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: Baveno, Italy
Sample: 37BAV
_database_code_amcsd 0019894
23.2272 5.0028 19.4518 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   .08346 .24646 .15288 .00675 .01205  .0133  .0123  .0106 -.00072 -.00060 .00152
Ca   .08346 .24646 .15288   .989 .01205  .0133  .0123  .0106 -.00072 -.00060 .00152
SiT1      0  .7775    .25         .0077  .0078  .0077  .0076       0       0      0
BeT2 .12486  .8144    .25         .0087  .0095  .0085  .0080  -.0010       0      0
SiT3      0  .7229 .10424   .711  .0078  .0085  .0075  .0074       0       0  .0002
BeT3      0  .7229 .10424   .289  .0078  .0085  .0075  .0074       0       0  .0002
SiT4 .09493     .5      0  .2975  .0066  .0089  .0060  .0049       0       0 -.0001
AlT4 .09493     .5      0  .7025  .0066  .0089  .0060  .0049       0       0 -.0001
SiT5 .17018      0      0        .00810  .0088  .0083  .0072       0       0 -.0006
SiT6 .21410 .85831 .14347        .00775  .0085  .0075  .0072   .0001   .0007  .0008
O1        0  .5755 .18268         .0097  .0120  .0100  .0072       0       0 -.0007
O2        0  .0368 .11203         .0128  .0128  .0092  .0166       0       0  .0001
O3   .05757  .5985 .07051         .0135  .0153  .0135  .0117   .0047   .0038  .0012
O4   .13129  .2331 .03518         .0127  .0148  .0112  .0121   .0040   .0009 -.0020
O5   .20816  .8673 .06037         .0121  .0146  .0152  .0065   .0018  -.0007  .0002
O6   .23366  .5584 .16507         .0110  .0130  .0082  .0119   .0020   .0015  .0016
O7   .15459  .9319 .17991         .0113  .0107  .0127  .0105   .0029   .0034  .0030
O8   .12103  .4898    .25         .0116  .0103  .0101  .0144  -.0010       0      0
O9   .05841  .9532    .25         .0092   .007  .0107  .0098  -.0006       0      0
H8    .1615   .435    .25          .015
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