CHEMDIV-ZINC06721506 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 0 0 1 0 0 0 0 0999 V2000 0.0170 1.4970 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.0100 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.6190 1.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -0.6820 -1.1770 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.1550 -2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 1.0280 -3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 1.3230 -4.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 0.4320 -5.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -0.7480 -4.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 -1.0540 -3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -2.1360 -2.4980 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0430 -2.1160 -1.3930 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0120 -2.4950 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -3.2050 -0.2400 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -4.2170 -1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -3.4740 -2.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -5.5280 -1.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -6.2180 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 -7.5720 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -8.2450 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -7.5380 2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -6.1950 1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -5.5800 0.7930 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 -1.5620 -1.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 1.8680 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 1.8580 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.8540 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 1.7270 -2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 2.2490 -4.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 0.6590 -6.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -1.4380 -5.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2810 -5.9710 -2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -8.0910 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -9.2970 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -8.0340 3.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -5.6420 2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -1.2650 -2.3080 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 4 1 0 0 0 0 4 5 1 0 0 0 0 4 12 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 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 24 37 1 0 0 0 0 M END