Orthopinakiolite
Takeuchi Y, Haga N, Kato T, Miura Y
The Canadian Mineralogist 16 (1978) 475-485
Orthopinakiolite, Me2.95O2[BO3]: its crystal structure
and relationship to pinakiolite, Me2.90O2[BO3]
Note: z-coordinate of O9 changed. y-coordinate of M7* changed.
_database_code_amcsd 0005157
18.357 12.591 6.068 90 90 90 Pnnm
atom       x      y     z  occ Biso
MnM1       0      0     0       .42
MnM2       0      0    .5       .43
MnM3       0     .5     0       .48
MgM4       0     .5    .5  .54  2.4
MnM4       0     .5    .5  .05  2.4
MgM5  .11890  .1703 .2480 .918  .51
MnM5  .11890  .1703 .2480 .082  .51
MnM6  .12887  .3935     0       .49
MnM7   .1064  .3973    .5 .448  .98
MnM7*   .144  .3861    .5  .26  4.8
FeM7'  .0646  .4043    .5 .292  3.3
MnM8  .25289 .27535     0       .51
MgM9   .2509  .2820    .5  .57  .79
MnM9   .2509  .2820    .5  .43  .79
MgM10 .37222  .1160 .2476 .733  .55
MnM10 .37222  .1160 .2476  .12  .55
FeM10 .37222  .1160 .2476 .147  .55
MgM11 .37260  .3948 .2488 .775  .49
MnM11 .37260  .3948 .2488 .078  .49
FeM11 .37260  .3948 .2488 .147  .49
B1     .9821  .2446     0       .40
B2     .9816  .2471    .5       .84
B3     .2367  .0318     0       .64
B4     .2318  .0443    .5       .59
O1     .0662  .0306 .2504       .71
O2     .0564  .2416     0       .78
O3     .0577  .2442    .5       .75
O4     .0731  .4685 .2148       .81
O5     .1947  .1234     0       .86
O6     .1926  .1369    .5       .73
O7     .1802  .3152 .2221       .87
O8     .3125  .0407     0       .92
O9     .3070  .0468    .5       .77
O10    .3189  .2530 .2379       .84
O11    .3038  .4466     0       .79
O12    .2977  .4352    .5       .72
O13    .4463  .1566     0       .85
O14    .4445  .1595    .5       .67
O15    .4443  .3471     0       .74
O16    .4423  .3489    .5       .64