SIAL-ZINC04545914 MOE2007 3D CORINA 3.40 0006 02.08.2006 78 81 0 0 1 0 0 0 0 0999 V2000 0.0220 1.0710 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.4370 0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0300 -0.7610 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -1.1730 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -0.9580 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -1.6830 -3.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -2.3100 -3.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -1.6340 -4.7890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -2.3390 -5.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -2.1260 -7.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -1.4550 -7.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -0.7530 1.2520 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8450 -0.3580 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -2.2830 1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -2.5200 2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -1.1750 3.6140 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6240 -1.0680 3.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -0.1680 2.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6520 1.2040 2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 1.5800 4.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 0.5420 5.2990 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0950 0.5400 5.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -0.8840 4.8230 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3500 -0.9220 4.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -1.8870 5.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -1.5450 7.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -0.1340 7.6480 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1270 0.1100 8.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 0.8940 6.5050 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4760 2.3040 6.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.3590 7.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 1.3550 8.5100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6480 1.6060 9.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -0.0690 8.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 1.4060 8.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 2.3190 10.0620 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 2.4070 10.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 3.4540 9.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 0.8370 6.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -0.1570 2.3220 C 0 0 0 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