PUBCHEM-ZINC06220848 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0290 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 2.3120 -0.0240 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 3.5890 0.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 1.4420 0.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 2.5710 -1.6080 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 3.4120 -2.4550 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8920 4.1100 -1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 2.5290 -3.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 3.4070 -4.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 4.1870 -5.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 5.0700 -4.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 4.1910 -3.4390 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0200 4.8200 -2.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0520 3.2750 -4.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.7530 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4980 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 2.1650 -1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 1.8300 -3.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 1.9730 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 2.7780 -4.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 4.1060 -3.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 3.4880 -5.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 4.8120 -5.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0580 5.6250 -5.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 5.7680 -3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6290 3.7010 -4.9070 H 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 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 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END