American Mineralogist Crystal Structure Database

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Karlite
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Bonazzi P, Menchetti S, Sabelli C, Trosti-Ferroni R
 
Neues Jahrbuch fur Mineralogie, Monatshefte 1986 (1986) 253-262
Karlite: crystal structure and chemical composition
Locality: Tauern Window, Schleigeistal, Zillertaler, Alpen, Austria
_database_code_amcsd 0014800
17.6370 17.967 3.1040 90 90 90 P2_12_12
atom      x     y    z  occ Biso
Mg1   .4259 .1984 .999   .6  .53
Al1   .4259 .1984 .999   .3  .53
Fe2+1 .4259 .1984 .999 .033  .53
Fe3+1 .4259 .1984 .999 .067  .53
Mg2   .2985 .1089 .498       .29
Mg3   .3596 .3601 .447       .71
Mg4   .1265 .1430 .956       .47
Mg5   .2295 .4303 .960       .48
Mg6   .1108 .2929 .470       .52
Mg7       0     0 .230   .9  .89
Fe7       0     0 .230   .1  .89
B1    .2582 .2555 .968       .46
B2    .1527 .0245 .585       .66
B3    .4869 .3275 .602       .51
O2    .3045 .1938 .003       .88
O3    .1797 .2472 .954       .30
O4    .2915 .3271 .953       .31
O6    .0643 .1852 .445       .52
O8    .0816 .0301 .764       .50
O9    .3078 .4569 .464       .57
O11   .1870 .0918 .470       .57
O12   .4556 .3914 .772       .68
O13   .4335 .2744 .484       .70
Oh1   .1608 .3954 .467       .79
Oh5   .0394 .3228 .991       .62
Oh7   .4104 .1291 .504       .75
Oh10  .3143 .0351 .998       .68
H1     .114  .426 .460         2
H2     .026  .378 .976         2
H3     .058  .583 .513         2
H4      .13  .525 .984         2
Cl        0    .5 .943   .8  .16
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