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NH4FeIIH(SO4)2*2H2O |
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Heinicke F, Lerner H W, Bolte M |
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Acta Crystallographica E60 (2004) i84-i85 |
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NH4FeIIH(SO4)2*2H2O |
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_database_code_amcsd 0010435 |
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4.5955 5.8420 8.3811 103.678 98.069 95.638 P-1 |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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N1 0 0 -.5 .0170 .0214 .0133 .0139 -.0001 -.0025 .0034 |
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H1A -.062 -.145 -.572 .50 .026 |
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H1B -.121 .113 -.504 .50 .038 |
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H1C -.150 -.068 -.460 .50 .025 |
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H1D -.097 .030 -.593 .50 .031 |
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Fe 0 0 0 .01102 .01036 .01036 .01227 .00139 .00108 .00323 |
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S -.60037 -.31653 -.23937 .01068 .01309 .00969 .00858 -.00021 .00203 .00158 |
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O1 -.4994 -.3020 -.40179 .0200 .0311 .0155 .0123 -.0046 .0117 -.0001 |
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O2 -.3409 -.28480 -.10850 .0154 .0121 .0144 .0195 .0012 -.0003 .0058 |
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O3 -.7726 -.54790 -.26264 .0171 .0216 .0125 .0153 -.0044 .0061 .0005 |
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O4 -.7750 -.11876 -.20058 .0142 .0135 .0159 .0156 .0052 .0041 .0065 |
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O5 .1993 -.2180 .14161 .0145 .0122 .0139 .0204 .0032 .0047 .0087 |
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H5A .111 -.311 .160 .025 |
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H5B .344 -.270 .126 .029 |
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