Kupletskite
Piilonen P C, McDonald A M, Lalonde A E
The Canadian Mineralogist 41 (2003) 27-54
Insights into astrophyllite-group minerals II: Crystal chemistry
Sample: MSH38a
Locality: altered nepheline syenite pegmatite at Mont Saint-Hilaire, Quebec, Canada
_database_code_amcsd 0005820
5.4028 11.9178 11.7000 113.036 94.671 103.163 P-1
atom       x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mn(1) .85031 .20574 .47956 .897 .0119  .0108  .0111  .0141  .0033  .0030  .0053
Na(1) .85031 .20574 .47956 .103 .0119  .0108  .0111  .0141  .0033  .0030  .0053
Mn(2) .27958 .06735 .48803 .995 .0131  .0115  .0131  .0162  .0043  .0047  .0069
Mn(3) .42231 .35200 .48492 .985 .0132  .0123  .0127  .0167  .0050  .0051  .0072
Mn(4)      0     .5     .5 .489 .0115  .0101  .0099  .0137  .0028  .0019  .0042
Ti    .07825 .08504 .19447 .787 .0125  .0090  .0125  .0168  .0039  .0035  .0063
Nb    .07825 .08504 .19447 .213 .0125  .0090  .0125  .0168  .0039  .0035  .0063
Si(1)  .6785 .27211 .23113      .0119  .0130  .0101  .0116  .0030  .0023  .0036
Si(2)  .8132 .54620 .25257      .0140  .0169  .0105  .0135  .0028  .0023  .0047
Si(3)  .3783 .67446 .25518      .0141  .0171  .0118  .0137  .0037  .0028  .0060
Si(4)  .5058 .93099 .23521      .0118  .0135  .0115  .0112  .0036  .0027  .0055
K      .1365  .2679  .9958  .91 .0527  .0710  .0491  .0319  .0130  .0067  .0136
Na     .1365  .2679  .9958  .09 .0527  .0710  .0491  .0319  .0130  .0067  .0136
Na        .5      0      0 .386 .0256  .0394  .0204  .0138  .0070  .0030  .0053
Ca        .5      0      0 .114 .0256  .0394  .0204  .0138  .0070  .0030  .0053
O(1)   .7265  .3182  .3835      .0144  .0146  .0147  .0115  .0028  .0018  .0038
O(2)   .1475  .1603  .3699      .0154  .0159  .0149  .0122  .0034  .0026  .0029
O(3)   .1295  .3924  .5948      .0138  .0150  .0136  .0117  .0034  .0024  .0045
OH(4)  .2970  .4624  .3998      .0177  .0181  .0182  .0165  .0060  .0041  .0062
OH(5)  .9924  .1178  .5938      .0177  .0191  .0179  .0165  .0071  .0046  .0064
O(6)   .5592  .2579  .5915      .0146  .0168  .0142  .0122  .0041  .0026  .0051
O(7)   .5728  .0142  .3883      .0140  .0160  .0135  .0113  .0045  .0018  .0039
O(8)   .0734  .5909  .1999      .0286  .0264  .0313  .0178 -.0041  .0040  .0067
O(9)   .2494  .0408  .8281      .0354  .0289  .0377  .0190 -.0124  .0107  .0017
O(10)  .4297  .4146  .8005      .0286  .0395  .0308  .0180  .0218  .0045  .0066
O(11)  .1259  .8068  .8315      .0364  .0581  .0479  .0214  .0458  .0163  .0146
O(12)  .2642  .9567  .1711      .0364  .0475  .0362  .0212  .0314 -.0087      0
O(13)  .2681  .6070  .8071      .0266  .0478  .0111  .0177  .0033  .0037  .0060
O(14)  .5720  .2217  .8032      .0277  .0499  .0137  .0189  .0053  .0065  .0084
O(15)  .3843  .1910  .1674      .0364  .0232  .0487  .0218 -.0178 -.0035  .0162
F(16)      0      0      0  .50 .0217  .0228  .0230  .0153  .0048  .0017  .0053