SIAL-ZINC04556860 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 39 0 0 1 0 0 0 0 0999 V2000 -0.0280 1.5540 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 0.0290 -0.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3770 -0.3490 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -0.4810 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -1.1000 1.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -0.1820 -0.9480 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -0.5020 -1.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2220 -0.1480 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0060 -2.0010 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 -2.5540 -2.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -2.1110 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 0.2350 -2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 0.8410 -2.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -0.5300 1.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -0.5190 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -0.0810 0.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -1.0950 2.4960 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9540 -0.8610 3.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -2.6170 2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -3.2460 3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -5.0590 3.4780 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1910 -5.4480 5.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 1.9340 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 1.9770 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.9430 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 0.3350 -1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7340 -2.5340 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0560 -2.2250 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -0.9460 1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -3.0580 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -2.8500 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 -2.8680 3.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -3.0110 4.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 -4.9720 5.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 -5.1120 5.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 -6.5300 5.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6770 0.1770 -2.2810 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9340 -0.4390 2.7790 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 0.5660 2.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -0.5270 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 14 15 1 0 0 0 0 14 29 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 19 1 0 0 0 0 17 38 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 M CHG 1 37 -1 M END