PUBCHEM-ZINC00446166 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 0 0 0 0 0 0999 V2000 -0.2230 1.4300 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -0.0580 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -0.6510 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -2.0370 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -2.8320 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -2.2610 -0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -0.8740 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -4.5920 0.3390 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -5.1380 -0.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -4.8490 1.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -5.0750 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 -6.5840 -0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 -7.0390 -1.1280 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -8.8050 -0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -9.5940 -1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -10.9740 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 -11.5720 -0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 -10.8010 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 -9.4110 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0920 -11.4480 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7940 -10.6730 2.0500 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7050 1.7820 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 1.7110 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 1.9440 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -0.0320 1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -2.4810 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -2.8760 -1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -0.4290 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -4.5760 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -4.7030 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -7.0700 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 -6.9440 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -9.1420 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 -11.5880 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -12.6510 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9210 -8.8040 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -12.7160 1.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 2 0 0 0 0 M CHG 1 21 -1 M END