American Mineralogist Crystal Structure Database

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Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Lily Pad Lake, Fort Hope, Ontario, Canada
Sample: 40BAV
_database_code_amcsd 0019896
23.1895 4.9725 19.4488 90 90 90 Cmcm
atom      x      y      z   occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Na   .08215 .25394 .15377 .0075 .01369  .0144  .0159  .0107 -.00208 -.00083 .00163
Ca   .08215 .25394 .15377  .983 .01369  .0144  .0159  .0107 -.00208 -.00083 .00163
SiT1      0  .7721    .25        .0090  .0068  .0094  .0109       0       0      0
BeT2 .12437  .8208    .25        .0063  .0073  .0078  .0039   .0012       0      0
SiT3      0  .7201 .10421  .529  .0095  .0087  .0102  .0096       0       0 -.0006
BeT3      0  .7201 .10421  .471  .0095  .0087  .0102  .0096       0       0 -.0006
SiT4 .09375     .5      0   .49  .0070  .0110  .0099  .0077       0       0 -.0003
AlT4 .09375     .5      0   .51  .0070  .0110  .0099  .0077       0       0 -.0003
SiT5 .17016      0      0       .00972  .0093  .0109 .00906       0       0 -.0012
SiT6 .21392 .86269 .14405       .00865  .0089  .0094  .0077  .00007   .0008  .0005
O1        0  .5729 .18240        .0113  .0120  .0125  .0096       0       0 -.0017
O2        0  .0354 .10949        .0145  .0126  .0103      0       0       0 -.0002
O3   .05753  .5955 .06913        .0151  .0146  .0165  .0143   .0041   .0040  .0006
O4   .13086  .2387 .03381        .0147  .0140  .0168  .0133   .0048   .0003 -.0030
O5   .20814  .8735 .06087        .0139  .0155  .0198  .0065   .0030  -.0005 -.0002
O6   .23313  .5602 .16560        .0123  .0127  .0105  .0137   .0023   .0025  .0011
O7   .15435  .9394 .18036        .0125  .0116  .0141  .0118   .0027   .0046  .0024
O8   .12132  .4939    .25        .0121  .0097  .0107  .0160 -.00004       0      0
O9   .05801  .9554    .25        .0093   .007  .0102  .0106  -.0010       0      0
H8    .1617    .43    .25         .015
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