American Mineralogist Crystal Structure Database

26 matching records for this search.

Filipstadite
Download hom/filipstadite.pdf
Dunn P J, Peacor D R, Criddle A J, Stanley C J
Download am/vol73/AM73_413.pdf
American Mineralogist 73 (1988) 413-419
Filipstadite, a new Mn-Fe3+-Sb derivative of spinel, from Lanban, Sweden
Locality: Langban, Varmland, Sweden
Note: cubic subcell, O arbitrarily placed in ideal eutactic position
_database_code_amcsd 0001146
8.640 8.640 8.640 90 90 90 Fd3m
atom    x    y    z  occ
Mn   .625 .625 .625 .625
Mg   .625 .625 .625 .375
Fe      0    0    0   .5
Sb      0    0    0   .5
O    .375 .375 .375
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Asisite
Download hom/asisite.pdf
Rouse R C, Peacor D R, Dunn P J, Criddle A J, Stanley C J, Innes J
Download am/vol73/AM73_643.pdf
American Mineralogist 73 (1988) 643-650
Asisite, a silicon-bearing lead oxychloride from the Kombat mine, South West
Africa (Namibia)
_database_code_amcsd 0001166
3.897 3.897 22.81 90 90 90 I4/mmm
atom x  y     z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb1  0  0 .0838            .020   .020   .007      0      0      0
Pb2  0  0 .3047 .75        .020   .020   .010      0      0      0
Cl   0  0    .5            .060   .060  .0300      0      0      0
O    0 .5  .144     .074
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Edgarbaileyite
Download hom/edgarbaileyite.pdf
Angel R J, Cressey G, Criddle A J
Download am/vol75/AM75_1192.pdf
American Mineralogist 75 (1990) 1192-1196
Edgarbaileyite, Hg6Si2O7: The crystal structure of the first mercury silicate
_database_code_amcsd 0001331
11.755 7.678 5.991 90 111.73 90 C2/m
atom     x     y     z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Hg1  .1140     0 .0490 1.56 0.0015 0.0102 0.0128      0 0.0019      0
Hg2  .1155 .2423 .5789 1.42 0.0016 0.0072 0.0135 0.0002 0.0011 0.0010
Si   .6491     0  .105  1.2
O1    .303     0  .113  1.8
O2    .311  .168  .728  1.7
O3      .5     0     0  0.1
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Fangite
Download hom/fangite.pdf
Wilson J R, Sen Gupta P K, Robinson P D, Criddle A J
Download am/vol78/AM78_1096.pdf
American Mineralogist 78 (1993) 1096-1103
Fangite, Tl3AsS4, a new thallium arsenic sulfosalt from the Mercur Au deposit,
Utah, and revised optical data for gillulyite
_database_code_amcsd 0001617
8.894 10.855 9.079 90 90 90 Pnma
atom     x     y      z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Tl1  .0612 .0494  .1958  .0331  .0236  .0314  .0021 -.0005 -.0028
Tl2  .3837   .25 -.1094  .0249   .064  .0280      0  .0020      0
As   .2807   .25  .4744   .015   .020   .014      0   .000      0
S1    .306   .25  .2338   .021   .033   .006      0  -.001      0
S2    .004   .25   .932   .020   .032   .024      0   .005      0
S3   .1557 .0869  .5354   .028   .024   .035  -.008   .002   .006
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Haggertyite
 
Grey I E, Velde D, Criddle A J
Download am/vol83/AM83_1323.pdf
American Mineralogist 83 (1998) 1323-1329
Haggertyite, a new magnetoplumbite-type titanate mineral from the
Prairie Creek (Arkansas) lamproite
_database_code_amcsd 0002051
5.9369 5.9369 23.3445 90 90 120 P6_3/mmc
atom      x      y      z occ  Uiso
BaA     1/3    2/3    .75 .69 .0136
KA      1/3    2/3    .75 .31 .0136
Fe1       0      0      0 .38 .0109
Ti1       0      0      0 .56 .0109
Mg1       0      0      0 .06 .0109
Fe2       0      0  .2586 .38 .0101
Ti2       0      0  .2586 .09 .0101
Mg2       0      0  .2586 .03 .0101
Fe3     1/3    2/3 .02658 .72 .0131
Ti3     1/3    2/3 .02658 .22 .0131
Mg3     1/3    2/3 .02658 .06 .0131
Fe4     1/3    2/3 .19034 .32 .0115
Ti4     1/3    2/3 .19034 .62 .0115
Mg4     1/3    2/3 .19034 .06 .0115
Fe5  .16780 .33561 .89243 .44 .0113
Ti5  .16780 .33561 .89243 .50 .0113
Mg5  .16780 .33561 .89243 .06 .0113
O1        0      0  .1523      .017
O2      1/3    2/3  .9408      .014
O3    .1841  .3682    .25      .014
O4    .1495  .2989  .0529      .012
O5    .4998  .9996  .1504      .013
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Suredaite
 
Paar W H, Miletich R, Topa D, Criddle A J, De Brodtkorb M K, Amthauer G, Tippelt G
Download am/vol85/AM85_1066.pdf
American Mineralogist 85 (2000) 1066-1075
Suredaite, PbSnS3, a new mineral species, from the Pirquitas Ag-Sn deposit,
NW-Argentina: Mineralogy and crystal structure
_database_code_amcsd 0002474
8.8221 3.7728 14.0076 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)
PbA   .5030 .75  .1705 .92  .0109  .0269  .0034      0 -.0001      0
SnA   .5030 .75  .1705 .08  .0109  .0269  .0034      0 -.0001      0
SnB   .1655 .25  .0521 .99  .0037  .0223  .0014      0  .0002      0
FeB   .1655 .25  .0521 .01  .0037  .0223  .0014      0  .0002      0
S1   -.0114 .75  .1062      .0063   .017  .0015      0 -.0014      0
S2    .3394 .75 -.0066      .0012   .031  .0013      0 -.0006      0
S3    .2855 .25  .2132      .0075   .015  .0016      0 -.0020      0
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Symesite
Download hom/symesite.pdf
Welch M D, Cooper M A, Hawthorne F C, Criddle A J
Download am/vol85/AM85_1526.pdf
American Mineralogist 85 (2000) 1526-1533
Symesite, Pb10(SO4)O7Cl4(H2O), a new PbO-related sheet mineral: Description and
crystal structure
_database_code_amcsd 0002592
19.727 8.796 13.631 82.21 78.08 100.04 B-1
atom      x     y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
S     .0078 .2544 .1866        .0207  .0452  .0215  .0077 -.0018 -.0074
Pb1  .82782 .0100 .1516        .0148  .0132  .0193  .0021 -.0028 -.0047
Pb2  .20839 .5489 .1468        .0165  .0136  .0178  .0037 -.0057 -.0078
Pb3  .91743 .6592 .1589        .0146  .0194  .0196  .0032 -.0037 -.0088
Pb4  .74960 .3610 .1582        .0155  .0143  .0177  .0027 -.0041 -.0078
Pb5  .28295 .1886 .1591        .0146  .0131  .0159  .0017 -.0043 -.0053
Pb6  .66701 .7222 .1285        .0169  .0151  .0205  .0035 -.0083 -.0075
Pb7  .37766 .8428 .1443        .0131  .0149  .0211  .0009 -.0014 -.0074
Pb8  .11177 .8864 .1523        .0150  .0161  .0179  .0021 -.0058 -.0060
Pb9  .46460 .4403 .1449        .0145  .0149  .0229  .0002 -.0049 -.0026
Pb10 .56724 .1162 .1439        .0158  .0178  .0221  .0033 -.0063 -.0103
Cl1   .4486 .1997 .0252        .0204  .0245  .0284  .0020 -.0087 -.0068
Cl2   .8124 .7275 .0260        .0236  .0274  .0263  .0087 -.0079 -.0113
Cl3   .6322 .4249 .0121        .0261  .0233  .0310  .0054 -.0084 -.0118
Cl4   .2739 .9080 .0195        .0257  .0201  .0296  .0035 -.0082 -.0089
O1    .0321 .1060 .2046 .1036
O2    .0147 .2892 .0756 .1036
O3    .0598 .3721 .2150 .1036
O4   -.0691 .2300 .2296 .1036
O5    .6821 .5229 .2333 .0164
O6    .1413 .6865 .2450 .0196
O7    .5036 .2610 .2351 .0173
O8    .2157 .3468 .2640 .0158
O9    .7793 .1482 .2725 .0149
O10   .6374 .1767 .2498 .0150
O11   .3256 .9930 .2455 .0145
O12   .0947 .6320 .0098 .0643
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Dukeite
 
Burns P C, Roberts A C, Stirling J A R, Criddle A J, Feinglos M N
Download am/vol85/AM85_1822.pdf
American Mineralogist 85 (2000) 1822-1827
Dukeite, Bi24Cr8O57(OH)6(H2O)3, a new mineral from Brejauba, Minas Gerais,
Brazil: Description and crystal structure
_database_code_amcsd 0002599
15.067 15.067 15.293 90 90 120 P31c
atom       x     y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Bi1   -.0237 .8074  .0630        .0192  .0379  .0200  .0184  .0038  .0056
Bi2    .6928 .6693  .0676        .0160  .0263  .0130  .0117 -.0023  .0024
Bi3    .8309 .5245  .0646        .0149  .0175  .0142  .0054  .0021 -.0022
Bi4    .6752 .4764  .2600        .0176  .0133  .0095  .0112  .0008 -.0001
Bi5    .0251 .7021  .2652        .0155  .0151  .0100  .0083  .0007  .0028
Bi6    .2921 .8245  .2649        .0201  .0190  .0078  .0136  .0012  .0002
Bi7    .1701 .9740  .2603        .0228  .0163  .0124  .0118 -.0002 -.0043
Bi8    .1261 .6464  .0651        .0535  .0188  .0050  .0075 -.0009  .0009
Cr1     .166  .836  -.089 .0149
Cr2      2/3   1/3  -.092 .0044
Cr3        0     0  -.088 .0258
Cr4    -.002  .494 -.0999 .0133
O1      .171  .832   .328 .0096
O2      .290  .947   .204 .0096
OH3     .830  .660  -.004 .0096
O4      .553  .340   .201 .0096
O5      .041  .841   .197 .0096
O6      .841  .790   .122 .0096
O7      .709  .548   .132 .0096
O8      .968  .655   .112 .0096
O9      .160  .832   .019 .0096
O10      2/3   1/3   .015 .0096
O11        0     0  -.194 .0096
O12    -.004  .497  -.207 .0096
O13    -.020  .093  -.062 .0096
O14    -.027  .579  -.062 .0096
O15    -.086  .380  -.063 .0096
O16     .671  .234  -.131 .0096
O17     .191  .751  -.126 .0096
O18     .263  .942  -.122 .0096
O19     .055  .813  -.126 .0096
O20     .109  .516  -.065 .0096
O21      2/3   1/3    .33 .0096
O22     .148  .707   .193 .0096
OH23    .017  .500   .105 .0096
Wat24   .339  .744   .105 .0096
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Baumstarkite
Download hom/baumstarkite.pdf
Effenberger H, Paar W H, Topa D, Criddle A J, Fleck M
Download am/vol87/AM87_753.pdf
American Mineralogist 87 (2002) 753-764
The new mineral baumstarkite and a structural reinvestigation of
aramayoite and miargyrite
_database_code_amcsd 0002820
7.766 8.322 8.814 100.62 104.03 90.22 P-1
atom      x      y      z  occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ag1  .10810 .42584 .14892       .0526  .0438  .0660  .0228  .0186  .0089
Ag2  .29748 .07224 .84390       .0518  .0422  .0643 -.0126  .0208  .0095
Ag3  .01456 .74128 .49807       .0357  .0465  .0311  .0024  .0068  .0097
Sb1  .63539 .41859 .16628 .994  .0232  .0183  .0247  .0027  .0070  .0046
As1  .63539 .41859 .16628 .006  .0232  .0183  .0247  .0027  .0070  .0046
Sb2  .17282 .91999 .17039 .966  .0229  .0177  .0241  .0035  .0053  .0035
As2  .17282 .91999 .17039 .034  .0229  .0177  .0241  .0035  .0053  .0035
Sb3  .48601 .24662 .49470 .974  .0248  .0193  .0272  .0020  .0073  .0018
Bi3  .48601 .24662 .49470 .026  .0248  .0193  .0272  .0020  .0073  .0018
S1    .8531  .2103  .2033       .0242  .0200  .0287  .0058  .0075  .0049
S2    .3751  .2545  .1731       .0237  .0241  .0251  .0002  .0063  .0057
S3    .7238  .5306  .4623       .0239  .0189  .0248  .0034  .0043  .0013
S4   -.0219  .7031  .1989       .0266  .0223  .0305 -.0003  .0087  .0025
S5    .4430  .7655  .1869       .0252  .0219  .0254  .0064  .0072  .0051
S6    .2447  .0324  .4631       .0255  .0195  .0253  .0001  .0088  .0009
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Aramayoite
Download hom/aramayoite.pdf
Effenberger H, Paar W H, Topa D, Criddle A J, Fleck M
Download am/vol87/AM87_753.pdf
American Mineralogist 87 (2002) 753-764
The new mineral baumstarkite and a structural reinvestigation of
aramayoite and miargyrite
_database_code_amcsd 0002821
7.813 8.268 8.880 100.32 104.07 90.18 P-1
atom       x      y      z  occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ag1   .11503 .42287 .14742       .0479  .0414  .0565  .0205  .0156  .0060
Ag2   .30433 .07450 .84722       .0500  .0400  .0530 -.0170  .0194  .0019
Ag3   .00914 .74334 .49858       .0278  .0387  .0249  .0014  .0054  .0059
Sb1   .64238 .41787 .16524 .937  .0182  .0163  .0195 .00172 .00499 .00364
Bi1   .64238 .41787 .16524 .063  .0182  .0163  .0195 .00172 .00499 .00364
Sb2   .16700 .91841 .16979 .963  .0174  .0165  .0193 .00243 .00389 .00267
Bi2   .16700 .91841 .16979 .037  .0174  .0165  .0193 .00243 .00389 .00267
Bi3   .49374 .24679 .49421 .903 .02031 .01733 .01897 .00126 .00456 .00252
Sb3   .49374 .24679 .49421 .097 .02031 .01733 .01897 .00126 .00456 .00252
S1    .85745 .20464 .20003       .0179  .0199  .0236  .0046  .0038  .0032
S2    .38019 .25024 .16822       .0185  .0224  .0187 -.0013  .0039  .0037
S3    .73044 .52180 .46193       .0199  .0190  .0189  .0011  .0035  .0007
S4   -.02532 .69719 .19690       .0208  .0224  .0241 -.0021  .0053  .0031
S5    .43666 .76178 .18244       .0187  .0220  .0183  .0062  .0041  .0032
S6    .23938 .02194 .46306       .0208  .0198  .0185  .0012  .0053  .0001
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Miargyrite
Download hom/miargyrite.pdf
Effenberger H, Paar W H, Topa D, Criddle A J, Fleck M
Download am/vol87/AM87_753.pdf
American Mineralogist 87 (2002) 753-764
The new mineral baumstarkite and a structural reinvestigation of
aramayoite and miargyrite
_database_code_amcsd 0002822
12.862 4.409 13.218 90 98.48 90 C2/c
atom      x       y      z U(1,1) U(2,2) U(3,3)  U(1,2) U(1,3)  U(2,3)
Ag1       0  .02945    .25  .0250  .0439  .0344       0  .0005       0
Ag2       0      .5     .5  .0346  .0593  .0392   .0157  .0145  -.0106
Sb   .25550 -.03358 .62662  .0218  .0184  .0148 -.00022  .0464 -.00050
S1   .14337   .3510 .69954  .0180  .0203  .0170  -.0005  .0041  -.0004
S2   .11173   .1796 .41767  .0207  .0237  .0210   .0012  .0084   .0017
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Hemloite
Download hom/hemloite.pdf
Harris D C, Hoskins B F, Grey I E, Criddle A J, Stanley C J
Download cm/vol27/CM27_427.pdf
The Canadian Mineralogist 27 (1989) 427-440
Hemloite (As,Sb)2(Ti,V,Fe,Al)12O23OH: A new mineral from the Hemlo gold
deposit, Hemlo, Ontario, and its crystal structure
Locality: Hemlo gold deposit, Hemlo, Ontario, Canada
_database_code_amcsd 0005230
7.158 7.552 16.014 89.06 104.32 84.97 P-1
atom      x      y       z  occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Sb1  .58105 .27632 -.36243  .47  .0071  .0083  .0240 -.0006 -.0007 -.0085
As1  .58105 .27632 -.36243 .474  .0071  .0083  .0240 -.0006  .0007 -.0085
As2   .5846  .0580  -.0724 .685  .0070  .0074  .0206 -.0010  .0007 -.0061
As3   .4135  .1690  -.2158 .315  .0073  .0062  .0093 -.0030  .0048 -.0014
FeM1  .0005 -.2131  -.0353       .0041  .0036  .0039 -.0014  .0017  .0003
TiM2 -.0018  .1142  -.1473  .68  .0117  .0089  .0108 -.0021  .0049 -.0008
AlM2 -.0018  .1142  -.1473  .32  .0117  .0089  .0108 -.0021  .0049 -.0008
FeM3  .0016  .0142  -.3316       .0056  .0044  .0049 -.0013  .0031  .0001
FeM4  .0057  .4401  -.2593       .0045  .0032  .0037 -.0013  .0026  .0004
TiM5  .0039  .3396  -.4484  .70  .0076  .0060  .0078 -.0022  .0046  .0006
VM5   .0039  .3396  -.4484  .30  .0076  .0060  .0078 -.0022  .0046  .0006
TiM6  .3139  .4198  -.0541  .70  .0074  .0058  .0074 -.0029  .0036 -.0009
VM6   .3139  .4198  -.0541  .30  .0074  .0058  .0074 -.0029  .0036 -.0009
TiM7  .3154  .7520  -.1648  .70  .0072  .0054  .0063 -.0010  .0036  .0000
VM7   .3154  .7520  -.1648  .30  .0072  .0054  .0063 -.0010  .0036  .0000
TiM8  .3143  .6489  -.3497  .70  .0084  .0065  .0082 -.0025  .0040 -.0008
VM8   .3143  .6489  -.3497  .30  .0084  .0065  .0082 -.0025  .0040 -.0008
FeM9  .3115  .9729  -.4638       .0035  .0014  .0040 -.0006  .0029  .0003
TiM10 .6852  .4771  -.1298  .70  .0083  .0061  .0072 -.0006  .0038  .0001
VM10  .6852  .4771  -.1298  .30  .0083  .0061  .0072 -.0006  .0038  .0001
TiM11 .6847  .8123  -.2388  .70  .0075  .0058  .0066 -.0029  .0031  .0000
VM11  .6847  .8123  -.2388  .30  .0075  .0058  .0066 -.0029  .0031  .0000
TiM12 .6894  .7027  -.4163  .70  .0077  .0055  .0060 -.0006  .0046  .0000
VM12  .6894  .7027  -.4163  .30  .0077  .0055  .0060 -.0006  .0046  .0000
O1   -.1589 -.2357   .0522        .011   .007   .012  -.002   .005  -.002
O2   -.1514  .0499  -.0648        .011   .010   .015  -.003   .008  -.008
O3   -.1797 -.3089  -.1292        .010   .006   .010  -.002   .004  -.000
O4    .1785 -.4183   .0105        .010   .009   .007  -.001   .001  -.002
O5    .1595 -.1113  -.1089        .015   .007   .012  -.001   .005  -.003
O6   -.1625  .3407  -.1871        .013   .006   .012  -.001   .003  -.001
O7   -.1573 -.0056  -.2440        .012   .006   .012  -.001   .005  -.002
O8    .1459  .1779  -.2320        .013   .007   .012  -.003   .008  -.002
O9   -.1543  .2781  -.3620        .009   .012   .008  -.001   .006   .000
O10  -.1816 -.0776  -.4207        .009   .006   .010  -.003   .004   .000
O11   .1813 -.1851  -.2850        .008   .007   .008   .001   .004   .001
O12   .1501  .1167  -.4058        .012   .006   .010  -.003   .005  -.001
O13  -.1695  .6474  -.2994        .011   .009   .008  -.002   .003  -.001
O14   .1821  .5366  -.1630        .011   .005   .010  -.003   .003  -.000
O15   .1631  .4634  -.3456        .014   .008   .006  -.004   .006  -.003
O16  -.1543  .5757  -.4770        .011   .007   .012  -.002   .008  -.003
O17  -.1787  .2409  -.5421        .009   .008   .008  -.002   .002  -.001
O18   .5007  .6207  -.0622        .009   .008   .007   .000   .003   .000
O19   .5016  .2841  -.1172        .011   .009   .017  -.001   .007  -.003
O20   .5035  .9437  -.1735        .011   .011   .013  -.002   .004  -.003
O21   .4999  .6100  -.2294        .008   .007   .011  -.002   .005  -.001
O22   .5021  .8478  -.3560        .010   .006   .008   .001   .005   .002
O23   .5126  .5144  -.4013        .011   .006   .013  -.005   .004   .001
O24   .5031  .8239  -.5260        .009   .007   .011  -.000   .002  -.004
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Nezilovite
 
Bermanec V, Holtstam D, Sturman D, Criddle A J, Back M E, Scavnicar S
Download cm/vol34/CM34_1287.pdf
The Canadian Mineralogist 34 (1996) 1287-1297
Nezilovite, a new member of the magnetoplumbite group, and the crystal
chemistry of mognetoplumbite and hibonite
_database_code_amcsd 0005518
5.849 5.849 22.809 90 90 120 P6_3/mmc
atom     x      y      z occ Biso
Pb     2/3    1/3    .25      7.5
AlM1     0      0      0       .6
FeM2     0      0  .2590 .18   .2
TiM2     0      0  .2590 .22   .2
MnM2     0      0  .2590 .10   .2
ZnM3   1/3    2/3  .0272 .95   .5
MnM4   2/3    1/3 -.1893 .29   .5
FeM4   2/3    1/3 -.1893 .71   .5
MnM5 .1677  .3354 -.1063 .29   .2
FeM5 .1677  .3354 -.1063 .71   .2
O1       0      0  .1512      2.1
O2     1/3    2/3 -.0598       .6
O3    .361  .1805    .75      3.1
O4    .145   .290  .0523       .8
O5   .5024 -.5024  .3511      1.1
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Magnetoplumbite
Download hom/magnetoplumbite.pdf
Bermanec V, Holtstam D, Sturman D, Criddle A J, Back M E, Scavnicar S
Download cm/vol34/CM34_1287.pdf
The Canadian Mineralogist 34 (1996) 1287-1297
Nezilovite, a new member of the magnetoplumbite group, and the crystal
chemistry of mognetoplumbite and hibonite
_database_code_amcsd 0005519
5.902 5.902 23.185 90 90 120 P6_3/mmc
atom      x     y      z occ Biso
Pb      2/3   1/3    .25 .98  7.4
Ba      2/3   1/3    .25 .02  7.4
FeM1      0     0      0 .75   .3
MgM1      0     0      0 .25   .3
FeM2      0     0  .2587  .5   .6
MnM3    1/3   2/3  .0262 .45   .7
FeM3    1/3   2/3  .0262 .55   .7
SbM4    2/3   1/3 -.1895 .29   .6
FeM4    2/3   1/3 -.1895 .71   .6
MnM5 .16675 .3335 -.1076 .15   .6
FeM5 .16675 .3335 -.1076 .85   .6
O1        0     0  .1523      1.6
O2      1/3   2/3 -.0585       .8
O3     .375 .1875    .75       .9
O4    .1505  .301  .0532       .7
O5     .503 -.503  .3490       .9
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Hibonite
Download hom/hibonite.pdf
Bermanec V, Holtstam D, Sturman D, Criddle A J, Back M E, Scavnicar S
Download cm/vol34/CM34_1287.pdf
The Canadian Mineralogist 34 (1996) 1287-1297
Nezilovite, a new member of the magnetoplumbite group, and the crystal
chemistry of mognetoplumbite and hibonite
_database_code_amcsd 0005520
5.613 5.613 22.285 90 90 120 P6_3/mmc
atom     x      y      z occ Biso
Ca     2/3    1/3    .25 .85  2.8
Ce     2/3    1/3    .25 .06  2.8
La     2/3    1/3    .25 .03  2.8
Nd     2/3    1/3    .25 .01  2.8
Mg     2/3    1/3    .25 .05  2.8
AlM1     0      0      0       .5
AlM2     0      0  .2379  .5  1.1
FeM3   1/3    2/3  .0271 .15   .7
MgM3   1/3    2/3  .0271 .24   .7
AlM3   1/3    2/3  .0271 .61   .7
SiM4   2/3    1/3 -.1889 .03   .8
TiM4   2/3    1/3 -.1889 .25   .8
AlM4   2/3    1/3 -.1889 .72   .8
AlM5 .1679  .3358 -.1071       .4
O1       0      0  .1481       .7
O2     1/3    2/3 -.0565       .8
O3    .362   .181    .75      2.3
O4   .1531  .3063  .0520      1.0
O5   .5043 -.5043  .3508       .9
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Walfordite
Download hom/walfordite.pdf
Back M E, Grice J D, Gault R A, Criddle A J, Mandarino J A
Download cm/vol37/CM37_1261.pdf
The Canadian Mineralogist 37 (1999) 1261-1268
Walforite, a new tellurite species from the Wendy Open Pit, El Indio-Tambo
Mining Property, Chile
Locality: Wendy Open Pit, El Indio-Tambo Mining Property, Chile
_database_code_amcsd 0005629
11.011 11.011 11.011 90 90 90 I2_1/a-3
atom      x     y     z occ  Uiso
Fe        0     0     0 .59 .0114
Te        0     0     0 .28 .0114
Ti        0     0     0 .08 .0114
Mg        0     0     0 .05 .0114
Te   .21099     0   1/4     .0197
O1    .4361 .1335 .3962     .0248
O2    .1725 .1725 .1725     .0213
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Sewardite
 
Roberts A C, Cooper M A, Hawthorne F C, Criddle A J, Stirling J A R
Download cm/vol40/CM40_1191.pdf
The Canadian Mineralogist 40 (2002) 1191-1198
Sewardite, CaFe2(AsO4)2(OH)2, the Ca-analogue of carminite,
from Tsumeb, Namibia: Description and crystal structure
Locality: Tsumeb, Namibia
_database_code_amcsd 0005788
16.461 7.434 12.131 90 90 90 Cccm
atom      x      y      z  Uiso
Ca1       0      0    1/4 .0185
Ca2     1/4    3/4      0 .0101
Fe   .37896  .1321 .13404 .0056
As1  .04504  .7447      0 .0054
As2  .21374      0    1/4 .0048
O1    .0144  .2246  .1119  .005
O2    .0885   .529      0  .006
O3    .1219  -.114      0  .012
O4    .1511  .1777  .2389  .011
O5    .2720 -.0150  .1378  .005
OH6   .1711   .233      0  .005
OH7   .4243      0    1/4  .017
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Schlemaite
Download hom/schlemaite.pdf
Forster H J, Cooper M A, Roberts A C, Stanley C J, Criddle A J,
Hawthorne F C, Laflamme J H G, Tischendorf G
Download cm/vol41/CM41_1433.pdf
The Canadian Mineralogist 41 (2003) 1433-1444
Schlemaite, (Cu,_)6(Pb,Bi)Se4, a new mineral species from Niederschlema-Alberoda,
Erzgebirge, Germany: Description and crystal structure
Locality: Niederschlema-Alberoda, Erzgebirge, Germany
_database_code_amcsd 0005918
9.5341 4.1004 10.2546 90 100.066 90 P2_1/m
atom       x    y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Cu1   -.0872  1/4 -.0409      .035   .048   .020   .042      0   .018      0
Cu2    .2588  1/4  .0273      .034   .044   .023   .043      0   .026      0
Cu3     .583  1/4   .474 .54  .024   .013   .036   .024      0   .005      0
Cu4     .500 .327 -.0849 .92  .044   .038   .056   .034   .014  -.004  -.001
Cu5    .7127 .075  .7208 .48  .062   .038   .083   .065   .029   .012   .039
Cu6     .509  1/4   .212 .18  .018
Cu7     .561  1/4   .891 .07  .010
Cu8     .537  1/4   .446 .26  .036
Ag     .3457  1/4  .2912 .20  .054   .035   .057   .061      0  -.017      0
Pb     .1178  1/4  .6702 .61 .0354  .0460  .0220  .0425      0  .0200      0
Bi     .1178  1/4  .6702 .39 .0354  .0460  .0220  .0425      0  .0200      0
Se1    .1650  3/4  .4887     .0179   .018   .019   .017      0   .004      0
Se2    .3008  3/4 -.0880     .0171   .018   .017   .017      0  .0058      0
Se3    .0883  1/4  .1837     .0188   .024   .017   .017      0   .009      0
Se4    .5289  3/4  .3268     .0238   .024   .030   .020      0   .009      0
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Pizgrischite
 
Meisser N, Schenk K, Berlepsch P, Brugger J, Bonin M, Criddle A J, Thelin P, Bussy F
Download cm/vol45/CM45_1229.pdf
The Canadian Mineralogist 45 (2007) 1229-1245
Pizgrischite, (Cu,Fe)Cu14PbBi17S35, a new sulfosalt from the Swiss Alps:
Description, crystal structure and occurrence
Locality: Piz Grisch Mountain, Val Ferrera, Graubunden, Switzerland
_database_code_amcsd 0006155
35.095 3.9067 43.222 90 96.71 90 C2/m
atom      x  y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb1  .87808 .5 .28981     .0374  .0262  .0493  .0350      0 -.0040      0
Bi1  .83272 .5 .43024     .0187  .0107  .0149  .0292      0 -.0029      0
Bi2  .43533 .5 .43755     .0206  .0112  .0190  .0299      0 -.0042      0
Bi3  .48725 .5 .29006     .0202  .0143  .0142  .0301      0 -.0057      0
Bi4  .22486 .5 .41883     .0199  .0121  .0172  .0291      0 -.0027      0
Bi5  .54122 .5 .39190     .0192  .0116  .0172  .0273      0 -.0043      0
Bi6  .77605 .5 .33146     .0256  .0141  .0280  .0326      0 -.0058      0
Bi7  .07211 .5 .10866     .0202  .0142  .0191  .0255      0 -.0051      0
Bi8  .11792 .5 .46427     .0220  .0148  .0207  .0288      0 -.0046      0
Bi9  .29783 .5 .15429     .0194  .0127  .0146  .0291      0 -.0056      0
Bi10 .35170 .5 .06782     .0198  .0149  .0144  .0294      0 -.0009      0
Bi11 .62900 .5 .03831     .0200  .0113  .0188  .0281      0 -.0049      0
Bi12 .09069 .5 .29255     .0231  .0171  .0197  .0307      0 -.0054      0
Bi13 .71726  0 .25356     .0251  .0246  .0201  .0283      0 -.0071      0
Bi14 .95322 .5 .06212     .0210  .0125  .0206  .0287      0 -.0024      0
Bi15 .40889 .5 .20603     .0195  .0136  .0153  .0276      0 -.0064      0
Bi16 .11495 .5 .20713     .0219  .0121  .0218  .0304      0 -.0031      0
Bi17 .74597 .5 .07344     .0249  .0115  .0307  .0305      0 -.0059      0
Cu1  .81357 .5 .23153     .0286   .017   .028   .039      0  -.004      0
Cu2  .53261 .5 .03173     .0315   .017   .026   .048      0  -.011      0
Cu3  .63631 .5 .38674     .0341   .022   .024   .057      0   .007      0
Cu4  .28162 .5 .49869     .0326   .028   .025   .041      0  -.012      0
Cu5  .70395 .5 .18146     .0271   .014   .019   .048      0   .002      0
Cu6  .94277 .5 .35623     .0398   .038   .026   .049      0  -.022      0
Cu7  .16616 .5 .12222     .0276   .016   .030   .035      0  -.005      0
Cu8  .02411 .5 .46870     .0314   .026   .026   .043      0   .007      0
Cu9A  .6811 .5  .3236 .43  .029
Cu9B  .6724 .5  .3071 .57  .027
Cu10 .48048 .5 .14103      .051   .030   .075   .046      0  -.002      0
Cu11  .9185 .5 .13739      .055   .090   .021   .064      0   .045      0
Cu12 .00502 .5 .22807     .0387   .041   .029   .042      0  -.013      0
Cu13 .37489 .5 .36494     .0409   .051   .023   .041      0  -.027      0
Cu14 .52719 .5 .19096      .054   .028   .088   .046      0   .001      0
Cu15 .78546 .5 .00309 .77 .0395   .062   .025   .033      0   .012      0
Fe15 .78546 .5 .00309 .23 .0395   .062   .025   .033      0   .012      0
S1    .6732  0 .17639      .016
S2    .3297 .5  .5389      .019
S3    .2879 .5  .3929      .018
S4    .1087 .5 .40303      .014
S5    .5516 .5 .45275      .015
S6    .7687 .5  .1869      .018
S7    .9899 .5  .3965      .019
S8    .6559 .5  .2509      .018
S9    .5827 .5 .16938      .015
S10   .0303 .5  .3229      .018
S11   .5404 .5  .2453      .020
S12   .8734 .5 .17144      .013
S13   .7113  0 .31240      .013
S14   .6827  0 .03947      .014
S15   .3280 .5  .3240      .017
S16   .8818 .5  .0335      .018
S17   .6167 .5  .3301      .019
S18   .5185 .5 .10135      .016
S19   .4292 .5 .32849      .016
S20   .7723 .5  .4705      .022
S21   .4661 .5  .0239      .017
S22   .9842 .5  .1742      .021
S23   .7008 .5  .3805      .017
S24   .8150 .5 .10498      .016
S25   .2815 .5  .0320      .016
S26   .6373 .5  .0991      .019
S27   .7715 .5  .2687      .017
S28   .9593 .5  .4757      .018
S29   .3516 .5 .23875      .016
S30   .8875 .5  .3925      .016
S31   .0662 .5  .0475      .021
S32   .4209 .5  .1095      .024
S33   .9440 .5  .2524      .021
S34   .3728 .5 .46547      .016
S35   .2321 .5  .1151      .019
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Krettnichite
 
Brugger J, Armbruster T, Criddle A J, Berlepsch P, Graeser S, Reeves S
 
European Journal of Mineralogy 13 (2001) 145-158
Description, crystal structure, and paragenesis of krettnichite,
PbMn2(VO4)2(OH)2, the Mn3+ analogue of mounanaite
_database_code_amcsd 0006853
9.2953 6.2894 7.6906 90 118.068 90 C2/m
atom     x     y     z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb       0     0     0 .83 .0221  .0231  .0177  .0251      0  .0109      0
Sr       0     0     0 .17 .0221  .0231  .0177  .0251      0  .0109      0
Mn     1/4   1/4   1/2     .0124  .0122  .0113  .0138 -.0005  .0062 -.0011
V    .9213   1/2 .2189     .0107  .0101  .0102   .013      0  .0060      0
OH1  .3365   1/2  .420      .016   .010   .014   .020      0   .005      0
O2    .315     0  .351      .020   .022   .020   .023      0   .013      0
O3   .0432 .2737 .2645      .017   .016   .015   .018   .001   .008  -.002
O4    .219   1/2  .012      .027   .025   .027   .022      0   .005      0
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Paganoite
 
Roberts A C, Burns P C, Gault R A, Criddle A J, Feinglos M N, Stirling J A R
 
European Journal of Mineralogy 13 (2001) 167-175
Paganoite, NiBiAsO5, a new mineral from Johanngeorgenstadt,
Saxony, Germany: description and crystal structure
Locality: Johanngeorgenstadt, Saxony, Germany
_database_code_amcsd 0006855
6.7127 6.8293 5.2345 107.625 95.409 111.158 P-1
atom      x      y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ni    .3634  .7345  .8307 .0133  .0099  .0170  .0129  .0057  .0023  .0049
Bi   .23608 .96812 .40945 .0127  .0077  .0183  .0134  .0067  .0036  .0055
As    .1864  .3875  .1578 .0108  .0072  .0144  .0108  .0051  .0015  .0038
O1     .501   .050   .770 .0118  .0070  .0237  .0070  .0095  .0024  .0047
O2     .228   .628   .416 .0119  .0122  .0149  .0128  .0087  .0048  .0065
O3     .235   .423   .864 .0167  .0176  .0148  .0194  .0097  .0034  .0051
O4    -.083   .202   .084 .0145  .0111  .0166  .0160  .0055  .0045  .0061
O5     .347   .275   .268 .0163  .0087  .0204  .0237  .0080  .0048  .0103
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Tripuhyite
Download hom/tripuhyite.pdf
Berlepsch P, Armbruster T, Brugger J, Criddle A J, Graeser S
Download mm/vol67/MM67_31.pdf
Mineralogical Magazine 67 (2003) 31-46
Tripuhyte, FeSbO4, revisited
Locality: Tripuhy, Minas Gerais, Brazil
_database_code_amcsd 0014565
4.625 4.625 3.059 90 90 90 P4_2/mnm
atom     x    y z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Fe       0    0 0 .47 .0136  .0164  .0164    .08   -.01      0      0
Sb       0    0 0 .53 .0136  .0164  .0164    .08   -.01      0      0
O    -.304 .304 0      .008
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Tripuhyite
Download hom/tripuhyite.pdf
Berlepsch P, Armbruster T, Brugger J, Criddle A J, Graeser S
Download mm/vol67/MM67_31.pdf
Mineralogical Magazine 67 (2003) 31-46
Tripuhyte, FeSbO4, revisited
Locality: Falotta, Grisons, Switzerland
_database_code_amcsd 0014566
4.6433 4.6433 3.0815 90 90 90 P4_2/mnm
atom    x     y  z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Fe      0     0  0 .53 .0070  .0091  .0091  .0029  .0007      0      0
Sb      0     0  0 .47 .0070  .0091  .0091  .0029  .0007      0      0
O    .193 -.193 .5      .006
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Petewilliamsite
 
Roberts A C, Burns P C, Gault R A, Criddle A J, Feinglos M N
Download mm/vol68/MM68_231.pdf
Mineralogical Magazine 68 (2004) 231-240
Petewilliamsite, (Ni,Co)30(As2O7)15, a new mineral from Johanngeorgenstadt,
Saxony, Germany: description and crystal structure
Locality: Johanngeorgenstadt, Saxony, Germany
_database_code_amcsd 0014571
33.256 8.482 14.191 90 104.145 90 C2
atom       x      y      z  occ Uiso
NiM1       0  .0115      0  .47 .008
CoM1       0  .0115      0  .45 .008
CuM1       0  .0115      0  .08 .008
NiM2       0 -.6131      0  .47 .057
CoM2       0 -.6131      0  .45 .057
CuM2       0 -.6131      0  .08 .057
NiM3   .2988 -.4884  .3348  .47 .008
CoM3   .2988 -.4884  .3348  .45 .008
CuM3   .2988 -.4884  .3348  .08 .008
NiM4   .3957  .0096  .0042  .47 .011
CoM4   .3957  .0096  .0042  .45 .011
CuM4   .3957  .0096  .0042  .08 .011
NiM5   .4029  .0108 -.6690  .47 .011
CoM5   .4029  .0108 -.6690  .45 .011
CuM5   .4029  .0108 -.6690  .08 .011
NiM6   .3058  .5075 -.3386  .47 .014
CoM6   .3058  .5075 -.3386  .45 .014
CuM6   .3058  .5075 -.3386  .08 .014
NiM7   .4955  .5044 -.3287  .47 .022
CoM7   .4955  .5044 -.3287  .45 .022
CuM7   .4955  .5044 -.3287  .08 .022
NiM8   .1995  .0012  .0002  .47 .038
CoM8   .1995  .0012  .0002  .45 .038
CuM8   .1995  .0012  .0002  .08 .038
NiM9   .0909  .5000  .3452  .47 .000
CoM9   .0909  .5000  .3452  .45 .000
CuM9   .0909  .5000  .3452  .08 .000
NiM10  .3022 -.1227 -.0018  .47 .007
CoM10  .3022 -.1227 -.0018  .45 .007
CuM10  .3022 -.1227 -.0018  .08 .007
NiM11  .3994  .3776 -.3323  .47 .015
CoM11  .3994  .3776 -.3323  .45 .015
CuM11  .3994  .3776 -.3323  .08 .015
NiM12  .4956 -.1221 -.6631  .47 .008
CoM12  .4956 -.1221 -.6631  .45 .008
CuM12  .4956 -.1221 -.6631  .08 .008
NiM13  .2053 -.6212  .3289  .47 .010
CoM13  .2053 -.6212  .3289  .45 .010
CuM13  .2053 -.6212  .3289  .08 .010
NiM14  .0960 -.1187  .0041  .47 .021
CoM14  .0960 -.1187  .0041  .45 .021
CuM14  .0960 -.1187  .0041  .08 .021
NiM15  .6066  .3832 -.3408  .47 .023
CoM15  .6066  .3832 -.3408  .45 .023
CuM15  .6066  .3832 -.3408  .08 .023
NiM16  .3093 -.1135 -.6787  .47 .002
CoM16  .3093 -.1135 -.6787  .45 .002
CuM16  .3093 -.1135 -.6787  .08 .002
As1    .3558 -.3240 -.8027      .009
As2    .4430 -.3235  .1375      .007
As3    .3451 -.8251  .4677      .009
As4    .0458 -.3249  .1331      .012
As5    .0544  .2082  .1994      .020
As6    .2452 -.2922  .1348      .019
As7    .3433  .2072 -.1957      .019
As8    .2540 -.8237  .2012      .018
As9    .2427 -.3211  .4715      .010
As10   .1573 -.3155 -.1386      .019
As11  -.0429  .6813  .1946      .016
As12   .3573 -.2948 -.1383      .019
As13   .4560  .2063 -.4692      .016
As14   .3546 -.2966  .5321      .024
As15   .4450 -.3124 -.5323      .023
O1     .4456 -.1440 -.5960      .020
O2    -.0791  .7030  .0920      .020
O3    -.0505  .5310  .2600      .020
O4     .4217  .2040 -.5780      .020
O5     .3214 -.2920  .4240      .020
O6     .4776 -.3050 -.4240      .020
O7     .0222  .2090  .0900      .020
O8     .2222 -.8110  .0920      .020
O9     .2521 -.4710  .4060      .020
O10    .3785  .2000 -.0910      .020
O11    .2562 -.6470  .2600      .020
O12    .3785 -.8140  .5750      .020
O13    .4496  .3610 -.4010      .020
O14    .1207 -.2950 -.2400      .020
O15    .3213 -.3080 -.9090      .020
O16    .2792 -.3010  .5740      .020
O17    .3492  .3610 -.2630      .020
O18    .3529 -.4680  .5890      .020
O19    .0789 -.3120  .2410      .020
O20    .3538 -.1440 -.0700      .020
O21    .0409 -.1500  .0740      .020
O22    .3386 -.6510  .4080      .020
O23    .3645 -.1530 -.7420      .020
O24    .2492 -.1350  .0680      .020
O25    .0556  .0380  .2560      .020
O26    .3453 -.4770 -.7370      .020
O27    .4338 -.1530  .0760      .020
O28    .2424 -.4590  .0770      .020
O29    .0558  .3550  .2640      .020
O30    .3353  .0580 -.2490      .020
O31    .3561 -.9820  .3990      .020
O32    .4550  .0330 -.4080      .020
O33    .4522 -.4720  .0700      .020
O34    .1508 -.4680 -.0740      .020
O35    .2361 -.1550  .4060      .020
O36    .4785 -.3080  .2420      .020
O37       .5  .2320     .5      .020
O38    .3214 -.3050 -.2420      .020
O39    .1949 -.2150  .1314      .020
O40    .2775 -.2920  .2450      .020
O41    .3972 -.3970  .1560      .020
O42    .3009 -.8940  .4970      .020
O43    .1059  .2120  .1990      .020
O44    .0000 -.3950  .1470      .020
O45    .0548 -.4840  .0670      .020
O46    .2450 -.9870  .2720      .020
O47    .3524 -.1300  .6030      .020
O48    .1658 -.1570 -.0850      .020
O49    .3982 -.3870  .4700      .020
O50   -.0322  .8370  .2510      .020
O51    .3013 -.8710  .1890      .020
O52    .4519 -.4870 -.6030      .020
O53    .3596 -.4580 -.0760      .020
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Kingstonite
 
Stanley C J, Criddle A J, Spratt J, Roberts A C, Szymanski J T, Welch M D
Download mm/vol69/MM69_447.pdf
Mineralogical Magazine 69 (2005) 447-453
Kingstonite, (Rh,Ir,Pt)3S4, a new mineral species from Yubdo, Ethiopia
Locality: Bir Bir River, Yubdo District, Wallaga Province, Ethiopia
_database_code_amcsd 0014575
10.4616 10.7527 6.2648 90 109.000 90 C2/m
atom      x      y      z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Rh1  .36578 .14279 .95211 .75  .0055  .0064  .0066 -.0004  .0024 -.0005
Ir1  .36578 .14279 .95211 .25  .0055  .0064  .0066 -.0004  .0024 -.0005
Rh2  .64989      0 .44360 .90  .0049  .0061  .0070      0  .0021      0
Ir2  .64989      0 .44360 .10  .0049  .0061  .0070      0  .0021      0
Rh3       0      0      0 .64  .0039  .0057  .0042      0  .0015      0
Ir3       0      0      0 .36  .0039  .0057  .0042      0  .0015      0
Rh4       0 .16031     .5 .69  .0048  .0047  .0050      0  .0013      0
Ir4       0 .16031     .5 .31  .0048  .0047  .0050      0  .0013      0
S1   .41625      0 .23612      .0055  .0084  .0051      0 -.0006      0
S2   .87342 .15705 .11257      .0048  .0062  .0075  .0018  .0019  .0006
S3   .11639      0 .39114      .0119  .0085  .0056      0  .0046      0
S4   .14923 .28955 .40093      .0071  .0078  .0056 -.0033  .0023  .0002
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Hanawaltite
Download hom/hanawaltite.pdf
Roberts A C, Grice J D, Gault R A, Criddle A J, Erd R C
 
Powder Diffraction 11 (1996) 45-50
Hanawaltite, Hg1+6Hg2+[Cl,(OH)]2O3 - A new mineral from
the Clear Creek claim, San Benito County, California:
Description and crystal structure
Locality: Clear Creek claim, San Benito County, California
_database_code_amcsd 0015316
11.777 13.891 6.460 90 90 90 Pbma
atom      x     y     z Uiso
Hgl   .1167 .5831 .4712 .012
Hg2   .2911 .6295 .6759 .019
Hg3   .0378   .75  .134 .016
Hg4   .2448   .25  .151 .022
Hg5       0    .5     0 .010
Cl1     .25    .5  .084 .014
Cl2  .44095   .75  .329 .036
O1     .344   .75  -.10  .02
O2    -.020  .545   .28  .02
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Total number of retrieved datasets: 26
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