PUBCHEM-ZINC05498543 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 0.0180 -1.1780 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 1.4680 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 2.0940 -0.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 3.8280 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 4.2520 0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 5.5490 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 6.4720 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 5.9780 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 4.6630 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 7.0790 0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 8.1840 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 7.8260 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 7.0700 -0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8600 6.3070 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0030 6.8230 -1.4350 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2510 6.3060 -2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 8.2420 -1.9920 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6300 8.4270 -2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 9.1780 -0.8300 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8240 9.5080 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9940 8.3690 0.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7960 10.3830 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3410 11.2930 0.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 8.4110 -2.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2170 6.0710 -1.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 5.9810 0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.2280 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8290 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8190 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 9.2040 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8040 10.0470 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8060 10.8850 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8910 12.0830 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 9.2840 -2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5900 5.8870 -2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 5.3350 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 6.9310 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 23 33 1 0 0 0 0 24 34 1 0 0 0 0 25 35 1 0 0 0 0 26 36 1 0 0 0 0 27 37 1 0 0 0 0 27 38 1 0 0 0 0 M END