PUBCHEM-ZINC06694750 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 0.0210 1.5880 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 0.2630 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -0.5080 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 0.0780 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 1.3990 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 2.1890 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 1.6490 0.2610 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 2.5190 0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 0.5090 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 -0.4560 -0.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8920 0.4340 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4360 -0.3110 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9420 -0.2890 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6230 0.7360 1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0190 0.7810 1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7670 -0.1920 1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0770 -1.2170 0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6810 -1.2640 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2770 -0.1310 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8220 0.8510 1.6460 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8800 2.1650 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -0.1770 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -1.5370 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 3.2180 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1990 -0.0760 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 1.4460 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0500 0.1340 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0830 -1.3510 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 1.5100 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5330 1.5860 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6370 -1.9820 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -2.0660 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8910 -1.0620 0.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 2 0 0 0 0 M CHG 1 20 -1 M END