American Mineralogist Crystal Structure Database

25 matching records for this search.

Fianelite
Download hom/fianelite.pdf
Brugger J, Berlepsch P
Download am/vol81/AM81_1270.pdf
American Mineralogist 81 (1996) 1270-1276
Description and crystal structure of fianelite, Mn2V(V,As)O7.2H2O, a new mineral
from Fianel, Val Ferrera, Graubunden, Switzerland
_database_code_amcsd 0001837
7.809 14.554 6.705 90 93.27 90 P2_1/n
atom      x     y     z  occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mn1   .3987 .3846 .2378        .013  .0109   .012  .0013   .000  .0005
Mn2   .6200 .2475 .9615        .010  .0152   .016   .002  -.001  -.001
V1    .3285 .4211 .7458        .010  .0099   .007 -.0003  .0007  .0007
V2    .0403 .3176 .9497  .62   .012  .0135  .0104 -.0006  .0001 -.0008
As2   .0403 .3176 .9497  .38   .012  .0135  .0104 -.0006  .0001 -.0008
O1    .1650 .2928  .158        .023   .019   .012  -.004  -.012   .002
O2    .0580 .2360  .775        .019   .010   .012   .005   .003  -.002
O3    .1150 .4204  .848        .003   .024   .025  -.007   .005  -.005
O4    .3870 .5286  .706        .025   .007   .026  -.002  -.008   .000
O5   -.1640 .3394  .001        .025   .011   .024   .006   .000   .001
O6    .4580 .3674  .924        .025   .021   .011   .002   .011  -.005
O7    .3140 .3597  .529        .027   .019   .040   .014  -.014  -.008
Wat1   .231 .5068  .236        .027   .019   .040   .014  -.014  -.008
Wat2   .400 .1507  .945        .016   .049   .040  -.013  -.014   .006
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Cabalzarite
 
Brugger J, Meisser N, Schenk K, Berlepsch P, Bonin M, Armbruster T, Nyfeler D, Schmidt S
Download am/vol85/AM85_1307.pdf
American Mineralogist 85 (2000) 1307-1314
Description and crystal structure of cabalzarite Ca(Mg,Al,Fe)2(AsO4)2(H2O,OH)2,
a new mineral of the tsumcorite group
Locality: Falotta, Graubunden, Switzerland
Sample: CABA11.5, Lausanne
_database_code_amcsd 0002514
8.925 6.143 7.352 90 115.25 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)
CaM1      0     0      0       .0090  .0106  .0088  .0100      0  .0067      0
MgM2    .25   .25     .5 .392  .0040  .0033  .0041  .0038  .0006  .0007 -.0005
AlM2    .25   .25     .5 .408  .0040  .0033  .0041  .0038  .0006  .0007 -.0005
FeM2    .25   .25     .5 .177  .0040  .0033  .0041  .0038  .0006  .0007 -.0005
MnM2    .25   .25     .5 .023  .0040  .0033  .0041  .0038  .0006  .0007 -.0005
As   .91597    .5 .20844      .00491  .0036  .0067  .0049      0 .00225      0
Ow1   .3401    .5  .4089       .0102  .0067  .0182  .0060      0  .0031      0
O2    .3168     0  .3648       .0098  .0078  .0133  .0113      0  .0071      0
O3    .0371 .2771  .2519       .0084  .0078  .0075  .0103  .0011  .0039  .0004
O4    .2402    .5  .0187       .0140  .0086   .024  .0065      0  .0001      0
H11   .4278    .5  .4785   .5   .015
H14   .3321    .5  .3058        .052
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Cabalzarite
 
Brugger J, Meisser N, Schenk K, Berlepsch P, Bonin M, Armbruster T, Nyfeler D, Schmidt S
Download am/vol85/AM85_1307.pdf
American Mineralogist 85 (2000) 1307-1314
Description and crystal structure of cabalzarite Ca(Mg,Al,Fe)2(AsO4)2(H2O,OH)2,
a new mineral of the tsumcorite group
Locality: Falotta, Graubunden, Switzerland
Sample: CABA20, Bern
_database_code_amcsd 0002515
8.9284 6.1314 7.3439 90 115.494 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)
CaM1      0     0      0      .0154  .0183  .0143  .0160      0  .0096      0
MgM2    .25   .25     .5 .410 .0100  .0100  .0106  .0116  .0004  .0039  .0000
AlM2    .25   .25     .5 .420 .0100  .0100  .0106  .0116  .0004  .0039  .0000
FeM2    .25   .25     .5 .040 .0100  .0100  .0106  .0116  .0004  .0039  .0000
MnM2    .25   .25     .5 .130 .0100  .0100  .0106  .0116  .0004  .0039  .0000
As   .91648    .5 .20931      .0092  .0081  .0109  .0086      0  .0038      0
O1    .3396    .5  .4103      .0166   .011   .025   .013      0  .0051      0
O2    .3169     0  .3636      .0174   .017   .022   .017      0   .011      0
O3    .0376 .2764  .2528      .0015   .015   .013   .017   .001  .0068 -.0004
O4    .2385    .5  .0186      .0213   .018   .029   .013      0   .002      0
H11    .450    .5    .43   .5   .07
H14    .294    .5   .270        .03
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Turtmannite
 
Brugger J, Armbruster T, Meisser N, Hejny C, Grobety B
Download am/vol86/AM86_1494.pdf
American Mineralogist 86 (2001) 1494-1505
Description and crystal structure of turtmannite, a new mineral with a
68 Angstrom period related to mcgovernite
Note: z-coordinate of Mn12 has been modified
_database_code_amcsd 0002747
8.259 8.259 204.3 90 90 120 R-3c
atom      x      y      z  occ  Uiso
Mg1   .1412  .4234 .00010  .74  .014
Mn1   .1412  .4234 .00010  .26  .014
Mn2       0      0 .01010       .022
Mg3    .471   .100 .01450  .48  .006
V4      1/3    2/3 .01440  .89  .015
As4     1/3    2/3 .01440  .11  .015
Mn5   .2071  .2585 .02374      .0191
As6     2/3    1/3 .02396  .26  .015
Mn6    .897   .379 .02351 .152   .01
Mg7     1/3    2/3 .03491  .78  .014
Mn7     1/3    2/3 .03491  .22  .014
Mn8   .9039  .3545 .03505 .848 .0173
As9       0      0 .03833  .51  .013
V9        0      0 .03833  .49  .013
Mn10  .1189  .4158 .04864      .0158
Si11    2/3    1/3 .04935  .76  .016
As11    2/3    1/3 .04935  .24  .016
Mn12      0      0 .05965       .035
Mn13  .4217  .3136 .06009      .0153
Si14    1/3    2/3 .06192       .012
Mn15  .1072  .4013 .07179      .0147
Si16    2/3    1/3 .07321       .011
Mn17 -.0746 -.4079   1/12      .0161
V18       0      0 .08057       .012
O1     .481   .096 .00498       .022
O2      1/3    2/3 .00573       .021
O3     .052   .799 .00564       .028
O4     .221   .045 .01779       .023
O5     .385   .494 .01705       .030
O6      2/3    1/3  .0171  .60  .030
O7    .6987   .149 .02909       .023
O8     .561   .709 .02922       .018
O9        0      0 .02997       .011
O10    .959   .170 .04116       .016
O11    .112   .607 .04151       .022
O12     2/3    1/3 .04129       .013
O13    .637   .498 .05276       .015
O14    .184   .233 .05346       .015
O15     1/3    2/3 .05379       .019
O16     2/3    1/3 .06513       .010
O17    .369   .505 .06507       .010
O18   -.162  -.236 .06573       .013
O19    .159   .210 .07771       .016
O20    .872   .392 .07631       .013
O21       0      0 .08860       .015
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Marecottite
Download hom/marecottite.pdf
Brugger J, Burns P C, Meisser N
Download am/vol88/AM88_676.pdf
American Mineralogist 88 (2003) 676-685
Contribution to the mineralogy of acid drainage of uranium minerals:
Marecottite and the zippeite-group
Locality: La Creusaz uranium prospect near Les Marecottes, Western Swiss Alps, Switzerland
_database_code_amcsd 0003077
10.815 11.249 13.851 66.224 72.412 69.955 P-1
atom       x     y      z occ Uiso
U1     .5444 .8932  .1285     .015
U2    -.0290 .6004  .3627     .014
U3     .2059 .8722  .1226     .014
U4     .3110 .5786  .3648     .014
S1     .1232 .1251 -.1263     .015
S2     .3706 .3844  .6341     .016
Mg1        0   1/2      0 .62 .022
Mn1        0   1/2      0 .38 .022
Mg2      1/2     0    1/2 .72 .016
Mn2      1/2     0    1/2 .28 .016
Mg3        0     0    1/2 .82 .020
Mn3        0     0    1/2 .18 .020
O1     .2810 .7020  .4170     .034
O2     .6090 .0487 -.0225     .016
O3     .4410 .4593  .6514     .012
O4     .4480 .0060  .1933     .019
O5     .1150 .0918 -.0130     .018
O6     .1190 .5239  .4750     .017
O7     .2710 .0716 -.1720     .010
O8     .0510 .4630  .3182     .025
O9     .0410 .0603 -.1485     .017
O10    .4240 .2424  .6860     .013
O11    .0770 .2741 -.1712     .010
O12    .2270 .4300  .6718     .017
O13    .1730 .9697  .2030     .012
O14   -.1210 .7460  .3980     .028
O15    .3590 .4482  .3091     .020
O16    .3960 .4032  .5178     .020
O17    .1420 .7033  .2643     .017
OH18   .4050 .7255  .1927     .021
O19    .2280 .7850  .0330     .026
O20    .6470 .7720  .0700     .029
Wat21  .4070 .8790  .4730     .032
Wat22  .1820 .0140  .3878     .029
Wat23  .9170 .9890  .3890     .041
Wat24  .9360 .2110  .4390     .029
Wat25  .1060 .3010  .0750     .035
Wat26  .6060 .0430  .3380     .039
Wat27 -.1540 .4920  .1388     .029
Wat28  .1130 .5700  .0560     .040
Wat29  .3400 .1730  .4500     .033
Wat30  .2480 .2700  .2230     .062
Wat31  .8820 .1800  .1900     .060
Wat32  .3330 .7170  .6720     .076
Wat33  .5020 .2950  .1070     .094
Wat34  .5870 .5260  .0890     .076
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Spriggite
 
Brugger J, Krivovichev S V, Berlepsch P, Meisser N, Ansermet S, Armbruster T
Download am/vol89/AM89_339.pdf
American Mineralogist 89 (2004) 339-347
Spriggite, Pb3[(UO2)6O8(OH)2](H2O)3, a new mineral with beta-U3O8 - type sheets:
Description and crystal structure
_database_code_amcsd 0003406
28.355 11.990 13.998 90 104.248 90 C2/c
atom      x       y       z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U1   .12526  .50029  .06516     .0140  .0169  .0101  .0138  .0001  .0018 -.0012
U2   .12394 -.00013 -.18999     .0145  .0181  .0101  .0152  .0005  .0041  .0009
U3   .12656  .30570 -.18581     .0156  .0227   .013  .0100  .0024  .0025  .0000
U4   .12454 -.30597 -.18644     .0156  .0230   .012  .0130 -.0017  .0070  .0005
U5   .12421  .19495  .06122     .0141  .0185  .0123  .0120 -.0005  .0044  .0025
U6   .12516  .80571  .06188     .0144  .0201  .0122  .0109  .0014  .0038 -.0002
Pb1  .24991  .36349 -.29355 .95 .0181  .0291  .0123  .0134  .0055  .0058  .0057
Pb2  .00727  -.3563  -.4060 .64 .0347   .009   .047   .042   .019 -.0064 -.0018
Pb3  .00801   .1418  -.3314 .50 .0316   .015   .045   .036  -.002  .0088  -.007
Pb4  .25059   .3412   .0248 .50 .0253   .027   .019   .034  .0048  .0156  .0056
Pb5   .0081  -.1586  -.3468 .22  .040   .019   .061   .045   .004   .016   .015
Pb6   .0094  -.3548  -.5894 .14  .057   .026   .083   .068  -.012   .023  -.029
Pb7   .2500   .6392  -.3004 .05  .010
O1    .1318  -.1379  -.0963      .032
O2    .1127   .3616   .1436      .039
O3    .0595   .1953   .0130      .032
O4    .1912   .8139   .1059      .032
O5    .0605   .7941   .0145      .032
O6    .0588  -.3071  -.2001      .039
O7    .0628   .3058  -.2080      .039
O8    .1933   .4890   .1207      .039
O9    .1919   .0017  -.1800      .039
O10   .1336   .6486  -.0311      .032
O11   .1921  -.2963  -.1673      .039
O12   .1327   .1361  -.0964      .032
O13   .1277   .3642  -.3452      .032
O14   .1366   .3456  -.0271      .032
O15   .1152   .1543  -.2876      .032
OH16  .1129   .5024  -.2011      .032
OH17  .1108   .0004   .0520      .032
O18   .1150   .1628   .2074      .032
O19   .0612  -.0042  -.2186      .039
O20   .1920   .2979  -.1602      .032
O21   .1913   .1989   .1059      .039
O22   .0594   .5057   .0109      .039
Wat1  .2494   .5136  -.2043 .50  .100
Wat2      0       0     -.5      .100
Wat3  .2379   .3581  -.4772      .100
Wat4  .2467   .5053  -.1564 .50  .100
Wat5      0  -.4937    -.75      .100
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Scheuchzerite
 
Brugger J, Krivovichev S, Meisser N, Ansermet S, Armbruster T
Download am/vol91/AM91_937.pdf
American Mineralogist 91 (2006) 937-943
Scheuchzerite, Na(Mn,Mg)9[VSi9O28(OH)](OH)3, a new single-chain silicate
Sample: Fianel, Val Ferrera, Central Alps, Switzerland
_database_code_amcsd 0004162
9.831 10.107 13.855 86.222 73.383 71.987 P-1
atom      x     y     z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na     .131 .4358 .2935 .80  .026
Mn1   .0757 .8310 .0136     .0085  .0069  .0062  .0068  .0041  .0003 -.0010
Mn2   .5671 .6937 .1599     .0114  .0094  .0117  .0097  .0018 -.0017 -.0052
Mn3   .1538 .0823 .5619     .0146  .0151  .0133  .0107  .0019 -.0021 -.0037
Mn4   .7129 .3634 .1903 .93 .0096  .0104  .0072  .0079  .0012 -.0014 -.0017
Mg4   .7129 .3634 .1903 .07 .0096  .0104  .0072  .0079  .0012 -.0014 -.0017
Mn5   .7499 .4835 .9689     .0107  .0104  .0099  .0060  .0037 -.0007  .0005
Mn6   .3262 .7645 .5880     .0085  .0084  .0105  .0042  .0000 -.0009 -.0009
Mn7   .4794 .4353 .6140 .84 .0127   .012   .011   .012 -.0022 -.0003 -.0016
Mg7   .4794 .4353 .6140 .16 .0127   .012   .011   .012 -.0022 -.0003 -.0016
Mn8   .6306 .1039 .6374 .80 .0111  .0110  .0117  .0061  .0021 -.0010 -.0017
Mg8   .6306 .1039 .6374 .20 .0111  .0110  .0117  .0061  .0021 -.0010 -.0017
Mn9   .1425 .9711 .7869     .0126  .0141  .0124  .0048  .0019  .0017 -.0036
Mg     .109  .557  .649 .20  .050
V1    .8167 .2386 .7693 .89  .010
V1A    .951  .297  .770 .11  .010
Si1   .4550 .7412 .9501     .0058
Si2   .2825 .0474 .9656     .0097
Si3   .0371 .1425 .3656     .0058
Si4  -.5200 .1836 .2658     .0102
Si5   .6926 .6304 .5435     .0080
Si6   .9340 .5555 .1366     .0113
Si7   .0804 .2371 .1490     .0092
Si8   .7539 .7385 .3257     .0130
Si9   .8450 .3251 .5500     .0097
O1    .3109 .6926 .9527      .007
OH2   .4944 .4802 .7588      .010
O3    .5457 .6038 .5341      .010
O4   -.0682 .2056 .1429      .007
O5   -.0988 .0925 .3562      .011
O6    .1432 .0098 .9403      .011
O7    .6968 .2872 .5556      .012
OH8   .2692 .5927 .6638      .010
O9    .9164 .1186 .8378      .016
O10  -.3615 .1939 .2723      .015
O11   .7892 .5351 .1161      .010
OH12  .3811 .9364 .5120      .010
O13   .1507 .0328 .4170      .010
O14   .5975 .7299 .3174      .011
O15   .6667 .1889 .7688      .016
O16   .5537 .6440 .0175      .013
O17   .7899 .8761 .3067      .009
O18   .9266 .2407 .6354      .013
O19   .7603 .4006 .8198      .019
O20   .0202 .6468 .0628      .013
O21   .8117 .4896 .5668      .013
O22   .0649 .4020 .1387      .012
O23   .7716 .7015 .4420      .018
O24   .1109 .1989 .2573      .016
O25   .3949 .9012 .9902      .019
O26   .3661 .1245 .8720  .5  .011
OH26  .3661 .1245 .8720  .5  .011
O27   .2245 .1509 .0643      .016
O28   .8894 .6113 .2559      .019
O29  -.5246 .0258 .2672  .5  .020
OH29 -.5246 .0258 .2672  .5  .020
O30  -.0300 .2863 .4368      .017
O31   .6573 .7324 .6382      .017
O32   .5579 .7320 .8333      .009
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Bouazzerite
 
Brugger J, Meisser N, Krivovichev S, Armbruster T, Favreau G
Download am/vol92/AM92_1630.pdf
American Mineralogist 92 (2007) 1630-1639
Mineralogy and crystal structure of bouazzerite from Bou Azzer, Anti-Atlas, Morocco:
Bi-As-Fe nanoclusters containing Fe3+ in trigonal prismatic coordination
Locality: Bou Azzer, Anti-Atlas, Morocco
_database_code_amcsd 0018980
13.6322 30.469 18.4671 90 91.134 90 P2_1/n
atom       x       y      z occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Bi1   .33234 .439265 .05963     .01694  .0176  .0157  .0176  .0002  .0009  .0013
Bi2   .38659 .271567 .19862     .01812  .0204  .0149  .0191  .0006  .0010 -.0009
Bi3   .35259 .423520 .37927     .01714  .0179  .0178  .0158  .0000  .0010 -.0004
Mg1       .5      .5     .5 .76   .022   .020   .027   .018  -.002  -.001  -.002
Co1       .5      .5     .5 .24   .022   .020   .027   .018  -.002  -.001  -.002
Fe1   .19098  .33957 .30552      .0196  .0202  .0187  .0200 -.0001   .002  .0006
Fe2   .55546  .35884 .29353      .0183  .0183  .0199  .0166  .0010  .0008 -.0007
Fe3   .15471  .42957 .21954      .0187  .0192  .0182  .0188  .0006  .0024 -.0006
Fe4   .54076  .35731 .12029      .0187  .0191  .0189  .0182  .0020  .0017  .0013
Fe5   .35571  .37933 .21313      .0153  .0179  .0139  .0141  .0017  .0002  .0014
Fe6   .51905  .44607 .20669      .0198  .0177  .0219  .0197  .0011  .0014 -.0006
Fe7   .17860  .34025 .13515      .0198  .0193  .0183  .0218  .0000   .002 -.0002
As1   .61733  .45153 .36421      .0172  .0141  .0202  .0173  .0001  .0001 -.0036
As2   .32019  .50594 .25068      .0177  .0188  .0158  .0187 -.0005  .0015 -.0002
As3   .39425  .29800 .38449      .0173  .0194  .0168  .0158  .0027  .0000  .0023
As4   .35232  .32830 .01404      .0183  .0213  .0175  .0161  .0027 -.0003 -.0012
As5   .09272  .42095 .38783      .0168  .0144  .0189  .0171  .0017  .0016 -.0020
As6   .12300  .25221 .21955      .0184  .0209  .0145  .0199 -.0016  .0021  .0018
As7   .58885  .44700 .04135      .0172  .0165  .0188  .0165 -.0013  .0013 -.0001
As8   .64960  .27860 .20621      .0205  .0194  .0221  .0199  .0060  .0007  .0010
As9   .06318  .42076 .05797      .0173  .0164  .0178  .0176  .0014 -.0001  .0009
Mg2    .1429  .45627 -.1023      .0119   .016   .011   .009  .0024   .002  .0012
Mg3    .3684  .60454  .1802      .0215   .024   .017   .025  -.003   .009  -.001
Mg4   -.1410  .45746  .4274      .0180   .019   .015   .020   .003   .000  -.007
Mg5    .3529  .21064  .4977      .0224   .027   .020   .020   .000   .001   .005
Mg6    .3875  .23984 -.0901      .0212   .020   .023   .021   .001   .000  -.002
O1     .4783   .4497 -.0015       .019
OH2    .1044   .3655  .2227       .014
O3     .6527   .3118  .2806       .022
O4     .1250   .2827  .2975       .024
O5     .4385   .4054  .1342       .011
O6     .2755   .3241  .2206       .014
O7     .2560   .4007  .2890       .013
O8     .4512   .4076  .2826       .014
O9     .1032   .3652  .3775       .020
Wat10  .4777   .5628  .1400       .025
O11    .0602   .4449  .1418       .020
O12    .0876   .3659  .0648       .022
O13    .4661   .3331  .2109       .016
O14    .4045   .2715  .4614       .020
O15    .0294   .2170  .2220       .026
O16    .2111   .4876  .2163       .021
O17    .5982   .4741  .2807       .019
OH18   .6067   .3917  .2046       .014
O19    .6770   .4706 -.0058       .017
O20    .5169   .4587  .4137       .020
O21   -.0482   .4262  .0181       .018
O22   -.0018   .4317  .4429       .022
O23    .3384   .4883  .3369       .021
O24    .5867   .4720  .1235       .015
O25    .2465   .3997  .1458       .018
O26    .3199   .3811 -.0049       .021
O27    .7147   .4750  .4033       .019
O28    .1967   .4413  .4252       .018
O29    .1023   .2859  .1477       .025
O30    .6178   .3920  .0510       .021
O31    .6379   .3103  .1311       .021
O32    .2901   .3281  .3822       .023
O33    .4650   .3243  .0504       .028
O34    .0698   .4430  .3039       .019
O35    .4876   .3343  .3752       .024
O36    .2727   .3094  .0754       .025
O37    .2315   .2254  .2110       .023
O38    .3258   .5597  .2553       .026
O39    .6383   .3963  .3561       .018
O40    .3912   .2613  .3141       .020
Wat41  .2649   .6473  .2237       .027
Wat42  .4774   .6339  .2394       .031
Wat43  .1706   .5226 -.0833       .023
Wat44  .2973   .4515 -.1091       .032
Wat45  .3853   .2589 -.1963       .026
Wat46  .4260   .5459  .4350       .039
O47    .7550   .2506  .2001       .030
O48    .4075   .4869  .1955       .022
Wat49  .2109   .2349  .5216       .034
Wat50 -.1601   .4707  .5362       .027
Wat51 -.1913   .3913  .4357       .033
O52    .3438   .3007 -.0626       .022
Wat53  .3954   .2249  .6036       .036
O54    .5528   .2445  .2139       .029
Wat55 -.0882   .5232  .4247       .029
Wat56  .2431   .2182 -.0983       .036
Wat57 -.0102   .4652 -.1074       .032
Wat58  .4272   .1750 -.1263       .030
Wat59  .6318   .5347  .4841       .028
Wat60  .5391   .2558 -.0870       .028
O61    .1509   .4456  .0088       .021
Wat62 -.1199   .4568  .3128       .032
Wat63  .3986   .2165  .0168       .034
Wat64  .3988   .6489  .0916       .038
Wat65  .4886   .1848  .4749       .041
Wat66  .3128   .1456  .5293       .037
Wat67  .2574   .5805  .1094       .039
Wat68  .1341   .4598 -.2162       .048
Wat69  .3000   .1981  .3935       .047
Wat70  .1369   .3884 -.1066       .053
Wat71 -.0910   .3445  .2200       .038
Wat72  .7911   .4167  .1951       .036
Wat73  .6594   .6333  .1730       .038
Wat74 -.2016   .4103  .6398       .051
Wat75  .2544   .1745  .0891       .046
Wat76  .0392   .5398  .3011       .059
Wat77  .5131   .1416  .0439       .055
Wat78  .1989   .3255  .5219       .050
Wat79  .6083   .2018  .3542       .064
Wat80  .4075   .6305  .4859       .065
Wat81  .1155   .2354  .0102       .059
Wat82  .5475   .6775  .4092       .103
Wat83  .7577   .6598  .2972       .126
Wat84  .0722   .6223  .1897       .108
Wat85  .5205   .1556  .1892       .156
Wat86  .6604   .6117  .4151       .193
Wat87  .3013   .4441 -.2934       .194
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Birchite
 
Elliot P, Brugger J, Pring A, Cole M L, Willis A C, Kolitsch U
Download am/vol93/AM93_910.pdf
American Mineralogist 93 (2008) 910-917
Birchite, a new mineral from Broken Hill, New South Wales, Australia:
Description and structure refinement
Locality: Block 14 Opencut, Broken Hill, New South Wales, Australia
_database_code_amcsd 0004585
10.4768 20.8938 6.1640 90 90 90 Pnma
atom      x      y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Cd   .90709 .60270 .54392 .0237  .0252  .0243  .0216 -.0024  .0028 -.0007
Cu   .10856 .56327 .12074 .0192  .0231  .0232  .0113 -.0005 -.0001  .0042
P     .1735 .54334  .6333 .0163  .0201  .0177  .0111 -.0012  .0002  .0014
S     .9468    .75  .7596 .0239   .027  .0210   .024      0  .0003      0
O1    .9880    .75  .9852  .034   .029   .044   .028      0  -.017      0
O2    .8066    .75  .7490  .024   .029   .026   .017      0  -.004      0
O3    .9999  .6926  .6491  .038   .031   .033   .052  -.015   .010   .002
O4    .2888  .5865  .6574 .0202   .022   .019   .020  -.008   .001  -.004
O5    .0764  .5489  .8175 .0196   .016   .032   .010  -.008   .002   .004
O6    .2181  .4729  .6099 .0191   .022   .018   .017  -.003   .000   .008
O7    .0925  .5617  .4298 .0192   .022   .027   .009   .003  -.004   .004
Wat1  .9503  .6211  .1418 .0218   .031   .019   .015  -.003  -.004   .004
Wat2  .2212  .6593  .0593 .0211   .017   .020   .026   .007  -.001   .001
Wat3  .6947    .75  .1385  .030   .028   .040   .023      0   .001      0
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Argandite
 
Brugger J, Elliott P, Meisser N, Ansermet S
 
American Mineralogist 96 (2011) 1894-1900
Argandite, Mn7(VO4)2(OH)8, the V analogue of allactite from the metamorphosed
Mn ores at Pipji, Turtmann Valley, Switzerland
Locality: Pipji, Turtmann Valley, Switzerland
_database_code_amcsd 0018517
5.5038 12.2665 10.1055 90 95.559 90 P2_1/n
atom      x      y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mn1       0     .5     .5     .0105  .0117  .0098  .0098 -.0010  .0003 -.0016
Mn2  .23235 .17921 .79338     .0120  .0112  .0119  .0124  .0019 -.0019 -.0008
Mn3  .74927 .56820 .99173 .92 .0095  .0072  .0094  .0116 -.0002 -.0003  .0001
Mn4  .24910 .20769 .50088 .94 .0103  .0100  .0104  .0105 -.0012  .0006  .0000
V    .53430 .42008 .70834 .73 .0079  .0074  .0082  .0078  .0004 -.0002 -.0001
As   .53430 .42008 .70834 .27 .0079  .0074  .0082  .0078  .0004 -.0002 -.0001
O2    .5617 .42947  .8817     .0126  .0104  .0143  .0126  .0004 -.0014 -.0002
Oh1   .0535  .3060  .8875     .0138  .0139  .0149  .0126  .0008  .0008 -.0005
Oh3   .0784  .3449  .4060     .0156  .0128  .0156  .0183 -.0007  .0009  .0005
O4    .4159  .2965  .6677     .0177  .0232  .0135  .0156 -.0016 -.0021 -.0046
Oh5   .0749  .5612  .8870     .0152  .0123  .0138  .0192 -.0011  .0008  .0004
Oh6   .5433  .6824  .8724     .0151  .0139  .0157  .0158  .0028  .0018 -.0017
O7    .3496  .5203  .6375     .0154  .0162  .0127  .0165  .0026 -.0025  .0029
O8    .8205  .4273  .6616     .0182  .0135  .0270  .0142  .0048  .0016  .0017
H1     .013   .347   .807      .053
H3     .193   .361   .342      .053
H5     .056   .527   .801      .053
H6     .640   .746   .864      .053
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Leucostaurite
 
Brugger J, Meisser N, Ansermat S, Krivovichev S V, Kahlenberg V, Belton D, Ryan C G
 
American Mineralogist 97 (2012) 1206-1212
Leucostaurite, Pb2[B5O9]Cl*0.5H2O, from the Atacama Desert: The first Pb-dominant
member of the hilgardite group, and micro-determination of boron minerals by PIGE
Locality: Mina Asuncion, Atacama Desert, Chile
_database_code_amcsd 0019064
11.376 11.505 6.5568 90 90 90 Pnn2
atom     x      y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb1  .0379 .76058 .3457 .0189  .0206  .0240  .0121  .0004 -.0003  .0002
Pb2  .7276 .97810 .5167 .0257  .0334  .0262  .0174  .0034  .0014  .0029
Cl1     .5      0  .780  .036   .023   .035   .050   .004      0      0
Cl2      0      0  .474  .032   .030   .021   .045  -.006      0      0
B1    .820   .735  .641  .013
B2    .741   .531  .517  .010
B3    .988   .753  .869  .010
B4    .712   .321  .503  .012
B5    .710   .713  .315  .015
O1    .944   .728  .691  .022
O2    .761   .625  .690  .022
O3    .811   .766  .432  .010
O4    .714   .583  .343  .023
O5    .919   .793  .019  .020
O6    .764   .822  .777  .014
O7    .776   .229  .597  .015
O8    .608   .760  .419  .017
O9    .740   .434  .597  .022
Wat10   .0     .5  .818   .07
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Pseudojohannite
 
Plasil J, Fejfarova K, Wallwork K S, Dusek M, Skoda R, Sejkora J, Cejka J,
Veselovsky F, Hlousek J, Meisser N, Brugger J
 
American Mineralogist 97 (2012) 1796-1803
Crystal structure of pseudojohannite, with a revised formula,
Cu3(OH)2[(UO2)4O4(SO4)2](H2O)12
Locality: White Canyon, Utah, USA
_database_code_amcsd 0019492
8.6744 8.8692 10.0090 72.105 70.544 76.035 P-1
atom       x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U1    .42802 .34306 .46462      .0077  .0064  .0066  .0105 -.0020 -.0028 -.0013
U2    .09013 .67616 .47194      .0083  .0062  .0064  .0125 -.0023 -.0030 -.0011
Cu1       .5      0      0 .983 .0145   .018   .014   .012  .0011 -.0063 -.0052
Cu2   -.0072  .1684 -.0069 .977 .0167  .0143  .0165  .0161 -.0044  .0003 -.0027
S      .7502  .0037  .4954      .0103   .008   .009   .016  -.005  -.004 -.0019
Wat1   .5709  .0786  .1290       .017   .026   .017   .014  -.005  -.010  -.003
O2     .3516  .5917  .4981       .012
OH3   -.1183 -.0130  .1189       .018   .010   .025   .018  -.009  -.001  -.002
Wat4   .2056  .1178  .1158       .024   .023   .025   .022  -.005  -.007  -.003
O5     .1505  .4083  .5051       .010
O6     .4796  .4253  .2692       .016   .021   .013   .011   .002  -.004  -.006
Wat7    .311   .420   .062       .040   .042   .034   .046  -.007  -.022   .000
O8     .3804  .2360  .6585       .014   .015   .014   .011  -.001  -.004  -.004
Wat9   .4754 -.2140  .1374       .019   .021   .016   .018   .002  -.004  -.011
Wat10  -.160   .321  .1013       .031   .033   .028   .024  -.012   .005  -.004
O11    .1621  .7036  .2755       .016   .017   .015   .016  -.005  -.004   .000
O12    .6657  .1326  .3982       .016
Wat13  .1013  .3492 -.1471       .024   .023   .020   .025  -.004  -.001  -.005
O14    .0156  .6725  .6640       .019   .013   .025   .017  -.005  -.002   .000
O15    .7932  .0726  .5931       .015
O16    .6428 -.1150  .5913       .013
O17    .8984 -.0764  .4047       .014
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Gratianite
 
Ciobanu C L, Brugger J, Cook N J, Mills S J, Elliott P, Damian G, Damian F
 
American Mineralogist 99 (2014) 1163-1170
Gratianite, MnBi2S4, a new mineral from the Baita Bihor skarn, Romania
Locality:  Baita Bihor skarn deposit, Bihor County, Romania
_database_code_amcsd 0020334
12.677 3.9140 14.758 90 115.31 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)
Bi1  .22003 0 .36822  .9875 .0251  .0283  .0236  .0247      0  .0126      0
Sb1  .22003 0 .36822 .00903 .0251  .0283  .0236  .0247      0  .0126      0
Bi2  .35329 0 .13829  .9875 .0279  .0298  .0281  .0274      0  .0140      0
Sb2  .35329 0 .13829 .00903 .0279  .0298  .0281  .0274      0  .0140      0
Fe3       0 0     .5    .65  .025   .021   .027   .031      0   .013      0
Mn3       0 0     .5   .102  .025   .021   .027   .031      0   .013      0
Pb3       0 0     .5   .142  .025   .021   .027   .031      0   .013      0
Cu3       0 0     .5   .085  .025   .021   .027   .031      0   .013      0
Cd3       0 0     .5   .018  .025   .021   .027   .031      0   .013      0
Ag3       0 0     .5   .002  .025   .021   .027   .031      0   .013      0
Mn4       0 0      0         .027   .030   .031   .024      0   .015      0
S1    .6537 0  .0422         .021   .017   .022   .024      0   .009      0
Se1   .6537 0  .0422 .00298  .021   .017   .022   .024      0   .009      0
Te1   .6537 0  .0422 .00174  .021   .017   .022   .024      0   .009      0
S2    .0132 0  .1733         .022   .020   .020   .026      0   .011      0
Se2   .0132 0  .1733 .00298  .022   .020   .020   .026      0   .011      0
Te2   .0132 0  .1733 .00174  .022   .020   .020   .026      0   .011      0
S3    .6044 0  .4492         .021   .014   .024   .020      0   .003      0
Se3   .6044 0  .4492 .00298  .021   .014   .024   .020      0   .003      0
Te3   .6044 0  .4492 .00174  .021   .014   .024   .020      0   .003      0
S4    .8310 0  .3200         .023   .020   .027   .032      0   .019      0
Se4   .8310 0  .3200 .00298  .023   .020   .027   .032      0   .019      0
Te4   .8310 0  .3200 .00174  .023   .020   .027   .032      0   .019      0
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Manganlotharmeyerite
Download hom/manganlotharmeyerite.pdf
Brugger J, Krivovichev S V, Kolitsch U, Meisser N, Andrut M, Ansermet S, Burns P C
Download cm/vol40/CM40_1597.pdf
The Canadian Mineralogist 40 (2002) 1597-1608
Description and crystal structure of manganlotharmeyerite,
Ca(Mn,_,Mg)2{AsO4,[AsO2(OH)2]}2(OH,H2O)2, from the Starlera Mn-deposit,
Swiss Alps, and a redefinition of lotharmeyerite
Locality: Starlera Mn-deposit, Swiss Alps
_database_code_amcsd 0005797
9.043 6.2314 7.3889 90 116.392 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)
Ca1        0     0      0     .0144  .0166  .0150  .0105      0  .0051      0
Mn2      .25   .25     .5 .59 .0099  .0096  .0101  .0080  .0000  .0021  .0002
Mg2      .25   .25     .5 .17 .0099  .0096  .0101  .0080  .0000  .0021  .0002
As    .91498    .5 .20524     .0102  .0089  .0112  .0089      0  .0026      0
OH1    .3385    .5  .4098 .59 .0195   .015   .022   .019      0   .006      0
Wat1   .3385    .5  .4098 .41 .0195   .015   .022   .019      0   .006      0
O2     .3170     0  .3573     .0190   .019   .019   .022      0   .012      0
O3     .0351 .2793  .2468     .0186  .0168  .0164   .020  .0008  .0061 -.0010
O4     .2420 .5000  .0237     .0222   .017   .031   .013      0   .002      0
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Ansermetite
 
Brugger J, Berlepsch P, Meisser N, Armbruster T
Download cm/vol41/CM41_1423.pdf
The Canadian Mineralogist 41 (2003) 1423-1431
Ansermetite, MnV2O6.4H2O, a new mineral species with V5+ in five-fold coordination
from Val Ferrera, Eastern Swiss Alps
Locality: Val Ferrera, Eastern Swiss Alps
_database_code_amcsd 0005917
13.171 10.128 6.983 90 111.572 90 C2/c
atom      x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mn      .25    .25      0      .0188  .0188  .0200  .0188  .0021  .0083 -.0010
V    .10541 .47440 .19330 .975 .0142  .0147  .0166  .0125  .0014  .0067 -.0012
O1    .2047  .5795  .3004      .0254   .028   .028   .022  -.009   .011  -.004
O2    .1601  .3304  .1782      .0241   .029   .024   .024   .005   .014   .002
O3    .3885  .3589  .2165      .0348   .025   .035   .042  -.004   .010  -.007
O4    .9401  .4612  .0788      .0240   .017   .040   .020   .002   .012   .003
O5    .3934  .6246  .1073      .0393   .045   .035   .042  -.004   .022  -.008
H3A    .392   .445   .228        .05
H3B    .426   .296   .234        .05
H5A    .456   .644   .127        .05
H5B    .348   .647   .167        .05
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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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Vergasovaite
Download hom/vergasovaite.pdf
Berlepsch P, Armbruster T, Brugger J, Bykova E Y, Kartashov P M
 
European Journal of Mineralogy 11 (1999) 101-110
The crystal structure of vergasovaite Cu3O[(Mo,S)O4SO4],
and its relation to synthetic Cu3O[MoO4]2
_database_code_amcsd 0006764
7.421 6.754 13.624 90 90 90 Pnma
atom      x      y      z  occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Cu1       0      0    1/2      1.62  .0129  .0161  .0195 -.0006 -.0006 -.0013
Cu2   .8367   -1/4 .34104      2.27  .0320  .0219  .0142      0 -.0023      0
Cu3   .6731   -1/4 .55569      2.29  .0212  .0199  .0276      0  .0096      0
Mo1  .74740    1/4 .31217 .742 1.53  .0130  .0157  .0172      0 -.0005      0
S1   .74740    1/4 .31217 .258 1.53  .0130  .0157  .0172      0 -.0005      0
S2    .3355   -1/4  .3980      1.97  .0176  .0208  .0206      0  .0019      0
O1    .8920   -1/4  .4794      1.48   .016   .016   .013      0   .004      0
O2    .7738   -1/4  .2033       4.4   .075   .035   .023      0   .000      0
O3    .5336   -1/4  .4075       4.0   .019   .037   .063      0   .014      0
O4    .2625 -.0727  .4470      2.63   .021   .030   .028  -.004   .002   .001
O5    .8665  .0405  .3466      2.62   .028   .026   .025   .003  -.001  -.007
O6    .7031    1/4  .1915       3.7   .036   .027   .049      0  -.006      0
O7    .5456    1/4  .3738       3.4   .029   .038   .037      0   .014      0
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Nabiasite
Download hom/nabiasite.pdf
Brugger J, Bonin M, Schenk K J, Meisser N, Berlepsch P, Ragu A
 
European Journal of Mineralogy 11 (1999) 879-890
Description and crystal structure of nabiasite, BaMn9[(V,As)O4]6(OH)2,
a new mineral from the Central Pyrenees (France)
Locality: Central Pyrenees, France
_database_code_amcsd 0006798
12.832 12.832 12.832 90 90 90 Pa3
atom      x      y      z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ba        0      0      0      .017   .017   .017   .017   .003   .003   .003
Mn1     -.5      0      0      .011  .0114  .0114  .0114     .0     .0     .0
Mn2  -.3242  .1758  .3242      .012  .0118  .0118  .0118 -.0004 -.0004  .0004
Mn3  -.3051  .0054  .1590      .014  .0164  .0135  .0129 -.0008 -.0023 -.0016
V    -.2542  .0726 -.0930 .897 .009  .0094  .0091  .0097 -.0004  .0003  .0004
As   -.2542  .0726 -.0930 .103 .009  .0094  .0091  .0097 -.0004  .0003  .0004
O1   -.3308 -.0030 -.0074      .013   .014   .014   .012   .001     .0   .002
O2   -.1561  .1678  .3272      .014   .012   .015   .014  -.001     .0   .002
O3   -.3299  .1798  .4912      .014   .014   .015   .012     .0     .0   .003
O4   -.1701  .1414 -.0207      .016   .016   .017   .015  -.001  -.001  -.002
O5   -.3456 -.1544  .1544      .014   .015   .015   .015   .003  -.003   .003
H    -.3138 -.1862  .1862      .028
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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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Maghrebite
 
Meisser N, Brugger J, Krivovichev S, Armbruster T, Favreau G
 
European Journal of Mineralogy 24 (2012) 717-726
Description and crystal structure of maghrebite, MgAl2(AsO4)2(OH)2*8H2O,
from Aghbar, Anti-Atlas, Morocco: first arsenate in the laueite mineral group
Locality: Aghbar, Anti-Atlas, Morocco
_database_code_amcsd 0019348
5.4363 10.500 7.075 97.701 110.295 102.021 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)
Mg        .5      .5       0 .0133  .0093  .0119  .0235  .0074  .0079  .0082
Al1        0       0      .5 .0108  .0074  .0146  .0131  .0060  .0043  .0059
Al2        0       0       0 .0113  .0072  .0160  .0142  .0074  .0045  .0071
As   -.51690 -.16695 -.92788 .0130  .0077  .0174  .0178  .0081  .0054  .0083
Oh1   -.1279   .0075  -.2847 .0148   .010   .023   .015   .009   .004   .009
O2    -.3119  -.1497 -1.0633 .0146   .011   .018   .019  .0075   .008  .0056
O3    -.3702  -.0666  -.6885 .0158   .006   .019   .023  .0061   .004   .007
O4    -.8092  -.1268 -1.0603 .0162   .008   .028   .018   .013   .004   .011
O5    -.6033  -.3275  -.9118 .0193   .013   .018   .029   .006   .009   .008
Ow6   -.0222   .1851  -.5307 .0198   .018   .024   .021   .011   .008   .006
Ow7   -.5981  -.3076  -.5051 .0283   .024   .036   .032   .013   .015   .014
Ow8   -.1690  -.3876  -.0435 .0334   .015   .030   .063   .011   .017   .021
Ow9   -.2589  -.4878  -.6870 .0319   .028   .031   .033   .010   .006   .009
H1     -.110    .160   -.681   .05
H2      .025   -.384    .004   .13
H3     -.166    .210   -.495   .12
H4     -.453   -.228   -.416   .05
H5     -.305   -.536   -.589   .07
H6     -.210   -.400   -.596   .04
H7     -.580   -.316   -.639   .04
H8     -.237   -.309   -.050   .08
H9     -.320    .000   -.361   .12
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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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Plimerite
Download hom/plimerite.pdf
Elliot P, Kolitsch U, Giester G, Libowitzky E, McCammon C, Pring A, Birch W D, Brugger J
 
Mineralogical Magazine 73 (2009) 131-148
Description and crystal structure of a new mineral - plimerite, ZnFe3+4(PO4)3(OH)5 - the
Zn-analogue of rockbridgeite and frondelite, from Broken Hill, New South Wales, Australia
Locality: Broken Hill, New South Wales, Australia
_database_code_amcsd 0014590
13.865 16.798 5.151 90 90 90 Bbmm
atom       x      y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
FeM1       0     .5      0     .0091  .0095  .0074  .0103      0      0 -.0004
ZnM2  .06888 .65849      0 .58 .0168  .0158  .0086  .0259      0      0 -.0005
FeM2  .06888 .65849      0 .42 .0168  .0158  .0086  .0259      0      0 -.0005
FeM3  .32193 .63906  .2323 .94 .0087  .0095  .0068  .0097  .0001  .0014 -.0007
AlM3  .32193 .63906  .2323 .06 .0087  .0095  .0068  .0097  .0001  .0014 -.0007
P1    .14325 .54388     .5     .0096  .0091  .0056  .0141      0      0 -.0004
P2    .48312    .75      0     .0120  .0112  .0072  .0176      0      0      0
O1     .5464    .75 -.2479     .0201   .020  .0146   .025      0  .0123      0
O2     .0811 .55837  .2562     .0151  .0146  .0189  .0117  .0004 -.0038 -.0050
OH3    .3147    .75  .3801     .0144   .019   .008   .016      0   .008      0
O4     .1813  .4595     .5     .0278   .019  .0082   .056      0      0  .0042
OH5    .2154  .6745      0     .0198  .0139  .0099   .036      0      0  .0025
OH6    .0749  .3947      0     .0137  .0131  .0151  .0131      0      0  .0034
O7     .4211  .6745      0     .0160   .017  .0096   .021      0      0 -.0043
O8     .2238  .6063     .5     .0126  .0123  .0105  .0150      0      0 -.0020
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Plimerite
Download hom/plimerite.pdf
Elliot P, Kolitsch U, Giester G, Libowitzky E, McCammon C, Pring A, Birch W D, Brugger J
 
Mineralogical Magazine 73 (2009) 131-148
Description and crystal structure of a new mineral - plimerite, ZnFe3+4(PO4)3(OH)5 - the
Zn-analogue of rockbridgeite and frondelite, from Broken Hill, New South Wales, Australia
Locality: Broken Hill, New South Wales, Australia
_database_code_amcsd 0014590
13.865 16.798 5.151 90 90 90 Bbmm
atom       x      y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
FeM1       0     .5      0     .0091  .0095  .0074  .0103      0      0 -.0004
ZnM2  .06888 .65849      0 .58 .0168  .0158  .0086  .0259      0      0 -.0005
FeM2  .06888 .65849      0 .42 .0168  .0158  .0086  .0259      0      0 -.0005
FeM3  .32193 .63906  .2323 .94 .0087  .0095  .0068  .0097  .0001  .0014 -.0007
AlM3  .32193 .63906  .2323 .06 .0087  .0095  .0068  .0097  .0001  .0014 -.0007
P1    .14325 .54388     .5     .0096  .0091  .0056  .0141      0      0 -.0004
P2    .48312    .75      0     .0120  .0112  .0072  .0176      0      0      0
O1     .5464    .75 -.2479     .0201   .020  .0146   .025      0  .0123      0
O2     .0811 .55837  .2562     .0151  .0146  .0189  .0117  .0004 -.0038 -.0050
OH3    .3147    .75  .3801     .0144   .019   .008   .016      0   .008      0
O4     .1813  .4595     .5     .0278   .019  .0082   .056      0      0  .0042
OH5    .2154  .6745      0     .0198  .0139  .0099   .036      0      0  .0025
OH6    .0749  .3947      0     .0137  .0131  .0151  .0131      0      0  .0034
O7     .4211  .6745      0     .0160   .017  .0096   .021      0      0 -.0043
O8     .2238  .6063     .5     .0126  .0123  .0105  .0150      0      0 -.0020
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Edwardsite
Download hom/edwardsite.pdf
Elliot P, Brugger J, Caradoc-Davies T
 
Mineralogical Magazine 74 (2010) 39-53
Description and crystal structure of a new mineral, edwardsite,
Cu3Cd2(SO4)2(OH)6*4H2O, from Broken Hill, New South Wales, Australia
Locality: Block 14 Opencut, Broken Hill, Australia
_database_code_amcsd 0014597
10.863 13.129 11.169 90 113.04 90 P2_1/c
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    .52495 .74448 1.01316     .0095  .0117  .0060  .0105  -.0010  .0041   .0003
Cu2        .5     .5       1     .0093  .0111  .0067  .0096  -.0014  .0036  -.0007
Cu3        .5     .5      .5     .0095  .0115  .0065  .0103   .0007  .0042   .0013
Cu4    .49372 .37193  .74106     .0091  .0115  .0059  .0105  -.0003  .0050   .0005
Cd1   -.00341 .56798  .31880     .0103  .0103  .0079  .0123  .00036  .0039 -.00009
Cd2    .56339 .61959  .77299 .89 .0117  .0201  .0057  .0105 -.00116  .0074 -.00215
Zn     .56339 .61959  .77299 .11 .0117  .0201  .0057  .0105 -.00116  .0074 -.00215
S1     .18421 .38395  .49236     .0092  .0103  .0069  .0101   .0000  .0037   .0006
S2     .19454 .61158  .89026     .0095  .0101  .0077  .0115  -.0018  .0051  -.0007
O1      .1302  .2814   .4883     .0157   .021   .007   .020   .0017   .008  -.0021
O2      .3292  .3803   .5269     .0112   .010   .014   .007  -.0018  .0001   .0002
O3      .1550  .4483   .5877     .0118   .014   .009   .015  -.0018  .0083   .0016
O4      .1222  .4307   .3604     .0125   .017   .011   .010   .0044  .0054   .0050
O5      .3288  .6217   .9932     .0133   .012   .012   .015  -.0006  .0038  -.0011
O6      .1857  .6688   .7728     .0141   .017   .013   .012   .0029  .0056   .0006
O7      .0944  .6526   .9380     .0139   .018   .011   .015  -.0020  .0084  -.0003
O8      .1663  .5021   .8562     .0134   .013   .009   .016  -.0012  .0025   .0019
OH9     .6077  .6175   .9863     .0148   .013   .011   .020  -.0037   .005  -.0012
OH10    .6095  .7275  1.2014     .0110   .011   .008   .012   .0000  .0023   .0032
OH11    .5573  .2527   .6770     .0126   .017   .009   .014   .0033  .0082   .0031
OH12    .4316  .4903   .8079     .0114   .012   .011   .013  -.0048  .0061  -.0031
OH13    .4426  .6310   .5499     .0110   .014   .007   .012   .0006  .0049   .0014
OH14    .4044  .5295   .3157     .0125   .013   .014   .012   .0012  .0070   .0011
Wat15   .1335  .6248   .2090     .0175   .020   .016   .019  -.0002   .011  -.0026
Wat16   .1566  .6507   .4978     .0138   .015   .009   .018   .0015  .0068   .0001
Wat17  -.1000  .7201   .2504     .0173   .024   .008   .019   .0018   .007   .0016
Wat18   .7994  .5979   .8606     .0247   .017   .023   .031   -.001   .006   -.004
H1       .700   .615   1.011      .035
H2       .698   .707   1.226      .035
H3       .644   .228    .700      .035
H4       .336   .488    .771      .035
H5       .353   .634    .534      .035
H6       .321   .556    .302      .035
H7       .143   .696    .206      .035
H8       .116   .601    .125      .035
H9       .135   .720    .494      .035
H10      .145   .625    .570      .035
H11     -.102   .751    .171      .035
H12     -.042   .769    .312      .035
H13      .837   .655    .913      .035
H14      .862   .572    .831      .035
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Total number of retrieved datasets: 25
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