PUBCHEM-ZINC02032322 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -0.0710 1.3880 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -0.0030 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -0.6410 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 0.0820 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 1.4740 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 2.1360 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 3.6390 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 4.0720 1.3390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 5.6420 1.7090 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 5.7940 3.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 5.9660 1.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 6.5930 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 6.7250 1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 7.5070 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 8.1690 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 8.0230 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 7.2440 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 9.0300 -0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9600 9.1170 -0.0370 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2510 -2.4410 -0.0860 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -2.7380 0.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -2.7730 0.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -2.8730 -1.6150 N 0 5 0 0 0 0 0 0 0 0 0 0 2.1200 -2.5610 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 1.8830 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 -0.5850 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 -0.4270 0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 2.0420 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 4.0570 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 3.9950 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 3.5820 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 6.2400 2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 7.6150 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 8.5340 -1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 7.1660 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 9.6050 -1.8080 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 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 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 2 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 19 -1 M CHG 1 23 -1 M END