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Benyacarite |
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Demartin F, Pilati T, Gay H D, Gramaccioli C M |
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Zeitschrift fur Kristallographie 208 (1993) 57-71 |
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The crystal structure of a mineral related to paulkerrite |
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Locality: granitic pegmatites in Cerro Blanco, Tanti, Cordoba, Argentina |
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_database_code_amcsd 0011061 |
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10.561 20.585 12.516 90 90 90 Pbca |
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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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MnM1 .5033 .24517 .23961 .75 .0162 .0166 .0115 .0204 -.0014 .0018 .0017 |
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FeM1 .5033 .24517 .23961 .21 .0162 .0166 .0115 .0204 -.0014 .0018 .0017 |
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MgM1 .5033 .24517 .23961 .04 .0162 .0166 .0115 .0204 -.0014 .0018 .0017 |
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FeM2 .6625 -.00457 .26007 .68 .0123 .0081 .0134 .0155 -.0014 .0007 -.0031 |
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TiM2 .6625 -.00457 .26007 .28 .0123 .0081 .0134 .0155 -.0014 .0007 -.0031 |
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AlM2 .6625 -.00457 .26007 .07 .0123 .0081 .0134 .0155 -.0014 .0007 -.0031 |
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Ti .5 .5 0 .0128 .0173 .0142 .0070 .000 -.0051 .0002 |
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P1 .4152 .0894 .2940 .0132 .016 .0137 .0100 -.002 -.002 -.0001 |
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P2 .5892 .4027 .1965 .0104 .0074 .0141 .0096 .0016 -.0004 .0005 |
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F .1434 .5030 .5970 .40 .033 .029 .042 .028 .003 -.001 .002 |
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OH .1434 .5030 .5970 .60 .033 .029 .042 .028 .003 -.001 .002 |
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OK .7802 .1481 .9454 .78 .047 .051 .036 .054 .014 -.007 .018 |
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K .7802 .1481 .9454 .16 .047 .051 .036 .054 .014 -.007 .018 |
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O1 .4054 .1629 .2853 .022 .027 .018 .022 .002 .003 .001 |
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O2 .5333 .0646 .2363 .019 .018 .024 .016 .000 .000 .000 |
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O3 .4174 .0683 .4119 .019 .023 .022 .013 .002 -.001 .001 |
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O4 .2954 .0616 .2402 .018 .014 .021 .019 -.004 -.004 .000 |
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O5 .5939 .3293 .1906 .021 .020 .018 .024 .002 -.003 -.002 |
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O6 .4709 .4261 .2581 .015 .014 .020 .011 .003 .004 .005 |
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O7 .5894 .4307 .0826 .020 .017 .030 .013 .007 .000 .002 |
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O8 .7087 .4261 .2549 .020 .018 .024 .017 -.004 -.005 -.001 |
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O9 .6503 .1869 .1761 .037 .028 .026 .056 .001 -.009 -.008 |
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O10 .4172 .2401 .0779 .031 .037 .025 .031 .005 -.003 .003 |
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O11 .3544 .3044 .3072 .033 .026 .022 .051 .006 .012 .003 |
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O12 .5926 .2500 .3962 .037 .035 .042 .033 .002 -.001 .003 |
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O13 .1624 .5050 .9120 .022 .019 .030 .017 -.004 -.005 .006 |
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O14 .2394 .1405 .0602 .047 .081 .036 .023 -.024 -.018 .007 |
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O15 .0306 .4059 .0091 .053 .061 .047 .052 .006 .019 .004 |
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H9a .6406 .1483 .1953 .05 |
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H9b .75 .1816 .1953 .05 |
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H10a .3887 .2832 .0820 .05 |
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H11a .3594 .3495 .3046 .05 |
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H11b .2773 .3163 .3339 .05 |
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H12a .6406 .1992 .4180 .05 |
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H12b .5565 .25 .4727 .05 |
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H13a .6406 .0332 .0566 .05 |
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H13b .7227 .0010 .0293 .05 |
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H14a .75 .0996 .3887 .05 |
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H14b .6934 .1172 .4707 .05 |
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View JMOL 3-D Structure (permalink) |
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