 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 5.4260 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 4.7270 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3540 6.3720 -2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 9.1650 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 10.9400 -3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3830 11.6220 -4.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9210 7.5370 -6.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4250 6.8310 -4.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 39 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END