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Phosphammite |
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Khan A A, Roux J P, James W J |
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Acta Crystallographica B28 (1972) 2065-2069 |
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The crystal structure of diammonium hydrogen phosphate, (NH4)2HPO4 |
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11.043 6.700 8.031 90 113.42 90 P2_1/c |
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atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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N1 .4517 .1190 .1608 .0050 .0128 .0129 .0003 .0031 -.0001 |
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N2 .1217 .3857 .2620 .0052 .0099 .0114 -.0002 .0026 -.0006 |
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H1 .179 .876 .137 3.1 |
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H2 .513 .160 .115 1.3 |
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H3 .418 .000 .115 1.1 |
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H4 .496 .121 .285 1.8 |
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H5 .392 .205 .127 1.2 |
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H6 .170 .405 .186 1.9 |
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H7 .125 .498 .315 .5 |
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H8 .161 .292 .348 .9 |
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H9 .043 .351 .197 .8 |
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P .24913 .89110 .43043 .0040 .0080 .0078 .0002 .0022 -.0004 |
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O1 .2039 .9678 .2277 .0098 .0102 .0094 .0003 .0039 .0002 |
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O2 .2644 .0823 .5394 .0064 .0108 .0113 -.0010 .0038 -.0023 |
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O3 .3767 .7735 .4845 .0054 .0159 .0136 .0022 .0034 -.0001 |
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O4 .1389 .7602 .4409 .0049 .0111 .0110 -.0007 .0023 .0005 |
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