American Mineralogist Crystal Structure Database

32 matching records for this search.

Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S1
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001388
9.246 3.0927 9.384 90 90 90 Pnma
atom      x   y      z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B     .1678 .25  .8741      .0022  .0235  .0029      0  .0002      0
Fe1  .11564 .25 .56885 .85  .0034  .0267  .0030      0 -.0002      0
Cr1  .11564 .25 .56885 .02  .0034  .0267  .0030      0 -.0002      0
Ti1  .11564 .25 .56885 .04  .0034  .0267  .0030      0 -.0002      0
Al1  .11564 .25 .56885 .02  .0034  .0267  .0030      0 -.0002      0
Mg1  .11564 .25 .56885 .07  .0034  .0267  .0030      0 -.0002      0
Mg2  .10278 .25 .18992      .0033  .0306  .0037      0  .0001      0
O1    .0212 .25  .8648      .0027  .0267  .0032      0 -.0003      0
O2    .2469 .25  .7465      .0032  .0240  .0036      0  .0002      0
O3    .2387 .25  .0064      .0028  .0327  .0027      0  .0001      0
O4    .0091 .25  .3870      .0026  .0308  .0026      0  .0001      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S2
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001389
9.226 3.0860 9.369 90 90 90 Pnma
atom      x   y      z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B     .1658 .25  .8752      .0068  .0420  .0017      0  .0006      0
Al1  .11569 .25 .56890 .01  .0046  .0273  .0034      0 -.0002      0
Cr1  .11569 .25 .56890 .23  .0046  .0273  .0034      0 -.0002      0
Fe1  .11569 .25 .56890 .50  .0046  .0273  .0034      0 -.0002      0
Ti1  .11569 .25 .56890 .12  .0046  .0273  .0034      0 -.0002      0
Mg1  .11569 .25 .56890 .14  .0046  .0273  .0034      0 -.0002      0
Mg2  .10218 .25 .19020      .0041  .0268  .0030      0  .0002      0
O1    .0202 .25  .8680      .0043  .0394  .0034      0 -.0010      0
O2    .2463 .25  .7469      .0040  .0341  .0034      0  .0006      0
O3    .2386 .25  .0057      .0041  .0473  .0023      0 -.0010      0
O4    .0098 .25  .3841      .0042  .0331  .0026      0  .0001      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S3
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001390
9.230 3.0906 9.378 90 90 90 Pnma
atom      x   y      z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B     .1374 .25  .8750      .0056  .0236  .0031      0  .0003      0
Al1  .11567 .25 .56875 .04  .0049  .0173  .0037      0 -.0007      0
Cr1  .11567 .25 .56875 .18  .0049  .0173  .0037      0 -.0007      0
Fe1  .11567 .25 .56875 .51  .0049  .0173  .0037      0 -.0007      0
Ti1  .11567 .25 .56875 .12  .0049  .0173  .0037      0 -.0007      0
Mg1  .11567 .25 .56875 .15  .0049  .0173  .0037      0 -.0007      0
Mg2  .10266 .25 .19032      .0042  .0157  .0039      0  .0000      0
O1    .0208 .25  .8674      .0046  .0325  .0041      0 -.0007      0
O2    .2465 .25  .7471      .0048  .0340  .0033      0  .0007      0
O3    .2376 .25  .0054      .0048  .0291  .0032      0 -.0011      0
O4    .0101 .25  .3835      .0053  .0243  .0037      0  .0004      0
Download AMC data (View Text File)
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Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S4
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001391
9.228 3.0840 9.371 90 90 90 Pnma
atom      x   y      z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B     .1672 .25  .8748      .0056  .0499  .0020      0  .0003      0
Al1  .11556 .25 .56885 .02  .0034  .0302  .0033      0 -.0002      0
Cr1  .11556 .25 .56885 .17  .0034  .0302  .0033      0 -.0002      0
Fe1  .11556 .25 .56885 .47  .0034  .0302  .0033      0 -.0002      0
Ti1  .11556 .25 .56885 .16  .0034  .0302  .0033      0 -.0002      0
Mg1  .11556 .25 .56885 .18  .0034  .0302  .0033      0 -.0002      0
Mg2  .10245 .25 .19035      .0030  .0239  .0036      0 -.0002      0
O1    .0203 .25  .8669      .0033  .0494  .0032      0 -.0004      0
O2    .2468 .25  .7475      .0041  .0526  .0023      0  .0006      0
O3    .2388 .25  .0053      .0042  .0499  .0028      0 -.0008      0
O4    .0090 .25  .3842      .0036  .0368  .0033      0  .0005      0
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S5
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001392
9.246 3.0993 9.378 90 90 90 Pnma
atom      x   y      z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B     .1673 .25  .8755      .0005  .0156  .0020      0 -.0003      0
Cr1  .11495 .25 .56951 .04  .0016  .0125  .0015      0 -.0002      0
Fe1  .11495 .25 .56951 .65  .0016  .0125  .0015      0 -.0002      0
Ti1  .11495 .25 .56951 .15  .0016  .0125  .0015      0 -.0002      0
Mg1  .11495 .25 .56951 .16  .0016  .0125  .0015      0 -.0002      0
Mg2  .10218 .25 .19058      .0010  .0112  .0013      0 -.0001      0
O1    .0209 .25  .8676      .0013  .0156  .0020      0 -.0003      0
O2    .2467 .25  .7481      .0016  .0200  .0021      0 -.0009      0
O3    .2371 .25  .0050      .0016  .0286  .0018      0 -.0003      0
O4    .0101 .25  .3834      .0018  .0216  .0015      0 -.0003      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S6
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001393
9.242 3.098 9.383 90 90 90 Pnma
atom     x   y     z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B    .1672 .25  .873       .8
Al1  .1150 .25 .5696 .02       .0012  .0076  .0012      0 -.0000      0
Cr1  .1150 .25 .5696 .02       .0012  .0076  .0012      0 -.0000      0
Fe1  .1150 .25 .5696 .61       .0012  .0076  .0012      0 -.0000      0
Ti1  .1150 .25 .5696 .17       .0012  .0076  .0012      0 -.0000      0
Mg1  .1150 .25 .5696 .18       .0012  .0076  .0012      0 -.0000      0
Mg2  .1024 .25 .1901           .0008  .0156  .0017      0 -.0006      0
O1   .0192 .25 .8662       .7
O2   .2478 .25 .7484       .4
O3   .2372 .25 .0059       .6
O4   .0099 .25 .3824      .59
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S7
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001394
9.255 3.0941 9.402 90 90 90 Pnma
atom      x   y      z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B     .1663 .25  .8740      .0015  .0183  .0014      0  .0006      0
Al1  .11552 .25 .56856 .01   0017  .0167  .0018      0 -.0002      0
Cr1  .11552 .25 .56856 .23  .0017  .0167  .0018      0 -.0002      0
Fe1  .11552 .25 .56856 .54  .0017  .0167  .0018      0 -.0002      0
Ti1  .11552 .25 .56856 .10  .0017  .0167  .0018      0 -.0002      0
Mg1  .11552 .25 .56856 .12  .0017  .0167  .0018      0 -.0002      0
Mg2   .1025 .25  .1904      .0012  .0172  .0019      0  .0000      0
O1    .0210 .25  .8671      .0011  .0261  .0017      0 -.0000      0
O2    .2470 .25  .7470      .0013  .0235  .0014      0  .0002      0
O3    .2379 .25  .0053      .0010  .0313  .0011      0 -.0004      0
O4    .0095 .25  .3843      .0022  .0209  .0012      0  .0001      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S1
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001388
9.246 3.0927 9.384 90 90 90 Pnma
atom      x   y      z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B     .1678 .25  .8741      .0022  .0235  .0029      0  .0002      0
Fe1  .11564 .25 .56885 .85  .0034  .0267  .0030      0 -.0002      0
Cr1  .11564 .25 .56885 .02  .0034  .0267  .0030      0 -.0002      0
Ti1  .11564 .25 .56885 .04  .0034  .0267  .0030      0 -.0002      0
Al1  .11564 .25 .56885 .02  .0034  .0267  .0030      0 -.0002      0
Mg1  .11564 .25 .56885 .07  .0034  .0267  .0030      0 -.0002      0
Mg2  .10278 .25 .18992      .0033  .0306  .0037      0  .0001      0
O1    .0212 .25  .8648      .0027  .0267  .0032      0 -.0003      0
O2    .2469 .25  .7465      .0032  .0240  .0036      0  .0002      0
O3    .2387 .25  .0064      .0028  .0327  .0027      0  .0001      0
O4    .0091 .25  .3870      .0026  .0308  .0026      0  .0001      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S2
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001389
9.226 3.0860 9.369 90 90 90 Pnma
atom      x   y      z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B     .1658 .25  .8752      .0068  .0420  .0017      0  .0006      0
Al1  .11569 .25 .56890 .01  .0046  .0273  .0034      0 -.0002      0
Cr1  .11569 .25 .56890 .23  .0046  .0273  .0034      0 -.0002      0
Fe1  .11569 .25 .56890 .50  .0046  .0273  .0034      0 -.0002      0
Ti1  .11569 .25 .56890 .12  .0046  .0273  .0034      0 -.0002      0
Mg1  .11569 .25 .56890 .14  .0046  .0273  .0034      0 -.0002      0
Mg2  .10218 .25 .19020      .0041  .0268  .0030      0  .0002      0
O1    .0202 .25  .8680      .0043  .0394  .0034      0 -.0010      0
O2    .2463 .25  .7469      .0040  .0341  .0034      0  .0006      0
O3    .2386 .25  .0057      .0041  .0473  .0023      0 -.0010      0
O4    .0098 .25  .3841      .0042  .0331  .0026      0  .0001      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S3
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001390
9.230 3.0906 9.378 90 90 90 Pnma
atom      x   y      z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B     .1374 .25  .8750      .0056  .0236  .0031      0  .0003      0
Al1  .11567 .25 .56875 .04  .0049  .0173  .0037      0 -.0007      0
Cr1  .11567 .25 .56875 .18  .0049  .0173  .0037      0 -.0007      0
Fe1  .11567 .25 .56875 .51  .0049  .0173  .0037      0 -.0007      0
Ti1  .11567 .25 .56875 .12  .0049  .0173  .0037      0 -.0007      0
Mg1  .11567 .25 .56875 .15  .0049  .0173  .0037      0 -.0007      0
Mg2  .10266 .25 .19032      .0042  .0157  .0039      0  .0000      0
O1    .0208 .25  .8674      .0046  .0325  .0041      0 -.0007      0
O2    .2465 .25  .7471      .0048  .0340  .0033      0  .0007      0
O3    .2376 .25  .0054      .0048  .0291  .0032      0 -.0011      0
O4    .0101 .25  .3835      .0053  .0243  .0037      0  .0004      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S4
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001391
9.228 3.0840 9.371 90 90 90 Pnma
atom      x   y      z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B     .1672 .25  .8748      .0056  .0499  .0020      0  .0003      0
Al1  .11556 .25 .56885 .02  .0034  .0302  .0033      0 -.0002      0
Cr1  .11556 .25 .56885 .17  .0034  .0302  .0033      0 -.0002      0
Fe1  .11556 .25 .56885 .47  .0034  .0302  .0033      0 -.0002      0
Ti1  .11556 .25 .56885 .16  .0034  .0302  .0033      0 -.0002      0
Mg1  .11556 .25 .56885 .18  .0034  .0302  .0033      0 -.0002      0
Mg2  .10245 .25 .19035      .0030  .0239  .0036      0 -.0002      0
O1    .0203 .25  .8669      .0033  .0494  .0032      0 -.0004      0
O2    .2468 .25  .7475      .0041  .0526  .0023      0  .0006      0
O3    .2388 .25  .0053      .0042  .0499  .0028      0 -.0008      0
O4    .0090 .25  .3842      .0036  .0368  .0033      0  .0005      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S5
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001392
9.246 3.0993 9.378 90 90 90 Pnma
atom      x   y      z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B     .1673 .25  .8755      .0005  .0156  .0020      0 -.0003      0
Cr1  .11495 .25 .56951 .04  .0016  .0125  .0015      0 -.0002      0
Fe1  .11495 .25 .56951 .65  .0016  .0125  .0015      0 -.0002      0
Ti1  .11495 .25 .56951 .15  .0016  .0125  .0015      0 -.0002      0
Mg1  .11495 .25 .56951 .16  .0016  .0125  .0015      0 -.0002      0
Mg2  .10218 .25 .19058      .0010  .0112  .0013      0 -.0001      0
O1    .0209 .25  .8676      .0013  .0156  .0020      0 -.0003      0
O2    .2467 .25  .7481      .0016  .0200  .0021      0 -.0009      0
O3    .2371 .25  .0050      .0016  .0286  .0018      0 -.0003      0
O4    .0101 .25  .3834      .0018  .0216  .0015      0 -.0003      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S6
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001393
9.242 3.098 9.383 90 90 90 Pnma
atom     x   y     z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B    .1672 .25  .873       .8
Al1  .1150 .25 .5696 .02       .0012  .0076  .0012      0 -.0000      0
Cr1  .1150 .25 .5696 .02       .0012  .0076  .0012      0 -.0000      0
Fe1  .1150 .25 .5696 .61       .0012  .0076  .0012      0 -.0000      0
Ti1  .1150 .25 .5696 .17       .0012  .0076  .0012      0 -.0000      0
Mg1  .1150 .25 .5696 .18       .0012  .0076  .0012      0 -.0000      0
Mg2  .1024 .25 .1901           .0008  .0156  .0017      0 -.0006      0
O1   .0192 .25 .8662       .7
O2   .2478 .25 .7484       .4
O3   .2372 .25 .0059       .6
O4   .0099 .25 .3824      .59
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Yuanfuliite
Download hom/yuanfuliite.pdf
Bigi S, Brigatti M F, Capedri S
Download am/vol76/AM76_1380.pdf
American Mineralogist 76 (1991) 1380-1388
Crystal chemistry of Fe- and Cr-rich warwickite
sample S7
Locality: Jumilla, Murcia province, southeast Spain
_database_code_amcsd 0001394
9.255 3.0941 9.402 90 90 90 Pnma
atom      x   y      z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
B     .1663 .25  .8740      .0015  .0183  .0014      0  .0006      0
Al1  .11552 .25 .56856 .01   0017  .0167  .0018      0 -.0002      0
Cr1  .11552 .25 .56856 .23  .0017  .0167  .0018      0 -.0002      0
Fe1  .11552 .25 .56856 .54  .0017  .0167  .0018      0 -.0002      0
Ti1  .11552 .25 .56856 .10  .0017  .0167  .0018      0 -.0002      0
Mg1  .11552 .25 .56856 .12  .0017  .0167  .0018      0 -.0002      0
Mg2   .1025 .25  .1904      .0012  .0172  .0019      0  .0000      0
O1    .0210 .25  .8671      .0011  .0261  .0017      0 -.0000      0
O2    .2470 .25  .7470      .0013  .0235  .0014      0  .0002      0
O3    .2379 .25  .0053      .0010  .0313  .0011      0 -.0004      0
O4    .0095 .25  .3843      .0022  .0209  .0012      0  .0001      0
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Biotite
Download hom/biotite.pdf
Bigi S, Brigatti M F
Download am/vol79/AM79_63.pdf
American Mineralogist 79 (1994) 63-72
Crystal chemistry and microstructures of plutonic biotite
Sample 1M from Valle del Cervo syenitic complex
_database_code_amcsd 0001633
5.335 9.244 10.206 90 100.08 90 C2/m
atom     x     y     z  occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
SiT  .0752 .1669 .2258 .702  .0161  .0038  .0052 -.0002  .0021  .0001
AlT  .0752 .1669 .2258 .298  .0161  .0038  .0052 -.0002  .0021  .0001
Al1      0     0    .5 .015  .0172  .0038  .0067      0  .0036      0
Fe1      0     0    .5 .400  .0172  .0038  .0067      0  .0036      0
Mg1      0     0    .5 .512  .0172  .0038  .0067      0  .0036      0
Mn1      0     0    .5 .007  .0172  .0038  .0067      0  .0036      0
Ti1      0     0    .5 .067  .0172  .0038  .0067      0  .0036      0
Na2      0 .3343    .5 .017  .0160  .0044  .0060      0  .0028      0
K2       0 .3343    .5 .953  .0160  .0044  .0060      0  .0028      0
O1   .0247     0 .1688       .0306  .0047  .0071      0  .0021      0
O2   .3219 .2336 .1683       .0212  .0088  .0066 -.0022  .0034 -.0006
O3   .1334 .1675 .3905       .0197  .0044  .0061  .0000  .0029  .0004
O4   .1301    .5 .3952       .0198  .0053  .0064      0  .0027      0
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Biotite
Download hom/biotite.pdf
Bigi S, Brigatti M F
Download am/vol79/AM79_63.pdf
American Mineralogist 79 (1994) 63-72
Crystal chemistry and microstructures of plutonic biotite
Sample 2M1 from Valle del Cervo syenitic complex
_database_code_amcsd 0001634
5.339 9.249 20.196 90 95.06 90 C2/c
atom     x     y     z  occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
SiT1 .4615 .2498 .1370 .696  .0074  .0023  .0007  .0003  .0002  .0001
AlT1 .4615 .2498 .1370 .304  .0074  .0023  .0007  .0003  .0002  .0001
SiT2 .9636 .4166 .1371 .696  .0076  .0024  .0007  .0005  .0002  .0001
AlT2 .9636 .4166 .1371 .304  .0076  .0024  .0007  .0005  .0002  .0001
Fe1    .75   .25     0 .405  .0069  .0031  .0008 -.0008  .0003 -.0004
Mg1    .75   .25     0 .515  .0069  .0031  .0008 -.0008  .0003 -.0004
Mn1    .75   .25     0 .006  .0069  .0031  .0008 -.0008  .0003 -.0004
Ti1    .75   .25     0 .075  .0069  .0031  .0008 -.0008  .0003 -.0004
Fe2  .2473 .0825 .0000 .405  .0112  .0033  .0008 -.0003  .0004 -.0003
Mg2  .2473 .0825 .0000 .515  .0112  .0033  .0008 -.0003  .0004 -.0003
Mn2  .2473 .0825 .0000 .006  .0112  .0033  .0008 -.0003  .0004 -.0003
Ti2  .2473 .0825 .0000 .075  .0112  .0033  .0008 -.0003  .0004 -.0003
K        0 .0852   .25 .946  .0238  .0081  .0021      0  .0007      0
Na       0 .0852   .25 .032  .0238  .0081  .0021      0  .0007      0
O11  .7385 .3176 .1656       .0129  .0051  .0011 -.0015  .0004 -.0001
O21  .2368 .3478 .1665       .0143  .0044  .0011  .0010  .0000 -.0001
O22  .4418 .0844 .1662       .0165  .0038  .0011  .0007  .0007 -.0003
O31  .4324 .2376 .0550       .0082  .0006  .0005 -.0002  .0000 -.0001
O32  .9359 .4047 .0550       .0098  .0022  .0006  .0002  .0004 -.0002
O4   .9351 .0695 .0518       .0103  .0019  .0009  .0010  .0005 -.0005
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Erionite-Ca
 
Gualtieri A, Artioli G, Passaglia E, Bigi S, Viani A, Hanson J C
Download am/vol83/AM83_590.pdf
American Mineralogist 83 (1998) 590-606
Crystal structure-crystal chemistry relationships in the zeolites erionite
and offretite
Sample from Lady Hill
_database_code_amcsd 0002001
13.339 13.339 15.112 90 90 120 P6_3/mmc
atom      x     y     z  occ Uiso
Si1   .0012 .2308 .1058 .939 .027
Al1   .0012 .2308 .1058 .061 .027
Si2   .0871 .4190   .25 .512 .015
Al2   .0871 .4190   .25 .488 .015
Ca1     1/3   2/3  .118  .40 .091
Ca2     1/3   2/3  .942  .47 .082
Ca3     2/3   1/3  .221  .07 .041
Ca4      .5     0     0  .04 .091
K         0     0   .25      .051
O1    .0295 .3443 .1584      .044
O2    .0991 .1982 .1285      .052
O3    .1266 .2532 .6284      .044
O4    .2645     0     0      .051
O5    .2314 .4628   .25      .033
O6    .1105 .5552   .25      .035
Wat1  .2705 .5410 -.060  .39 .067
Wat1b .2439 .4878 .0154  .46 .067
Wat2  .2050 .4100   .75  .31 .048
Wat2b  .254  .508  .691  .29 .048
Wat3  .4414 .8828 .9141  .62 .047
Wat3b  .470 -.060  .027  .38 .047
Wat3c .4205 .8410 .6586  .18 .047
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Erionite-Ca
 
Gualtieri A, Artioli G, Passaglia E, Bigi S, Viani A, Hanson J C
Download am/vol83/AM83_590.pdf
American Mineralogist 83 (1998) 590-606
Crystal structure-crystal chemistry relationships in the zeolites erionite
and offretite
Sample from Shourdo
_database_code_amcsd 0002002
13.264 13.264 15.067 90 90 120 P6_3/mmc
atom      x     y     z  occ Uiso
Si1   .0006 .2329 .1052 .823 .036
Al1   .0006 .2329 .1052 .177 .036
Si2   .0926 .4226   .25 .695 .031
Al2   .0926 .4226   .25 .305 .031
Ca1     1/3   2/3  .104  .15 .077
Ca2     1/3   2/3  .887  .12 .069
Ca3     2/3   1/3 .2010  .13 .032
Ca4      .5     0     0  .14 .065
Mg      2/3   1/3 .0730  .13 .103
K         0     0   .25      .038
O1    .0251 .3473 .6609      .045
O2    .0973 .1946 .1261      .019
O3    .1263 .2526 .6320      .024
O4    .2680     0     0      .038
O5    .2310 .4620   .25      .043
O6    .0970 .5485   .25      .070
Wat1   .266  .532  .008  .29 .086
Wat2   .235  .470  .718  .36 .128
Wat2b  .260  .522  .694  .18 .128
Wat3   .431  .862  .903  .61 .138
Wat3b  .462 -.074  .029  .22 .138
Wat3c  .465  .930  .779  .14 .138
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Erionite-Ca
 
Gualtieri A, Artioli G, Passaglia E, Bigi S, Viani A, Hanson J C
Download am/vol83/AM83_590.pdf
American Mineralogist 83 (1998) 590-606
Crystal structure-crystal chemistry relationships in the zeolites erionite
and offretite
Sample from Tunguska
_database_code_amcsd 0002003
13.304 13.304 15.078 90 90 120 P6_3/mmc
atom      x     y     z  occ Uiso
Si1   .0030 .2332 .1057 .823 .036
Al1   .0030 .2332 .1057 .177 .036
Si2   .0945 .4227   .25 .645 .028
Al2   .0945 .4227   .25 .355 .028
Ca1     1/3   2/3  .113  .16 .026
Ca2     1/3   2/3 .9263  .55 .072
Ca3     2/3   1/3  .219  .13 .033
Ca4      .5     0     0  .04 .095
K         0     0   .25  .85 .039
O1    .0223 .3453 .6616      .026
O2    .0952 .1904 .1255      .042
O3    .1259 .2518 .6383      .058
O4    .2661     0     0      .040
O5    .2284 .4568   .25      .051
O6    .0722 .5361   .25      .061
Wat1  .2476 .4952  .020  .39 .128
Wat2   .242  .484   .75  .24 .149
Wat2b  .238  .476  .678  .46 .149
Wat3  .4337 .8674  .882  .74 .128
Wat3b  .534  .069  .004  .33 .128
Wat3c  .421  .842  .711  .19 .128
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Erionite-Ca
 
Gualtieri A, Artioli G, Passaglia E, Bigi S, Viani A, Hanson J C
Download am/vol83/AM83_590.pdf
American Mineralogist 83 (1998) 590-606
Crystal structure-crystal chemistry relationships in the zeolites erionite
and offretite
Sample from Agate Beach
_database_code_amcsd 0002004
13.289 13.289 15.079 90 90 120 P6_3/mmc
atom       x     y     z  occ Uiso
Si1   -.0005 .2332 .1015 .830 .031
Al1   -.0005 .2332 .1015 .170 .031
Si2    .0897 .4249   .25 .655 .046
Al2    .0897 .4249   .25 .345 .046
Ca1      1/3   2/3 .1137  .30 .085
Ca2      1/3   2/3 .9047  .22 .079
Ca3      2/3   1/3  .177  .16 .020
Mg       2/3   1/3  .049  .20 .018
K          0     0   .25  .87 .017
O1     .0175 .3305 .6752      .057
O2     .0915 .1830 .1176      .064
O3     .1101 .2202 .6371      .062
O4     .2693     0     0      .019
O5     .2329 .4658   .25      .088
O6     .0365 .5182   .25      .052
Wat1    .245  .490  .106  .33 .162
Wat2b  .2658 .5316 .7009  .86 .135
Wat3    .422  .844  .897  .90 .107
Wat3b   .469 -.602  .073  .30 .107
Wat3c   .441  .882  .789  .24 .107
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Offretite
Download hom/offretite.pdf
Gualtieri A, Artioli G, Passaglia E, Bigi S, Viani A, Hanson J C
Download am/vol83/AM83_590.pdf
American Mineralogist 83 (1998) 590-606
Crystal structure-crystal chemistry relationships in the zeolites erionite
and offretite
Sample from Mt. Semiol
_database_code_amcsd 0002005
13.293 13.293 7.608 90 90 120 P-6m2
atom       x     y     z occ Uiso
Si1   -.0004 .2308 .2067 .71 .028
Al1   -.0004 .2308 .2067 .29 .028
Si2    .0919 .4210    .5 .71 .030
Al2    .0919 .4210    .5 .29 .030
Ca1      2/3   1/3  .353 .43 .067
Ca2      2/3   1/3  .245 .27 .052
K          0     0    .5     .040
Mg       1/3   2/3     0     .026
O1     .0267 .3476 .3188     .030
O2     .0942 .9056 .2340     .016
O3     .8849 .1151 .2807     .026
O4     .0093 .2722     0     .032
O5     .2271 .7729    .5     .010
O6     .4545 .5455    .5     .051
Wat1     1/3   2/3 .2587     .043
Wat2   .2437 .7563     0 .80 .041
Wat3   .1740 .4957     0 .30 .060
Wat4   .7579 .2421    .5     .058
Wat5  -.4357 .4357 .1713 .35 .042
Wat5b -.4820 .4820 .1231 .37 .042
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Offretite
Download hom/offretite.pdf
Gualtieri A, Artioli G, Passaglia E, Bigi S, Viani A, Hanson J C
Download am/vol83/AM83_590.pdf
American Mineralogist 83 (1998) 590-606
Crystal structure-crystal chemistry relationships in the zeolites erionite
and offretite
Sample #1 from Fitta
_database_code_amcsd 0002006
13.390 13.390 7.598 90 90 120 P-6m2
atom      x     y     z occ Uiso
Si1  -.0014 .2321 .2087 .70 .039
Al1  -.0014 .2321 .2087 .30 .039
Si2   .0884 .4231    .5 .70 .020
Al2   .0884 .4231    .5 .30 .020
Ca1     2/3   1/3 .4021 .40 .042
Ca2     2/3   1/3 .2664 .36 .048
K         0     0    .5 .96 .051
Mg      1/3   2/3     0 .97 .043
O1    .0260 .3494 .3160     .020
O2    .0962 .9037 .2500     .028
O3    .8734 .1265 .2926     .066
O4    .0052 .2644     0     .022
O5    .2331 .7668    .5     .026
O6    .4602 .5397    .5     .037
Wat1    1/3   2/3 .2335     .120
Wat2  .2432 .7568     0 .81 .063
Wat3  .1350 .5104     0 .26 .060
Wat4  .7663 .2337    .5 .85 .056
Wat5 -.4325 .4325 .1682     .062
Wat6 -.2539 .2539     0 .32 .060
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Offretite
Download hom/offretite.pdf
Gualtieri A, Artioli G, Passaglia E, Bigi S, Viani A, Hanson J C
Download am/vol83/AM83_590.pdf
American Mineralogist 83 (1998) 590-606
Crystal structure-crystal chemistry relationships in the zeolites erionite
and offretite
Sample #2 from Fitta
_database_code_amcsd 0002007
13.308 13.308 7.597 90 90 120 P-6m2
atom      x     y     z occ Uiso
Si1   .0006 .2317 .2048 .70 .039
Al1   .0006 .2317 .2048 .30 .039
Si2   .0921 .4227    .5 .70 .026
Al2   .0921 .4227    .5 .30 .026
Ca1     2/3   1/3 .3876 .43 .041
Ca2     2/3   1/3 .2438 .32 .033
K         0     0    .5 .89 .018
Mg      1/3   2/3     0 .86 .030
O1    .0208 .3479 .3173     .020
O2    .0957 .9043 .2686     .091
O3    .8761 .1239 .2900     .089
O4    .0019 .2691     0     .049
O5    .2287 .7713    .5     .067
O6     .457  .543    .5     .019
Wat1    1/3   2/3 .2335     .120
Wat2  .2424 .7576     0 .65 .020
Wat3  .1129 .4602     0 .55 .039
Wat4  .7564 .2436    .5 .94 .044
Wat5 -.4363 .4363 .1603      .13
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Chondrodite
Download hom/chondrodite.pdf
Ottolini L, Camara F, Bigi S
Download am/vol85/AM85_89.pdf
American Mineralogist 85 (2000) 89-102
An investigation of matrix effects in the analysis of fluorine in humite-group
minerals by EMPA, SIMS, and SREF
Sample: Chum HV-41 n.2
_database_code_amcsd 0002337
4.7405 10.2377 13.6496 100.843 90 90 P2_1/b
atom      x      y      z occ Biso
Si1  .07329 .06623 .38930      .31
Si2  .07641 .17670 .83511      .31
Mg1A     .5      0     .5      .46
Mg1B .49743 .94627 .27421      .48
Mg25 .00928 .14038 .17026      .49
Mg26 .50876 .25023 .38825      .45
Mg3  .49277 .87792 .04299      .52
O11  .73294 .06451 .38811      .41
O12  .27787 .41947 .38776      .40
O13  .22308 .11240 .29312      .43
O14  .22238 .15881 .48636      .43
O21  .23624 .32276 .16287      .40
O22  .77897 .96885 .16257      .44
O23  .72430 .27994 .26273      .45
O24  .72808 .22680 .07021      .45
F5   .26152 .04630 .05566 .64  .68
O5   .26152 .04630 .05566 .36  .68
H      .067  -.021   .013 .33 4.51
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Clinohumite
Download hom/clinohumite.pdf
Ottolini L, Camara F, Bigi S
Download am/vol85/AM85_89.pdf
American Mineralogist 85 (2000) 89-102
An investigation of matrix effects in the analysis of fluorine in humite-group
minerals by EMPA, SIMS, and SREF
Sample: Chum HV-41 n.3
_database_code_amcsd 0002338
4.7396 10.2328 13.6439 100.843 90 90 P2_1/b
atom      x      y      z occ Biso
Si1  .07341 .06624 .38934      .32
Si2  .07655 .17672 .83514      .31
Mg1A     .5      0     .5      .51
Mg1B .49760 .94628 .27423       .5
Mg25 .00935 .14043 .17024       .5
Mg26 .50894 .25023 .38823      .49
Mg3  .49291 .87778 .04305      .52
O11  .73319 .06451 .38810      .38
O12  .27818 .41946 .38781      .42
O13  .22349 .11244 .29321      .43
O14  .22232 .15885 .48631      .44
O21  .23585 .32291 .16289      .40
O22  .77862 .96886 .16249      .43
O23  .72435 .27998 .26271      .42
O24  .72776 .22658 .07007      .45
F5   .26193 .04644 .05568 .52  .67
O5   .26193 .04644 .05568 .48  .67
H      .084   .001   .021 .46 4.35
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Chondrodite
Download hom/chondrodite.pdf
Ottolini L, Camara F, Bigi S
Download am/vol85/AM85_89.pdf
American Mineralogist 85 (2000) 89-102
An investigation of matrix effects in the analysis of fluorine in humite-group
minerals by EMPA, SIMS, and SREF
Sample: Chond HV-43 n.3
_database_code_amcsd 0002339
4.7230 10.2584 7.8504 109.076 90 90 P2_1/b
atom      x      y      z occ Biso
Si   .07656 .14403 .70374      .35
Mg1      .5      0     .5      .52
Mg2  .00943 .17358 .30654      .49
Mg3  .49214 .88645 .07927      .49
O1   .77761 .00156 .29407      .46
O2   .72731 .24074 .12567      .42
O3   .22439 .16824 .52798      .41
O4   .26401 .85487 .29478      .39
F5   .26227 .05742 .10053 .62  .68
O5   .26227 .05742 .10053 .38  .68
H      .143   .024   .021 .38 3.79
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Chondrodite
Download hom/chondrodite.pdf
Ottolini L, Camara F, Bigi S
Download am/vol85/AM85_89.pdf
American Mineralogist 85 (2000) 89-102
An investigation of matrix effects in the analysis of fluorine in humite-group
minerals by EMPA, SIMS, and SREF
Sample: Chond HV-43 n.4
_database_code_amcsd 0002340
4.7226 10.2564 7.8490 109.076 90 90 P2_1/b
atom      x      y      z occ Biso
Si   .07642 .14413 .70375      .37
Mg1      .5      0     .5      .51
Mg2  .00936 .17352 .30652       .5
Mg3  .49218 .88645 .07939       .5
O1   .77749 .00158 .29381      .48
O2   .72730 .24078 .12569      .45
O3   .22456 .16834 .52795      .45
O4   .26413 .85492 .29496      .42
F    .26252 .05756 .10064 .62  .73
O5   .26252 .05756 .10064 .38  .73
H      .100   .016   .023 .38  .41
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Chabazite-Mg
 
Montagna G, Bigi S, Konya P, Szakall S, Vezzalini G
 
American Mineralogist 95 (2010) 939-945
Chabazite-Mg: A new natural zeolite of the chabazite series
Locality: basalts of Praga Hill, Veszprem County, West Hungary
_database_code_amcsd 0005050
9.3433 9.3433 9.3433 94.894 94.894 94.894 R-3m
atom        x      y      z  occ  Uiso
MgC3a    .425   .350   .425  .11  .085
KC2     .2380  .2380  .2380  .26  .047
CaC4    .5843  .5843   .221 .058  .041
SiT    .10679 .33406 .87926  .74 .0148
AlT    .10679 .33406 .87926  .26 .0148
O1      .2583 -.2583      0      .0441
O2      .1544 -.1544     .5      .0321
O3      .2560  .2560  .8998      .0405
O4      .0313  .0313  .3312      .0346
Wat1        0     .5     .5  .48   .13
Wat2     .258   .258   .524  .24   .16
Wat3     .151   .419   .511  .29   .19
Wat4     .375  -.375     .5  .34   .20
Wat6a    .289   .289   .232  .21  .072
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Pb2FeCl3(OH)4.H2O
 
Pasero M, Perchiazzi N, Bigi S, Franzini M, Merlino S
 
European Journal of Mineralogy 9 (1997) 43-51
Pb2FeCl3(OH)4.H2O, a newly discovered natural phase from Tuscany,
Italy: physio-chemical data, crystal structure, and OD character
Locality: Tuscany, Italy
_database_code_amcsd 0006643
8.033 6.253 9.221 90 102.98 90 P2_1
atom     x     y     z  Uiso
Pb1  .8462 .2133 .8084 .0198
Pb2  .3181 .2555 .8119 .0227
Fe   -.002  .484  .505  .017
Cl1   .137  .229  .058  .020
Cl2   .649  .226  .065  .022
Cl3   .463  .465  .359  .032
OH1  -.063  .487  .298  .001
OH2   .056  .442  .732  .024
OH3   .165  .713  .495  .011
OH4   .169  .247  .512  .022
Wat5  .436  .950  .284  .053
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Yuanfuliite
Download hom/yuanfuliite.pdf
Appel P W U, Bigi S, Brigatti M F
 
European Journal of Mineralogy 11 (1999) 483-491
Crystal structure and chemistry of yuanfuliite
and its relationships with warwickite
Sample: 425359
Locality: Inglefield Land, North-West Greenland
_database_code_amcsd 0006777
9.198 3.091 9.355 90 90 90 Pnma
atom      x   y      z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2)  B(1,3) B(2,3)
MgM1 .11469 .25 .56943 .378  .50 .00171 .01125 .00140      0 -.00026      0
FeM1 .11469 .25 .56943 .529  .50 .00171 .01125 .00140      0 -.00026      0
CrM1 .11469 .25 .56943 .018  .50 .00171 .01125 .00140      0 -.00026      0
TiM1 .11469 .25 .56943 .070  .50 .00171 .01125 .00140      0 -.00026      0
MgM2 .10299 .25 .19214 .585  .61 .00156 .01517 .00202      0  .00008      0
FeM2 .10299 .25 .19214 .188  .61 .00156 .01517 .00202      0  .00008      0
MnM2 .10299 .25 .19214 .005  .61 .00156 .01517 .00202      0  .00008      0
AlM2 .10299 .25 .19214 .226  .61 .00156 .01517 .00202      0  .00008      0
B     .1654 .25  .8755       .53 .00174 .01308 .00140      0 -.00032      0
O1    .0190 .25  .8682       .86 .00147 .03166 .00245      0 -.00023      0
O2    .2467 .25  .7495       .79 .00218 .03244 .00117      0  .00034      0
O3    .2357 .25  .0072       .72 .00198 .02747 .00131      0 -.00046      0
O4    .0110 .25  .3831       .69 .00233 .02093 .00137      0  .00032      0
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Yuanfuliite
Download hom/yuanfuliite.pdf
Appel P W U, Bigi S, Brigatti M F
 
European Journal of Mineralogy 11 (1999) 483-491
Crystal structure and chemistry of yuanfuliite
and its relationships with warwickite
Sample: 425360
Locality: Inglefield Land, North-West Greenland
_database_code_amcsd 0006778
9.174 3.084 9.337 90 90 90 Pnma
atom      x   y      z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2)  B(1,3) B(2,3)
MgM1 .11447 .25 .56959 .395  .57 .00178 .01314 .00177      0 -.00020      0
AlM1 .11447 .25 .56959 .003  .57 .00178 .01314 .00177      0 -.00020      0
FeM1 .11447 .25 .56959 .514  .57 .00178 .01314 .00177      0 -.00020      0
CrM1 .11447 .25 .56959 .005  .57 .00178 .01314 .00177      0 -.00020      0
TiM1 .11447 .25 .56959 .077  .57 .00178 .01314 .00177      0 -.00020      0
MgM2 .10303 .25 .19206 .574  .66 .00163 .01629 .00232      0  .00008      0
FeM2 .10303 .25 .19206 .151  .66 .00163 .01629 .00232      0  .00008      0
AlM2 .10303 .25 .19206 .280  .66 .00163 .01629 .00232      0  .00008      0
B     .1658 .25  .8756       .64 .00207 .01603 .00174      0 -.00020      0
O1    .0190 .25  .8677      1.04 .00187 .03942 .00283      0 -.00026      0
O2    .2467 .25  .7495       .98 .00264 .03706 .00183      0  .00020      0
O3    .2357 .25  .0075       .86 .00222 .03259 .00169      0 -.00049      0
O4    .0117 .25  .3832       .80 .00270 .02365 .00166      0  .00037      0
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Sardignaite
 
Orlandi P, Pasero M, Bigi S
 
Mineralogy and Petrology 100 (2010) 17-22
Sardignaite, a new mineral, the second known bismuth molybdate:
description and crystal structure
Locality: Su Senargiu, near Sarroch, Sardegna, Italy
_database_code_amcsd 0017091
5.7797 11.567 6.3344 90 113.360 90 P2_1/m
atom      x      y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Bi   .15761    .75 .26334 .0238  .0264  .0217  .0212      0  .0074      0
Mo    .6926 .59567  .6545 .0200  .0206  .0162  .0201  .0002  .0050 -.0009
O1     .886  .6153   .511  .032   .033   .028   .036   .001   .016   .002
O2     .886  .6187   .937  .030   .031   .026   .025   .000   .002  -.001
O3     .656  .4333   .634 .0225   .024   .017   .023  -.000   .006  -.001
O4     .531    .75   .592  .022   .027   .016   .022      0   .008      0
O5     .381    .75   .075  .038   .046   .046   .031      0   .025      0
O6     .400  .5737   .825  .026   .031   .023   .024  -.001   .010  -.001
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Total number of retrieved datasets: 32
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