SIAL-ZINC00058133 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 0.6210 1.7060 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 0.2300 -0.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8790 0.1550 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -0.5310 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 0.0020 -2.8310 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -1.0000 -4.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -1.9210 -3.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.6310 -5.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -0.4160 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -1.0960 1.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.1770 2.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 0.4320 2.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -0.1220 3.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -0.2010 4.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -0.5560 3.6240 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1020 -1.6340 3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 0.2150 3.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 1.3540 3.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 1.8070 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 2.2420 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 2.2210 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 -0.3810 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -1.6060 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 0.4070 -5.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -1.2760 -6.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -0.7770 -5.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 1.5180 2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 0.1850 1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 0.5010 4.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -1.1290 3.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 0.7690 5.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -0.9510 5.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 -0.3780 4.8230 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 M CHG 1 33 -1 M END