American Mineralogist Crystal Structure Database

2 matching records for this search.

Strontioginorite
Download hom/strontioginorite.pdf
Konnert J A, Clark J R, Christ C L
Download am/vol55/AM55_1911.pdf
American Mineralogist 55 (1970) 1911-1931
Crystal structure of strontioginorite, (Sr,Ca)2B14O20(OH)6.5H2O
_database_code_amcsd 0000214
12.817 14.448 12.783 90 101.42 90 P2_1/a
atom     x      y      z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Sr   .6178  .1711  .7364      .00265 .00120 .00201 .00008 .00122 .00013
Ca   .1264  .2187  .2463       .0015  .0007  .0013 -.0002  .0008  .0000
B1   .3903  .2010 -.1236   .7
B2   .4334  .3031  .0504  1.0
B3   .2622  .1961  .0125   .8
B4   .5752  .2551 -.0426   .7
B5   .3410  .2573  .1920   .8
B6   .3046  .0571 -.0796  1.1
B7   .3902  .3189  .3781   .7
B8   .4223  .2021  .5384   .9
B9   .2549  .3110  .5049   .8
B10  .5704  .2546  .4567   .8
B11  .3364  .2530  .6868   .5
B12  .2922  .4571  .4152   .8
B13  .4099  .0668  .4092   .9
B14  .5247  .0623  .2736   .9
O1   .3667  .2306 -.0165   .6
O2   .4324  .2890  .1635  1.0
O3   .2627  .2156  .1239  1.0
O4   .2574  .0967 -.0046  1.2
O5   .3645  .1038 -.1369  1.1
O6   .5032  .2121 -.1213  1.0
O7   .5443  .2942  .0439  1.2
OH8  .2923 -.0375 -.1003  2.1
OH9  .3876  .3922  .0146  1.7
O10  .1774  .2449 -.0557  1.2
O11  .3221  .2682  .2933   .9
O12  .3628  .2839  .4816   .5
O13  .4122  .2040  .6507   .9
O14  .2589  .3007  .6183   .9
O15  .2349  .4071  .4757   .9
O16  .3680  .4175  .3694  1.0
O17  .5030  .3049  .3809   .8
O18  .5358  .2136  .5399   .9
OH19 .2707  .5488  .3972  1.9
O20  .3810  .1160  .4898  1.0
OH21 .3730 -.0219  .3899  1.5
O22  .4742  .1041  .3465  1.3
OH23 .5046 -.0264  .2415  1.8
OH24 .5952  .1170  .2329  1.5
O25  .1729  .2518  .4419   .9
O26  .3285  .2568  .7919  1.0
Wat1 .1096  .1489  .7207  2.3
Wat2 .1537  .0614  .2715  2.6
Wat3 .2367  .4502  .8493  2.1
Wat4 .0167  .0384  .8661  2.8
Wat5 .0509 -.0246  .4008  2.8
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Strontioginorite
Download hom/strontioginorite.pdf
Grice J D
Download cm/vol43/CM43_1019.pdf
The Canadian Mineralogist 43 (2005) 1019-1026
Strontioginorite: crystal-structure analysis and hydrogen bonding
Sample: Penobsquis, Kings County, New Brunswick, Canada
_database_code_amcsd 0006023
12.8171 14.4576 12.8008 90 101.327 90 P2_1/a
atom      x       y       z   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3)  U(2,3)
Sr   .61773  .17104  .73631 .01266 .01255 .01385 .01270 .00081 .00518  .00090
Ca   .12691  .21922  .24657 .01271  .0116  .0145   .012 .00047 .00323 -.00020
B1    .3906   .2019  -.1234  .0116  .0103  .0156  .0097 -.0007  .0034  -.0020
B2    .4329   .3028   .0508  .0122  .0108  .0158  .0106 -.0015  .0033  -.0014
B3    .2632   .1964   .0125   .012  .0099  .0156  .0102 -.0011  .0034  -.0016
B4    .5752   .2547  -.0426  .0134  .0113  .0177  .0116 -.0002  .0028  -.0001
B5    .3425   .2579   .1940  .0128  .0117  .0161  .0110  .0007  .0030  -.0004
B6    .3041   .0563  -.0793  .0176  .0180  .0169  .0196 -.0018  .0080  -.0030
B7    .3909   .3198   .3790  .0110  .0103  .0136  .0092  .0005  .0027   .0003
B8    .4231   .2027   .5392  .0112  .0108  .0127  .0107  .0000  .0035  -.0002
B9    .2553   .3107   .5049  .0108  .0091  .0134  .0106  .0004  .0032  -.0002
B10   .5702   .2545   .4567  .0113  .0100  .0128  .0114 -.0002  .0024  -.0013
B11   .3357   .2527   .6870  .0116  .0100  .0142  .0108 -.0013  .0027  -.0006
B12   .2918   .4570   .4154  .0154  .0162  .0146  .0168  .0013  .0063   .0019
B13   .4098   .0662   .4099  .0143  .0162  .0130  .0148  .0006  .0054  -.0007
B14   .5245   .0623   .2736  .0159  .0171  .0148  .0172  .0004  .0068  -.0011
O1   .36670  .23073 -.01619  .0112  .0094  .0149  .0096 -.0016  .0031  -.0021
O2   .43256  .28843  .16350  .0165  .0130  .0273  .0098 -.0054  .0037  -.0028
O3   .26259  .21563  .12386  .0150  .0128  .0258  .0102 -.0040  .0044  -.0036
O4   .25822  .09641 -.00390  .0189  .0224  .0153  .0228 -.0039  .0134  -.0040
O5   .36394  .10376 -.13751  .0170  .0211  .0150  .0176 -.0033  .0106  -.0038
O6   .50382  .21244 -.12115  .0149  .0096  .0231  .0125 -.0018  .0034  -.0036
O7   .54432  .29426  .04367  .0170  .0105  .0266  .0150 -.0032  .0050  -.0070
Oh8   .2939 -.03712  -.1001  .0324  .0475  .0165  .0433 -.0104  .0331  -.0097
Oh9  .38786  .39242  .01462  .0226  .0253  .0149  .0249  .0014 -.0014  -.0012
O10  .17728  .24475 -.05638  .0171  .0098  .0282  .0138  .0014  .0036   .0043
O11  .32221  .26825  .29316  .0140  .0111  .0217  .0097 -.0021  .0030  -.0025
O12  .36268  .28403  .48183  .0102  .0085  .0131  .0096  .0010  .0032   .0011
O13  .41210  .20398  .65046  .0129  .0138  .0155  .0104  .0024  .0050   .0013
O14  .25872  .30099  .61876  .0136  .0118  .0201  .0096  .0029  .0034   .0012
O15  .23477  .40711  .47531  .0144  .0141  .0130  .0179  .0022  .0074   .0017
O16  .36793  .41761  .36912  .0157  .0170  .0138  .0182  .0033  .0084   .0033
O17  .50387  .30540  .38105  .0124  .0090  .0165  .0120  .0007  .0030   .0019
O18  .53563  .21339  .53912  .0127  .0098  .0165  .0124  .0010  .0038   .0024
Oh19  .2709   .5492   .3968  .0285  .0353  .0153  .0426  .0088  .0265   .0092
O20  .38137  .11539  .49021  .0149  .0161  .0139  .0165 -.0021  .0074  -.0028
Oh21 .37338 -.02187  .38927  .0218  .0314  .0154  .0231 -.0072  .0165  -.0053
O22  .47503  .10394  .34641  .0192  .0254  .0137  .0226 -.0034  .0152  -.0036
Oh23  .5035 -.02604   .2416  .0270  .0324  .0156  .0407 -.0065  .0260  -.0095
Oh24 .59516  .11733  .23334  .0220  .0278  .0168  .0264 -.0056  .0179  -.0045
O25  .17299  .25171  .44172  .0130  .0093  .0169  .0133 -.0014  .0035  -.0022
O26  .32821  .25721  .79196  .0149  .0141  .0218  .0095  .0035  .0037   .0008
Ow27  .1091   .1503   .7210  .0305  .0364  .0248  .0320  .0029  .0110  -.0023
Ow28  .1546   .0621   .2712  .0355  .0446  .0242  .0431  .0096  .0218   .0065
Ow29  .2366  .45021  .84915  .0266  .0282  .0267  .0231  .0037  .0009  -.0003
Ow30  .0184   .0384   .8665  .0352  .0398  .0318  .0341  .0028  .0075   .0007
Ow31  .0519  -.0244   .4009  .0363  .0318  .0352  .0432  .0090  .0107   .0071
H8     .256   -.059   -.071    .05
H9     .415    .432    .056    .05
H19    .230    .565    .430    .05
H21    .338   -.038    .432    .05
H23    .551   -.045    .208    .05
H24    .619    .090    .198    .05
H27A   .088    .148    .685    .05
H27B   .123    .136    .774    .05
H28A   .135    .037    .319    .05
H28B   .208    .024    .262    .05
H29A   .284    .422    .897    .05
H29B   .218    .494    .883    .05
H30A  -.030    .012    .815    .05
H30B  -.025    .065    .908    .05
H31A   .022   -.079    .381    .05
H31B  -.006    .015    .392    .05
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Download in:

Multiple datasets can be concatenated into a single downloadable file by selecting the datasets and then clicking

Multiple datasets can be downloaded as individual files inside a ZIP archive by selecting the datasets and then clicking

Total number of retrieved datasets: 2
View in amc, download in amc

Return to AMCSD Home Page