PUBCHEM-ZINC05114754 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 38 0 0 1 0 0 0 0 0999 V2000 0.3700 1.6610 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 0.1530 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -0.3970 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 -0.9250 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -1.9500 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -2.5380 -2.5030 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0600 -2.3830 -2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -4.0380 -2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -4.6230 -3.7520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -5.1430 -3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 -5.5670 -5.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -5.3350 -5.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -4.7500 -4.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -4.3240 -5.3050 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4370 -3.8000 -4.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -4.4960 -6.4310 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5340 -5.2210 -2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -1.8910 -3.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 1.8690 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 2.0160 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 2.1720 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -0.2020 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -0.0540 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 0.6540 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 -0.9690 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -0.3110 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 -1.9560 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 -0.8830 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -2.0340 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -2.4980 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -4.5180 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -4.1900 -2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -5.5790 -6.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 -6.1630 -2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 -5.1680 -3.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 -4.3900 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -1.9880 -3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -0.5360 -1.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 38 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END