SIAL-ZINC05273878 MOE2007 3D CORINA 3.40 0006 02.08.2006 79 82 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 -0.7420 -2.1230 -7.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -2.9960 -8.5920 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -2.3830 -9.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -4.4030 -8.4070 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 3 0 0 0 0 0 0 0 0 0 1.0470 -1.8390 6.2070 H 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 -2.2970 0.8370 6.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -3.2060 5.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -0.1570 2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 1.4110 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 1.2850 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 1.5890 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -0.7860 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -2.2390 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -1.3450 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 0.1080 -2.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 -1.1320 -4.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -1.9510 -6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -3.4040 -5.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -2.5110 -6.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -1.0580 -7.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -2.7960 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -2.6400 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -2.7440 2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -3.3180 3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 1.1740 3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 1.9320 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 2.5490 4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 1.6500 3.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -1.5920 6.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -2.2600 7.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 3.0200 6.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 2.5540 7.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 2.1090 6.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 3.3630 7.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -0.7840 8.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -0.3120 7.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 2.2720 9.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -0.1680 5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 1.0890 6.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 1.5510 5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -3.8950 6.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -1.1580 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 0.1520 3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 0.5410 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -2.7080 -9.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -3.1160 -10.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 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