Apatite-(CaF)
Hughes J M, Ertl A, Bernhardt H J, Rossman G R, Rakovan J F
American Mineralogist 89 (2004) 629-632
Mn-rich fluorapatite from Autria: Crystal structure, chemical analysis, and
spectroscopic investigations
_database_code_amcsd 0003528
9.3429 9.3429 6.8110 90 90 120 P6_3/m
atom      x      y       z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca1     1/3    2/3 -.00256 .72 .0131  .0137  .0137  .0118 .00683      0      0
Mn1     1/3    2/3 -.00256 .28 .0131  .0137  .0137  .0118 .00683      0      0
Ca2  .75861 .75194     .25 .96 .0124  .0139  .0124  .0115  .0069      0      0
Mn2  .75861 .75194     .25 .04 .0124  .0139  .0124  .0115  .0069      0      0
P    .60081 .97137     .25     .0095  .0091  .0079  .0117  .0043      0      0
O1    .6690 .15855     .25     .0159  .0202  .0086  .0190  .0074      0      0
O2    .4111  .8767     .25     .0288  .0096  .0138   .062  .0048      0      0
O3    .6591 .91763   .0701     .0274  .0537  .0246  .0156  .0284  .0142  .0066
F         0      0     .25     .0305  .0176  .0176   .056  .0088      0      0