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Triplite |
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Rea J R, Kostiner E |
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Acta Crystallographica B28 (1972) 2525-2529 |
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The crystal structure of manganese fluorophosphate, Mn2(PO4)F |
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Locality: synthetic |
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_database_code_amcsd 0009440 |
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13.410 6.5096 10.094 90 119.99 90 C2/c |
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atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Mn1 .05582 .26660 .99515 .00105 .00501 .00196 .00066 .00071 .00057 |
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Mn2 .34421 .39570 .64860 .00124 .00265 .00222 -.00016 .00091 .00008 |
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P .17571 .40582 .80601 .00063 .00200 .00130 -.00009 .00034 -.00004 |
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O1 .3069 .0816 .5828 .00159 .00330 .00193 -.00023 .00056 .00083 |
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O2 .2101 .1441 .1880 .00101 .00613 .00304 .00049 .00125 .00052 |
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O3 .4157 .0367 .3582 .00124 .00424 .00150 -.00046 .00002 .00048 |
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O4 .3677 .2826 .1451 .00150 .00241 .00307 -.00029 .00135 .00004 |
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F .0140 .0970 .3918 .00168 .00790 .00536 -.00009 .00194 -.00228 |
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Whitlockite |
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Kostiner E, Rea J R |
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Acta Crystallographica B32 (1976) 250-253 |
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The crystal structure of manganese-whitlockite, Ca18Mn2H2(PO4)14 |
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Locality: synthetic |
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_database_code_amcsd 0009550 |
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10.438 10.438 37.150 90 90 120 R3c |
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atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Mn 0 0 0 .00208 .00208 .00013 .00104 0 0 |
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Ca1 .2954 .1585 .67216 .00871 .00455 .00025 .00504 -.00072 -.00050 |
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Ca2 .2813 .1464 .56572 .00229 .00232 .00014 .00122 -.00002 -.00004 |
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Ca3 .3874 .1798 .76784 .00278 .00211 .00014 .00128 -.00013 -.00005 |
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P1 0 0 .75426 .00263 .00263 .00038 .00131 0 0 |
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P2 .3166 .1431 .86498 .00208 .00186 .00014 .00116 .00001 .00002 |
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P3 .3524 .1590 .96737 .00180 .00208 .00012 .00082 .00002 .00004 |
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O1 .2798 .0955 .8259 .00495 .00443 .00016 .00278 .00009 .00010 |
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O2 .2449 .2318 .8783 .00428 .00413 .00024 .00315 .00014 .00003 |
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O3 .2708 .0006 .8868 .00287 .00208 .00014 .00110 .00014 .00020 |
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O4 .4868 .2415 .8711 .00223 .00174 .00027 .00079 .00016 .00002 |
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O5 .4017 .1953 .0075 .00492 .00321 .00014 .00211 -.00032 -.00008 |
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O6 .4020 .0512 .9542 .00348 .00394 .00018 .00257 -.00005 -.00002 |
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O7 .4174 .3063 .9473 .00403 .00272 .00015 .00085 .00017 .00020 |
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O8 .1817 .0802 .9629 .00195 .00253 .00021 .00091 -.00003 -.00011 |
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OH9 0 0 .7972 .00862 .00862 .00033 .00431 0 0 |
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O10 -.0182 .1303 .7425 .00410 .00247 .00040 .00226 .00046 .00029 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
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View JMOL 3-D Structure
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