American Mineralogist Crystal Structure Database

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Ehrleite
Download hom/ehrleite.pdf
Hawthorne F C, Grice J D
Download cm/vol25/CM25_767.pdf
The Canadian Mineralogist 25 (1987) 767-774
The crystal structure of ehrleite, a tetrahedral sheet structure
_database_code_amcsd 0005218
7.130 7.430 12.479 94.3 102.1 82.7 P-1
atom       x      y      z occ  Uiso
Ca1    .2746  .0009  .5520     .0100
Ca2    .0190  .9548  .2076     .0147
Zn     .1424  .4630  .1820     .0129
P1     .0542  .2810  .3790     .0079
P2     .3587  .6943  .3773     .0083
P3     .2454  .3698 -.0403 .89 .0081
P4     .1420  .3660  .8150 .11 .0081
Be     .2675  .4992  .5492     .0080
O1    -.0047  .0951  .3918     .0112
O2     .1367  .2617  .2713     .0124
O3     .2187  .3139  .4800     .0145
O4    -.1094  .4355  .3723     .0120
O5     .4184  .8860  .3927     .0133
O6     .2643  .6708  .4751     .0134
O7     .2098  .6833  .2705     .0144
O8     .5264  .5440  .3687     .0125
O9     .3212  .4261  .0807     .0171
OH10   .4326  .3277 -.0941     .0155
O11    .1467  .2013 -.0552     .0200
O12    .1224  .5277 -.0993     .0146
Wat13  .4563 -.1817  .6981     .0164
Wat14  .1986  .2079  .7054     .0141
Wat15 -.2512  .1624  .1374     .0232
Wat16  .2661  .9749  .1104     .0293
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