American Mineralogist Crystal Structure Database

1 matching records for this search.

Pringleite
Download hom/pringleite.pdf
Grice J D, Burns P C, Hawthorne F C
Download cm/vol32/CM32_1.pdf
The Canadian Mineralogist 32 (1994) 1-14
Determination of the megastructures of the borate polymorphs pringleite and
ruitenbergite
Note: Cell angles modified by Grice, June 2002
_database_code_amcsd 0005341
12.746 13.019 9.693 102.24 102.10 85.61 P1
atom       x     y     z Uiso
Ca1        0     0     0  .10
Ca2    .6993 .3050 .8019  .11
Ca3    .7648 .8770 .3976  .11
Ca4    .1967 .8075 .7980  .10
Ca5    .5658 .0705 .1942  .09
Ca6    .0641 .5644 .1807  .11
Ca7    .2679 .3822 .3988  .12
Ca8    .5001 .4987 .9941  .11
Ca9    .5350 .8586 .7293  .18
B1     .0048 .7343 .4952  .10
B2     .9152 .8006 .1347  .09
B3     .2860 .0339 .0667  .09
B4     .5141 .7989 .1497  .07
B5     .7864 .5297 .0606  .08
B6     .3571 .5832 .6933  .10
B7     .2613 .6437 .0342  .08
B8     .8506 .0764 .6984  .11
B9     .5026 .2331 .4974  .14
B10    .7683 .1483 .0546  .09
B11    .0154 .2947 .1535  .15
B12    .4141 .2996 .1322  .11
B13    .4174 .9043 .9719  .11
B14    .9042 .2068 .9322  .11
B15    .0802 .7379 .0132  .06
B16    .3634 .1774 .2743  .11
B17    .8665 .6733 .2718  .12
B18    .6805 .1324 .5243  .14
B19    .8234 .9799 .1643  .11
B20    .3177 .4768 .1459  .11
B21    .9207 .3997 .9744  .09
B22    .4043 .7087 .9286  .09
B23    .5859 .2403 .0278  .17
B24    .4526 .4052 .6680  .14
B25    .1905 .6433 .5156  .10
B26    .9403 .8947 .6733  .07
O1     .9724 .6688 .3661  .11
O2     .9372 .8130 .5430  .11
O3     .1082 .7206 .5661  .14
O4     .9923 .7301 .0886  .13
O5     .8964 .8968 .0993  .12
O6     .8519 .7717 .2174  .13
O7     .3668 .0842 .1601  .14
O8     .4959 .2323 .0971  .13
O9     .3066 .9416 .9764  .14
O10    .4887 .7066 .0574  .13
O11    .3512 .2744 .2190  .11
O12    .4809 .8948 .1174  .10
O13    .8061 .4405 .9710  .11
O14    .8683 .5824 .1562  .11
O15    .4121 .8049 .8712  .08
O16    .2749 .6496 .6442  .13
O17    .3803 .4882 .6107  .10
O18    .4229 .6133 .8244  .09
O19    .2984 .7109 .9629  .10
O20    .3262 .5593 .0662  .13
O21    .1623 .6618 .0656  .10
O22    .9179 .1077 .8315  .11
O23    .8677 .9791 .6182  .11
O24    .7666 .1402 .6551  .13
O25    .5994 .2087 .5797  .10
O26    .4685 .1679 .3691  .11
O27    .4411 .3190 .5408  .14
O28    .8322 .0659 .0893  .11
O29    .7986 .2107 .9744  .12
O30    .6679 .1683 .0902  .13
O31    .9918 .2011 .0608  .10
O32    .9130 .2966 .8741  .09
O33    .9728 .3884 .1240  .14
O34    .3931 .3931 .0909  .10
Oh1    .1789 .0684 .0502  .23
Oh2    .5811 .7988 .2826  .18
OH3    .4738 .9804 .9255  .15
OH4    .6818 .5692 .0550  .19
OH5    .0884 .2956 .2800  .19
OH6    .0487 .7129 .8545  .15
Oh7    .1175 .8455 .0338  .12
OH8    .2751 .1812 .3496  .13
Oh9    .7747 .6794 .3414  .16
Oh10   .7143 .1635 .4023  .16
Oh11   .6439 .0258 .4606  .15
Oh12   .7128 .9458 .1463  .12
Oh13   .8641 .0082 .3189  .16
Oh14   .3584 .5126 .3018  .19
Oh15   .2079 .4428 .1318  .18
Oh16   .9837 .4758 .9405  .14
Oh17   .5631 .2010 .8721  .16
OH18   .6200 .3492 .0507  .16
Oh19   .4171 .3774 .7902  .15
Oh20   .5613 .4350 .7344  .13
Oh21   .1492 .5356 .4515  .14
Oh22   .2247 .6680 .3911  .30
OH23   .8919 .8640 .7823  .15
Oh24   .0481 .9317 .7473  .16
Cl1    .2625 .8958 .3347  .36
Cl2    .6698 .5720 .5622  .33
Cl3    .9830 .4870 .6205  .38
Cl4    .3180 .1373 .7214  .45
OW1    .6974 .8161 .6108  .20
OW2    .1951 .3378 .5948  .34
OW3    .0640 .0569 .2731  .30
OW4    .2580 .9088 .6525  .47
OW5    .7743 .3614 .6187  .27
OW6    .6508 .7708 .9021  .26
OW7    .4626 .7240 .5410  .34
OW8    .6507 .0049 .7977  .31
OW9    .4667 .9714 .5591  .30
OW10   .5476 .5654 .2570  .24
OW11   .8207 .6516 .8498  .32
OW12   .7978 .4026 .2941  .54
OW13   .1485 .2867 .8894  .63
H1     .1756 .0984 .9947  .30
H2    -.4104 .7422 .3025  .30
H7     .1238 .8616 .1142  .30
H9    -.2226 .6534 .4010  .30
H10   -.2526 .2086 .4257  .30
H11   -.3991 .9996 .5130  .30
H12    .6946 .9133 .0691  .30
H13   -.1561 .0720 .3616  .30
H14    .3413 .5801 .3502  .30
H15    .1852 .3944 .0531  .30
H16   -.0159 .4716 .8509  .30
H17   -.4986 .2285 .8229  .30
H19    .3608 .3638 .7703  .30
H20   -.4198 .4831 .6951  .30
H21    .1261 .5147 .5121  .30
H22    .2721 .6970 .4234  .30
H24    .0740 .9660 .7111  .30
HW1    .6928 .7351 .5906  .30
HW1*  -.2591 .8167 .6590  .30
HW2    .1576 .3375 .6514  .30
HW3    .0255 .0590 .2779  .30
HW5   -.1699 .3874 .6123  .30
HW5*  -.2461 .4080 .5482  .30
HW7    .4957 .6571 .5355  .30
HW9    .4330 .9688 .5004  .30
HW10   .5923 .5645 .3039  .30
HW13  -.0277 .0459 .3289  .30
HW13*  .0938 .2854 .8609  .30
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Total number of retrieved datasets: 1
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