American Mineralogist Crystal Structure Database

26 matching records for this search.

Allabogdanite
 
Britvin S N, Rudashevsky N S, Krivovichev S V, Burns P C, Polekhovsky Y S
Download am/vol87/AM87_1245.pdf
American Mineralogist 87 (2002) 1245-1249
Allabogdanite, (Fe,Ni)2P, a new mineral from the Onello meteorite:
The occurence and crystal structure
_database_code_amcsd 0002898
5.792 3.564 6.691 90 90 90 Pnma
atom     x   y     z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Fe1  .3577 .25 .9357 .75 .0095  .0129  .0084  .0072      0  .0001      0
Ni1  .3577 .25 .9357 .25 .0095  .0129  .0084  .0072      0  .0001      0
Fe2  .4693 .25 .3324 .75 .0111   .014  .0114  .0080      0  .0010      0
Ni2  .4693 .25 .3324 .25 .0111   .014  .0114  .0080      0  .0010      0
P    .2443 .25 .6225     .0071   .009   .007   .005      0  .0002      0
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Armbrusterite
 
Yakovenchuk V N, Krivovichev S K, Pakhomovsky Y A, Ivanyuk G Y, Selivanova E A,
Menshikov Y P, Britvin S N
Download am/vol92/AM92_416.pdf
American Mineralogist 92 (2007) 416-423
Armbrusterite, K5Na6Mn3+Mn2+14[Si9O22]4(OH)10*4H2O, a new Mn hydrous
heterophyllosilicate from the Khibiny alkaline massif, Kola Peninsula, Russia
Locality: Khibiny alkaline massif, Kola Peninsula, Russia
_database_code_amcsd 0004282
17.333 23.539 13.4895 90 115.069 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)
K1      .210  .9513  .4905 .30  .090
K2      .505      0  .6035 .28  .072
K3         0      0     .5 .16  .042
K5     .9725  .6967   .495 .20    .1
K6      .815  .6705   .490 .17    .1
K7      .854  .7263   .479 .17    .1
K10     .824   .560   .477 .11    .1
K11     .398  .0665   .485 .12    .1
Na1    .8465 .14408  .0470     .0294  .0225  .0192   .047 -.0010  .0151   .001
Na2       .5  .8511      0      .031   .026   .026   .048      0   .024      0
Mn2+1      0 .06931      0     .0223  .0162  .0150  .0381      0  .0139      0
Mn2+2      0 .21062      0     .0219  .0153  .0170  .0355      0  .0127      0
Mn2+3 .32397 .07102 .96233     .0223  .0168  .0157  .0388 -.0003  .0160 -.0005
Mn2+4 .84790      0 .04652     .0229  .0155  .0178  .0380      0  .0141      0
Mn3+5     .5      0      0     .0214  .0137  .0181  .0351      0  .0129      0
Mn2+6 .67138 .78453 .01290     .0230  .0174  .0173  .0395  .0008  .0170  .0011
Si1   .28669 .06392  .1804     .0203  .0150  .0156  .0345 -.0001  .0144  .0009
Si2   .85334 .86802  .7929     .0205  .0135  .0166  .0342  .0018  .0128 -.0003
Si3   .39902 .06387  .7713     .0213  .0138  .0181  .0354 -.0004  .0139  .0000
Si4   .85790 .74466  .7667     .0222  .0148  .0186  .0346 -.0014  .0117 -.0010
Si5   .01462 .06473  .2525     .0206  .0167  .0133  .0363  .0009  .0156  .0000
Si6   .02831 .75457  .7661     .0221  .0165  .0180  .0359 -.0014  .0151  .0008
Si7   .25042 .85840  .7343     .0209  .0130  .0170  .0340  .0005  .0113  .0006
Si8   .05700 .14539  .6269     .0206  .0125  .0198  .0319 -.0001  .0117 -.0015
Si9   .43999 .13157  .2007     .0201  .0124  .0150  .0354 -.0013  .0124 -.0004
O3     .2454  .0672  .0507     .0234   .018   .016   .041  -.001   .016  -.001
O5     .4031  .1383  .0717     .0243   .016   .018   .038   .002   .011  -.003
O6     .2603  .8580  .8579     .0269   .022   .028   .032  -.003   .012  -.002
O7     .9042  .7291  .8946     .0250   .018   .027   .033  -.004   .014  -.003
O8     .9465  .0659  .1274     .0238   .022   .016   .037  -.006   .016  -.004
O9     .9156  .8623  .9180     .0231   .016   .018   .037  -.001   .014   .001
O10    .4251  .0613  .8999     .0242   .016   .022   .039   .002   .017  -.001
O11    .0479      0  .2970     .0255   .025   .014   .044      0   .021      0
O12    .9007  .8973  .7236     .0271   .026   .020   .040  -.004   .019  -.003
O13    .8129  .8070  .7384     .0237   .019   .012   .038  -.004   .009   .000
O14    .4644  .1037  .7424     .0244   .023   .017   .035  -.003   .014   .001
O15    .0671  .7719  .8922     .0259   .019   .028   .032   .002   .012  -.002
O16    .0597  .6928  .7419     .0236   .022   .021   .033   .002   .017   .003
O17    .3033  .9103  .7082     .0245   .015   .021   .041  -.002   .015  -.001
O18        0  .1576     .5      .032   .022   .040   .035      0   .013      0
O19    .7830  .7004  .6985     .0252   .018   .017   .039  -.004   .011   .002
O20    .2999      0  .2285      .027   .031   .013   .039      0   .017      0
O21    .1529  .1329  .6433     .0274   .016   .030   .042  -.001   .017  -.005
O22    .0547  .1999  .6958     .0315   .030   .025   .044   .002   .021  -.005
O23    .3814  .0906  .2391     .0290   .018   .033   .035  -.010   .010   .000
O24    .3989      0  .7223     .0238   .023   .019   .037      0   .020      0
O26    .9254  .7478  .7106     .0284   .014   .038   .033  -.004   .010  -.002
O27    .7697  .9067  .7654     .0293   .022   .030   .035   .012   .012   .001
O28    .9767  .0893  .3356     .0284   .023   .022   .051  -.004   .027  -.001
OH1    .2409      0  .8736     .0265   .023   .022   .040      0   .018      0
OH2    .4119      0  .0649      .029   .021   .023   .049      0   .019      0
OH4    .0899      0  .0692      .027   .024   .022   .038      0   .016      0
OH25   .7508  .7120  .0734     .0270   .018   .024   .042   .002   .016   .003
Wat1       0   .652     .5 .35    .1
Wat2       0   .586     .5 .34    .1
Wat3    .878   .683   .434 .26    .1
Wat4    .824   .613   .478 .29    .1
Wat5    .243      0   .413 .26    .1
Wat6    .218      0   .509 .26    .1
Wat7   .8609      0  .3821 .70    .1
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Rudashevskyite
 
Britvin S N, Bogdanova A N, Boldyreva M M, Aksenova G Y
Download am/vol93/AM93_902.pdf
American Mineralogist 93 (2008) 902-909
Rudashevskyite, the Fe-dominant analogue of sphalerite, a new mineral:
Description and crystal structure
Locality: Indarch meteorite
Sample: Domain 1
_database_code_amcsd 0004582
5.441 5.441 5.441 90 90 90 F-43m
atom   x   y   z occ Uiso
Fe     0   0   0 .61 .041
Zn     0   0   0 .35 .041
Mn     0   0   0 .04 .041
S    .25 .25 .25     .056
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Rudashevskyite
 
Britvin S N, Bogdanova A N, Boldyreva M M, Aksenova G Y
Download am/vol93/AM93_902.pdf
American Mineralogist 93 (2008) 902-909
Rudashevskyite, the Fe-dominant analogue of sphalerite, a new mineral:
Description and crystal structure
Locality: Indarch meteorite
Sample: Domain 2
_database_code_amcsd 0004583
5.439 5.439 5.439 90 90 90 F-43m
atom   x   y   z occ Uiso
Fe     0   0   0 .61 .038
Zn     0   0   0 .35 .038
Mn     0   0   0 .04 .038
S    .25 .25 .25     .046
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Rudashevskyite
 
Britvin S N, Bogdanova A N, Boldyreva M M, Aksenova G Y
Download am/vol93/AM93_902.pdf
American Mineralogist 93 (2008) 902-909
Rudashevskyite, the Fe-dominant analogue of sphalerite, a new mineral:
Description and crystal structure
Locality: Indarch meteorite
Sample: Domain 3
_database_code_amcsd 0004584
5.444 5.444 5.444 90 90 90 F-43m
atom   x   y   z occ Uiso
Fe     0   0   0 .61 .041
Zn     0   0   0 .35 .041
Mn     0   0   0 .04 .041
S    .25 .25 .25     .053
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Fluorvesuvianite
 
Britvin S N, Antonov A A, Krivovichev S V, Armbruster T, Burns P C, Chukanov N V
Download cm/vol41/CM41_1371.pdf
The Canadian Mineralogist 41 (2003) 1371-1380
Fluorvesuvianite, Ca19(Al,Mg,Fe)13[SiO4]10[Si2O7]4O(F,OH)9, a new mineral species
from Pitkaranta, Karelia, Russia: Description and crystal structure
Locality: Pitkaranta, Karelia, Russia
_database_code_amcsd 0005894
15.5295 15.5295 11.7808 90 90 90 *P4/nnc
.25 .25 .25
atom          x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1         3/4    1/4      0 .803 .0031  .0029  .0029  .0034      0      0      0
Si2      .81894 .04068 .87126      .0097  .0093  .0104  .0095  .0004  .0007  .0007
Si3      .91766 .84952 .36457      .0102  .0135  .0081  .0091 -.0012  .0002  .0008
Ca1         3/4    1/4    1/4      .0113  .0131  .0099  .0108      0      0      0
Ca2      .81096 .04346 .37980      .0111  .0095  .0128  .0109  .0010 -.0002  .0001
Ca3      .89923 .82022 .88711      .0156  .0132  .0130  .0207  .0020 -.0057 -.0026
Ca4         3/4    3/4  .1428  .50 .0140  .0140  .0140   .014      0      0      0
Fe1         3/4    3/4  .0500  .50 .0255  .0141  .0141   .048      0      0      0
Al2           0      0      0      .0103  .0095  .0067  .0148  .0013  .0019  .0003
Fe3      .88813 .12071 .12691 .046 .0080  .0087  .0084  .0070  .0004  .0017 -.0001
Al3      .88813 .12071 .12691 .780 .0080  .0087  .0084  .0070  .0004  .0017 -.0001
Mg3      .88813 .12071 .12691  .17 .0080  .0087  .0084  .0070  .0004  .0017 -.0001
O1        .7811  .1714  .0869      .0111   .010   .014   .009 -.0006  -.002 -.0042
O2        .8835  .1594  .2785      .0096   .012   .008   .009 -.0005  -.001  .0016
O3        .9504  .2782  .4233      .0104   .014   .009   .009 -.0025 -.0027 -.0034
O4        .1067 -.0627  .0296      .0106   .010   .009   .012 -.0033 -.0004  .0021
O5        .8305  .0148  .1782      .0121   .009   .012   .015  .0061  .0037  .0008
O6        .8823  .7288  .0590      .0148   .021   .010   .014  .0034   .003  .0025
O7        .0564  .1750  .3221      .0122   .011   .013   .013  .0016 -.0002  .0031
O8        .0906  .0610  .5661      .0104   .010   .009   .012 -.0008 -.0008 -.0028
O9        .8554  .8554    1/4      .0109  .0115  .0115   .010  -.002 -.0017  .0017
O10         3/4    3/4  .8642      .0146   .014   .014   .015      0      0      0
F11      -.0047  .0620  .1374  .72 .0166   .016   .020   .014 -.0006 -.0010 -.0030
O11      -.0047  .0620  .1374  .28 .0166   .016   .020   .014 -.0006 -.0010 -.0030
H           3/4    3/4    3/4       .080
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Pauflerite
 
Krivovichev S V, Vergasova L P, Britvin S N, Filatov S K, Kahlenberg V, Ananiev V V
Download cm/vol45/CM45_921.pdf
The Canadian Mineralogist 45 (2007) 921-927
Pauflerite, B-VO(SO4), a new mineral species from the Tolbachik volcano,
Kamchatka Peninsula, Russia
Locality: Great Fissure Tolbachik eruption, Kamchatka Peninsula, Russia
_database_code_amcsd 0006150
7.3890 6.2740 7.0788 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)
V    .33473   .25 .26710 .0082  .0096  .0060  .0091      0 -.0020      0
S    .37696   .75 .36810 .0064  .0063  .0055  .0074      0 -.0006      0
O1    .3752 .5627  .2434 .0120  .0191  .0055  .0115 -.0005  .0005 -.0019
O2    .1264   .25  .3324 .0127  .0094  .0139  .0146      0 -.0009      0
O3    .5448   .75  .4807 .0124  .0084  .0198  .0088      0 -.0029      0
O4    .2157   .75  .4901 .0125  .0101  .0196  .0078      0  .0018      0
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Kottenheimite
 
Chukanov N V, Britvin S N, Van K V, Mockel S, Zadov A E
 
The Canadian Mineralogist 50 (2012) 55-63
Kottenheimite, Ca3Si(OH)6(SO4)2*12H2O, a new member of the ettringite group
from the Eifel area, Germany
Locality: Bellerberg, near Kottenheim, Eastern Eifel area,
Rhineland-Palatinate, Germany
_database_code_amcsd 0019043
11.1548 11.1548 10.5702 90 90 120 P6_3/m
atom     x      y     z occ Biso
Ca    .193 -.0124   .25      .14
Si       0      0     0      1.1
S      1/3    2/3     0 .91   .8
Wat1  .390  .2325   .25      1.1
Wat2  .137  -.254   .25      1.5
Wat3 .3333 -.0155 .4257       .6
OH4  .1353  .1278 .1030     1.00
O5     1/3    2/3 -.137 .86  7.9
O6   .1912  .6133 .0334 .99  5.3
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Rimkorolgite
Download hom/rimkorolgite.pdf
Krivovichev S V, Britvin S N, Burns P C, Yakovenchuk V N
 
European Journal of Mineralogy 14 (2002) 397-402
Crystal structure of rimkorolgite, Ba[Mg5(H2O)7(PO4)4](H2O), and its comparison
with bakhchisaraitsevite
_database_code_amcsd 0006928
8.3354 12.8304 18.313 90 90.025 90 P2_1/c
atom       x      y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ba    .23818 .08279 .00270 .0168  .0132  .0169  .0202  .0009 -.0014  .0003
Mg1   -.2804  .1866 -.0681 .0060  .0060  .0051  .0067 -.0011  .0012  .0012
Mg2    .1951 -.0758 -.2292 .0144  .0079  .0085  .0177  .0010  .0001  .0001
Mg3   -.1979 -.0817 -.2458 .0113  .0093  .0094  .0151 -.0010  .0016 -.0024
Mg4   -.2956 -.3127 -.2691 .0103  .0093  .0066  .0152 -.0004 -.0014 -.0005
Mg5    .3129 -.3053 -.2457 .0093  .0088  .0077  .0115 -.0010  .0022 -.0009
P1    -.0213  .0941 -.1470 .0106  .0089  .0095  .0135 -.0003 -.0001 -.0006
P2    -.0108 -.2556 -.1499 .0097  .0079  .0107  .0104 -.0012 -.0003 -.0003
P3     .4900 -.0228 .14849 .0097  .0092  .0084  .0115  .0002  .0003  .0022
P4     .5125  .1408  .3473 .0105  .0078  .0111  .0126 -.0017  .0002 -.0005
Wat1   .3684  .2150  .5338 .0286  .0340  .0200  .0310 -.0010  .0040  .0020
Wat2   .2530 -.4456 -.1904 .0126  .0140  .0080  .0160 -.0010 -.0010 -.0030
O3    -.0536  .0670 -.0679 .0169  .0180  .0160  .0170 -.0040  .0000 -.0010
O4    -.0143 -.0033 -.1963 .0106  .0090  .0090  .0140  .0010 -.0030 -.0060
Wat5  -.2462 -.4472 -.2051 .0122  .0120  .0080  .0170  .0010  .0000  .0000
O6     .4484 -.0632  .0711 .0100  .0160  .0060  .0070  .0000 -.0010  .0020
O7     .1485 -.2219 -.1860 .0106  .0070  .0080  .0170 -.0030  .0050 -.0010
O8    -.0296 -.2006 -.0767 .0135  .0140  .0150  .0120  .0040  .0040 -.0040
O9     .6452  .1593  .2898 .0110  .0080  .0090  .0150 -.0010  .0060  .0030
O10    .1334  .1549 -.1520 .0178  .0180  .0150  .0210 -.0090  .0050 -.0020
O11   -.1480 -.2277 -.2016 .0131  .0130  .0130  .0130  .0020 -.0030  .0020
Wat12  .5126 -.2630 -.1749 .0153  .0120  .0160  .0180  .0010  .0020 -.0040
O13   -.1660  .1625 -.1694 .0142  .0110  .0170  .0150  .0060 -.0030  .0000
O14    .3645  .0592  .1697 .0136  .0120  .0060  .0230  .0030  .0060  .0000
O15    .3499  .1695  .3126 .0106  .0070  .0100  .0150  .0050 -.0030  .0010
O16    .4958 -.1157  .2022 .0110  .0080  .0110  .0140  .0010 -.0030  .0040
O17    .5112  .0241  .3700 .0131  .0140  .0050  .0200 -.0040  .0020  .0030
Wat18 -.0050  .3753 -.1811 .0176  .0170  .0150  .0220 -.0010  .0040  .0000
Wat19 -.2704  .1543  .0388 .0279  .0200  .0390  .0250 -.0190 -.0140 -.0050
O20    .6568  .0290  .1467 .0132  .0090  .0120  .0180 -.0030 -.0010  .0010
O21   -.0072 -.3758 -.1375 .0134  .0110  .0110  .0190 -.0020  .0040  .0040
Wat22  .7063  .0064  .4930 .0700  .0910  .0440  .0740 -.0120 -.0390  .0300
O23    .5485  .2083  .4149 .0150  .0180  .0070  .0200 -.0030  .0020 -.0050
Wat24 -.1151  .3130 -.0376 .0242  .0280  .0210  .0240 -.0010 -.0030 -.0030
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Stronadelphite
 
Pekov I V, Britvin S N, Zubkova N V, Pushcharovsky D Y, Pasero M, Merlino S
 
European Journal of Mineralogy 22 (2010) 869-874
Stronadelphite, Sr5(PO4)3F, a new apatite-group mineral
Locality: Belovitovoye pegmatite, Kirovskii apatite mine at Mt. Kukisvumchorr,
in the southern part of the Khibiny alkaline complex, Kola peninsula, Russia
_database_code_amcsd 0017880
9.845 9.845 7.383 90 90 120 P6_3/m
atom     x      y      z occ  Uiso
SrM1   1/3    2/3 -.0004  .9 .0206
CaM1   1/3    2/3 -.0004  .1 .0206
SrM2 .2393 -.0147    .25     .0208
P    .4005  .3689    .25     .0165
O1   .3326  .4826    .25      .018
O2   .5804  .4640    .25      .028
O3   .3455  .2637  .0797      .028
F        0      0    .25      .074
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Windhoekite
 
Chukanov N V, Britvin S N, Blass G, Belakovskiy D I, Van K V
 
European Journal of Mineralogy 24 (2012) 171-179
Windhoekite, Ca2Fe3+3-x(Si8O20)(OH)4*10H2O, a new palygorskite-group mineral
from the Aris phonolite, Namibia
Note: the chemical formula for this mineral cannot be obtained from the
crystal structure. The structure is missing two oxygens, and
the OH positions were not given.
Locality: Aris phonolite, Namibia
_database_code_amcsd 0018919
14.319 17.825 5.242 90 103.5 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)
CaM3      .5 .3130     0 .62  .057   .063   .067   .043      0   .019      0
Mn2+M3    .5 .3130     0 .04  .057   .063   .067   .043      0   .019      0
CaM4      .5 .2300    .5 .37  .053   .065   .045   .050      0   .016      0
Mn2+M4    .5 .2300    .5 .03  .053   .065   .045   .050      0   .016      0
Fe3+M1    .5    .5     0     .0294   .050   .024   .018      0   .015      0
Fe3+M2    .5 .4126    .5 .88 .0301   .051   .023   .022      0   .019      0
Si1    .3001 .4162 .0314     .0222   .045   .010   .016 -.0034   .015 -.0011
Si2    .2987 .3313 .5262     .0272   .053   .010   .024 -.0030   .020 -.0001
O1     .4180 .4167 .1144      .026   .044   .012   .025  -.007   .016  -.002
O2     .4154 .3308 .5910      .036   .052   .023   .037  -.001   .017  -.003
O3       .25   .25    .5      .041   .092   .009   .029  -.017   .026   .005
O4     .5685    .5 .3644      .033   .043   .033   .033      0   .028      0
O5     .2576    .5 .0015      .031   .057   .008   .031      0   .019      0
O6     .2566 .3735 .2495      .031   .061   .018   .019  -.001   .022   .006
O7     .2598 .3745  .755      .032   .057   .009   .035  -.009   .023  -.006
Wat1    .106    .5  .361       .26    .27    .27    .33      0    .24      0
Wat2   .4064 .2302  .107      .132    .17    .12    .13   .019   .083   -.01
Wat3    .487  .106  .698       .87
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Shulamitite
 
Sharygin V V, Lazic B, Armbruster T M, Murashko M N, Wirth R, Galuskina I O,
Galuskin E V, Vapnik Y, Britvin S N, Logvinova A M
 
European Journal of Mineralogy 25 (2013) 97-111
Shulamitite Ca3TiFe3+AlO8 - a new perovskite-related mineral from Hatrurim Basin, Israel
Locality: Hatrurim Basin, Israel
_database_code_amcsd 0019802
5.4200 11.064 5.5383 90 90 90 Pmma
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   -.25 .31440 .27827      .0126  .0202  .0088  .0088      0      0 -.0002
Ca2    .25      0 -.2663      .0139  .0164  .0119  .0133      0      0      0
Ti     .25 .17018 .23942  .50 .0062  .0043  .0086  .0056      0      0  .0006
Fe     .25 .17018 .23942 .400 .0062  .0043  .0086  .0056      0      0  .0006
Al     .25 .17018 .23942 .100 .0062  .0043  .0086  .0056      0      0  .0006
Al2  .1998     .5  .1794 .312 .0064  .0073  .0041  .0078      0 -.0012      0
Fe2  .1998     .5  .1794 .188 .0064  .0073  .0041  .0078      0 -.0012      0
O1     .25  .3599  .3214      .0183  .0326  .0116  .0108      0      0  .0017
O2   .1362     .5 -.1110  .50 .0148   .019   .012   .013      0  -.004      0
O3       0  .1521     .5      .0118  .0112  .0107  .0134      0  .0035      0
O4     .25      0  .1722      .0130   .019  .0100  .0097      0      0      0
O5       0  .2023      0      .0143  .0138  .0155  .0137      0 -.0024      0
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Hatertite
 
Krivovichev S V, Vergasova L P, Filatov S K, rybin D S, Britvin S N, Ananiev V V
 
European Journal of Mineralogy 25 (2013) 683-691
Hatertite, Na2(Ca,Na)(Fe3+,Cu)2(AsO4)3, a new alluaudite-group mineral from
Tolbachik fumaroles, Kamchatka peninsula, Russia
Locality: Tolbachik fumaroles, Kamchatka peninsula, Russia
_database_code_amcsd 0020029
12.640 13.007 6.700 90 113.828 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)
NaA(1)       .5       0      0 .87  .0321  .0394  .0189  .0205 -.0042 -.0061   .003
CaA(1)       .5       0      0 .13  .0321  .0394  .0189  .0205 -.0042 -.0061   .003
NaA(2)        0  -.0080    .25 .55  .0466  .0217   .047   .052      0 -.0049      0
KA(2)         0  -.0080    .25 .30  .0466  .0217   .047   .052      0 -.0049      0
CaM(1)        0  .26401    .25 .60  .0219  .0239  .0180  .0284      0  .0154      0
NaM(1)        0  .26401    .25 .27  .0219  .0239  .0180  .0284      0  .0154      0
MnM(1)        0  .26401    .25 .13  .0219  .0239  .0180  .0284      0  .0154      0
Fe3+M(2) .27324  .65670 .35841 .45  .0147  .0162  .0148  .0130  .0006  .0058 -.0004
CuM(2)   .27324  .65670 .35841 .20  .0147  .0162  .0148  .0130  .0006  .0058 -.0004
AlM(2)   .27324  .65670 .35841 .19  .0147  .0162  .0148  .0130  .0006  .0058 -.0004
ZnM(2)   .27324  .65670 .35841 .16  .0147  .0162  .0148  .0130  .0006  .0058 -.0004
AsT(1)        0 -.27594    .25      .0166  .0221  .0149  .0102      0  .0038      0
AsT(2)   .24467 -.10591 .13632     .01722  .0228  .0146  .0116  .0021  .0043  .0006
O(1)      .4476   .7007  .5259      .0208   .027   .024  .0107  .0000  .0066 -.0049
O(2)      .0971   .6447  .2211      .0308   .033   .024   .034  .0025   .013 -.0136
O(3)      .3262   .6661  .1044      .0235   .032   .016  .0160 -.0053  .0038 -.0015
O(4)      .1161   .4083  .3061      .0235   .027   .023  .0193  .0052  .0087  .0061
O(5)      .2306   .8200  .3333      .0214   .031   .022  .0159  .0018  .0144  .0035
O(6)      .3187   .5072  .3732      .0322   .044   .024  .0260 -.0178   .011 -.0005
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Mellizinkalite
 
Pekov I V, Zubkova N V, Yapaskurt V O, Lykova I S, Belakovskiy D I, Vigasina M F,
Sidorov E G, Britvin S N, Pushcharovsky D Y
 
European Journal of Mineralogy 27 (2015) 247-253
New zinc and potassium chlorides from fumaroles of the Tolbachik volcano, Kamchatka,
Russia: mineral data and crystal chemistry. I. Mellizinkalite, K3Zn2Cl7
Locality: Glavnaya Tenoritovaya fumarole, Tolbachik volcano, Kamchatka, Russia
_database_code_amcsd 0020463
6.7737 10.5715 11.0730 117.930 106.909 90.389 P-1
atom      x      y      z  occ  Uiso
K1    .3886  .9051  .7798 .983 .0429
Rb1   .3886  .9051  .7798  .01 .0429
K2    .9033  .1883 -.2240 .983 .0475
Rb2   .9033  .1883 -.2240  .01 .0475
K3    .1332  .4129  .2860 .983 .0514
Rb3   .1332  .4129  .2860  .01 .0514
Zn1   .5070 .34275 .01227  .92 .0386
Cu1   .5070 .34275 .01227  .07 .0386
Mg1   .5070 .34275 .01227 .045 .0386
Zn2  .64580 .73248 .44018  .92 .0333
Cu2  .64580 .73248 .44018  .07 .0333
Mg2  .64580 .73248 .44018 .045 .0333
Cl1   .6745  .8392  .3103 .993 .0465
Cl2   .6950  .4985  .3492 .993 .0502
Cl3   .2785  .1995  .0271 .993 .0328
Cl4   .2754  .5033  .0105 .993 .0402
Cl5   .7453  .1971  .0155 .993 .0338
Cl6   .3141  .7327  .4523 .993 .0394
Cl7   .8630  .8586  .6733 .993 .0493
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Alumoakermanite
Download hom/alumoakermanite.pdf
Wiedenmann D, Zaitsev A N, Britvin S N, Krivovichev S V, Keller J
 
Mineralogical Magazine 73 (2009) 373-384
Alumoakermanite, (Ca,Na)2(Al,Mg,Fe2+)(Si2O7), a new mineral from the active
carbonatite-nephelinite-phonolite volcano Oldoinyo Lengai, northern Tanzania
Locality: Oldoinyo Lengai, northern Tanzania
_database_code_amcsd 0020206
7.7661 7.7661 5.0297 90. 90. 90. P-42_1m
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  .66382 .83618 .49132 .76  .0182  .0204  .0204  .0138  .0063 -.0016 -.0016
Na1  .66382 .83618 .49132 .24  .0182  .0204  .0204  .0138  .0063 -.0016 -.0016
Al2       0      0      0 .50  .0125  .0111  .0111  .0154      0      0      0
Fe2       0      0      0 .30  .0125  .0111  .0111  .0154      0      0      0
Mg2       0      0      0 .20  .0125  .0111  .0111  .0154      0      0      0
Si   .85952 .64048 .05699     .01169  .0122  .0122  .0106  .0014  .0002  .0002
O1       .5      0  .8240      .0237  .0293  .0293   .012  -.017      0      0
O2   .85812 .64188  .7411      .0246  .0301  .0301  .0136  .0063  .0025  .0025
O3    .9172 .81825  .2026      .0257  .0372  .0186  .0214 -.0074  .0053 -.0045
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Kerimasite
 
Zaitsev A N, Williams C T, Britvin S N, Kuznetsova I V, Spratt J, Petrov S V, Keller J
 
Mineralogical Magazine 74 (2010) 803-820
Kerimasite, Ca3Zr2(Fe3+2Si)O12, a new garnet from carbonatites of Kerimasi volcano
and surrounding explosion craters, northern Tanzania
Locality: Kerimasi volcano, Tanzania
_database_code_amcsd 0018324
12.5512 12.5512 12.5512 90 90 90 Ia3d
atom     x     y     z occ  Uiso
CaX   .125     0   .25 .96 .0048
LaX   .125     0   .25 .03 .0048
MnX   .125     0   .25 .01 .0048
ZrY      0     0     0 .73 .0093
NbY      0     0     0 .22 .0093
MgY      0     0     0 .05 .0093
FeZ   .375     0   .25 .44  .013
AlZ   .375     0   .25 .28  .013
SiZ   .375     0   .25 .25  .013
TiZ   .375     0   .25 .03  .013
O    .0330 .0509 .6519     .0116
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Cerianite-(Ce)
Download hom/cerianitece.pdf
Zaitsev A N, Chakhmouradian A R, Siidra O I, Spratt J, Williams C T,
Stanley C J, Petrov S V, Britvin S N, Polyakova E A
 
Mineralogical Magazine 75 (2011) 2813-2822
Fluorine-, yttrium- and lanthanide-rich cerianite-(Ce) from carbonatitic rocks of the
Kerimasi volcano and surrounding explosion craters, Gregory Rift, northern Tanzania
Locality: Gregory Rift, northern Tanzania
_database_code_amcsd 0018569
5.4203 5.4203 5.4203 90 90 90 Fm-3m
atom   x   y   z occ  Uiso
CeA    0   0  .5 .62 .0093
YA     0   0  .5 .20 .0093
NdA    0   0  .5 .06 .0093
LaA    0   0  .5 .03 .0093
PrA    0   0  .5 .01 .0093
SmA    0   0  .5 .01 .0093
GdA    0   0  .5 .02 .0093
DyA    0   0  .5 .02 .0093
ErA    0   0  .5 .01 .0093
YbA    0   0  .5 .02 .0093
OX   .25 .25 .25 .84 .0128
FX   .25 .25 .25 .12 .0128
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Thaumasite
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Pekov I V, Chukanov N V, Britvin S N, Kabalov Y K, Gottlicher J, Yapaskurt V O,
Zadov A E, Krivovichev S V, Schuller W, Ternes B
 
Mineralogical Magazine 76 (2012) 1133-1152
The sulfite anion in ettringite-group minerals: a new mineral species
hielscherite, Ca3Si(OH)6(SO4)(SO3)*11H2O, and the thaumasite-hielscherite
solid-solution series
Note: sample Zb-01, single crystal
Locality: Zeilberg basalt quarry, Maroldsweisach, Franconia, Bavaria
_database_code_amcsd 0019543
11.070 11.070 10.4397 90 90 120 P6_3
atom        x      y     z occ Biso
Ca      .8054 .79393 .1340     1.78
Si          0      0 .3880     1.52
O1      .8688  .9949 .9883     1.98
O2      .0072  .8758 .2791     1.58
O3      .6644   .658 .9545     3.95
O4      .7705  .6085  .632     3.32
O5      .8582  .5967  .138     2.84
O6      .6722  .6529 .3148     2.13
S6+1      1/3    2/3 .3764 .85 2.45
OS1A      1/3    2/3 .2312     2.84
OS1B    .4259  .6199 .4216     2.13
C         1/3    2/3   .85  .5  1.6
S4+2      1/3    2/3  .911 .42  .32
O(C,S2)  .370  .8020 .8473     3.71
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Hielscherite
 
Pekov I V, Chukanov N V, Britvin S N, Kabalov Y K, Gottlicher J, Yapaskurt V O,
Zadov A E, Krivovichev S V, Schuller W, Ternes B
 
Mineralogical Magazine 76 (2012) 1133-1152
The sulfite anion in ettringite-group minerals: a new mineral species
hielscherite, Ca3Si(OH)6(SO4)(SO3)*11H2O, and the thaumasite-hielscherite
solid-solution series
Note: sample G-3231, single crystal
Locality: Graulay basalt quarry, Hillesheim,  Eifel Mountains, Germany
_database_code_amcsd 0019544
11.106 11.106 10.492 90 90 120 P6_3
atom        x      y     z occ Biso
Ca      .8058  .7950 .1378     2.07
Si          0      0 .3900      1.4
O1       .877   .998 .9943      2.0
O2      .0116  .8735 .2867      2.8
O3      .6710  .6638 .9581      2.8
O4      .7710  .6093  .640      4.0
O5      .8574  .5983 .1417      3.3
O6      .6695  .6497  .317      4.0
S6+1      1/3    2/3 .3742      2.3
OS1A      1/3    2/3  .237      4.0
OS1B    .4307  .6228  .421      4.5
S4+2      1/3    2/3 .8956      4.5
O(C,S2)  .372  .8042 .8503      3.9
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Hielscherite
 
Pekov I V, Chukanov N V, Britvin S N, Kabalov Y K, Gottlicher J, Yapaskurt V O,
Zadov A E, Krivovichev S V, Schuller W, Ternes B
 
Mineralogical Magazine 76 (2012) 1133-1152
The sulfite anion in ettringite-group minerals: a new mineral species
hielscherite, Ca3Si(OH)6(SO4)(SO3)*11H2O, and the thaumasite-hielscherite
solid-solution series
Note: sample G-3049, powder
Locality: Graulay basalt quarry, Hillesheim,  Eifel Mountains, Germany
_database_code_amcsd 0019545
11.1178 11.1178 10.5381 90 90 120 P6_3
atom        x      y     z occ Biso
Ca      .8059  .7948  .140      1.9
Si          0      0  .385  .7  1.7
Al          0      0  .385  .3  1.7
O1       .869   .995 .9878      1.8
O2       .007   .876 .2796      1.5
O3       .664   .659  .955      4.0
O4       .771   .609  .631      3.5
O5       .858  .5969  .140      3.0
O6       .672   .653  .315      2.2
S6+1      1/3    2/3  .375 .98  2.5
OS1A      1/3    2/3  .231        3
OS1B     .426   .620  .421        2
C         1/3    2/3   .85 .39    2
S4+2      1/3    2/3  .914 .59    1
O(C,S2)  .370   .802  .849        4
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Oxo-magnesio-hastingsite
 
Zaitsev A N, Avdontseva E Y, Britvin S N, Demeny A, Homonnay Z, Jeffries T E,
Keller J, Krivovichev V G, Markl G, Platonova N V, Siidra O I, Spratt J, Vennemann T
 
Mineralogical Magazine 77 (2013) 2773-2792
Oxo-magnesio-hastingsite, NaCa2(Mg2Fe3+3)(Al2Si6)O22O2, a new anhydrous amphibole
from the Deeti volcanic cone, Gregory rift, northern Tanzania
Locality: the Deeti volcanic cone, Gregory rift, northern Tanzania
_database_code_amcsd 0019979
9.8837 18.0662 5.3107 90 105.278 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)
NaAm    .0217     .5  .0433 .335  .0198
KAm'    .0587     .5   .114 .165  .0371
MgM1        0 .08344     .5  .61 .01223  .0086  .0209  .0077       0 .00317       0
Ti4+M1      0 .08344     .5  .22 .01223  .0086  .0209  .0077       0 .00317       0
Fe3+M1      0 .08344     .5  .17 .01223  .0086  .0209  .0077       0 .00317       0
MgM2        0 .17717      0  .60 .00715  .0073  .0064  .0078       0 .00213       0
AlM2        0 .17717      0  .06 .00715  .0073  .0064  .0078       0 .00213       0
Fe3+M2      0 .17717      0  .34 .00715  .0073  .0064  .0078       0 .00213       0
MgM3        0      0      0  .67  .0081  .0097  .0056  .0079       0  .0004       0
Fe3+M3      0      0      0  .33  .0081  .0097  .0056  .0079       0  .0004       0
CaM4   .27880     .5 .01131  .92 .01131  .0129 .00996  .0129       0 .00672       0
NaM4   .27880     .5 .01131 .075 .01131  .0129 .00996  .0129       0 .00672       0
Mn2+M4 .27880     .5 .01131 .005 .01131  .0129 .00996  .0129       0 .00672       0
SiT1   .28190 .08529 .30306 .575 .00740 .00744 .00632 .00809 -.00073 .00141 -.00056
AlT1   .28190 .08529 .30306 .425 .00740 .00744 .00632 .00809 -.00073 .00141 -.00056
SiT2   .29017 .17250 .81059 .975 .00724 .00715 .00686 .00760 -.00082 .00176 -.00005
AlT2   .29017 .17250 .81059 .025 .00724 .00715 .00686 .00760 -.00082 .00176 -.00005
O1     .10780 .08700 .21959      .00988  .0093  .0096  .0104  -.0008  .0020  -.0004
O2     .11857 .17148 .72761      .00989  .0082  .0105  .0107  -.0001  .0020   .0003
O3     .10719      0  .7145  .70  .0122  .0106  .0136  .0119       0  .0023       0
OH3    .10719      0  .7145  .30  .0122  .0106  .0136  .0119       0  .0023       0
O4     .36486 .25034  .7899      .01222  .0136  .0097  .0135  -.0028  .0039  -.0004
O5     .34981 .13882 .10795       .0140  .0112  .0169  .0129   .0002  .0014   .0051
O6     .34649 .11779 .60676       .0137  .0121  .0143  .0151   .0001  .0040  -.0042
O7     .34140      0  .2852       .0172  .0125  .0148  .0226       0  .0018       0
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Challacolloite
 
Schluter J, Pohl D, Britvin S
 
Neues Jahrbuch fur Mineralogie, Abhandlungen 182 (2005) 95-101
The new mineral challacolloite, KPb2Cl5, the natural occurrence of a
technically known laser material
Locality: Challacollo silver mine, Iquique, Atacama desert, Chile
_database_code_amcsd 0019134
8.864 7.932 12.491 90 90.153 90 P2_1/c
atom     x     y     z Biso
K    .0151 .0429 .8295 2.63
Pb1  .5054 .9863 .1736 2.63
Pb2  .2449 .9353 .4937 2.63
Cl1  .0413 .3082 .0715 2.63
Cl2  .4660 .3455 .1011 2.63
Cl3  .2555 .1471 .3110 2.63
Cl4  .2728 .5306 .4873 2.63
Cl5  .2175 .6941 .2195 2.63
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Piemontite-(Pb)
 
Chukanov N V, Varlamov D A, Nestola F, Belakovskiy D I, Goettlicher J,
Britvin S N, Lanza A, Jancev S
 
Neues Jahrbuch fur Mineralogie, Abhandlungen 189 (2012) 275-286
Piemontite-(Pb), CaPbAl2Mn3+[Si2O7][SiO4]O(OH), a new mineral species
of the epidote supergroup
Locality: "Mixed Series" formation, Jacupica Mtns, Macedonia
_database_code_amcsd 0020679
8.936 5.697 10.26 90 114.12 90 P2_1/m
atom      x     y      z  occ  Uiso
Ca    .7640   .75  .1548      .0176
Pb1  .58753   .75 .40974  .73 .0185
Ca1  .58753   .75 .40974  .30 .0185
AlM1      0     0      0  .65 .0139
FeM1      0     0      0  .34 .0139
AlM2      0     0     .5      .0143
MnM3  .2920   .25  .2198  .67 .0154
FeM3  .2920   .25  .2198  .33 .0154
Sil   .3385   .75  .0416      .0157
Si2   .6880   .25  .2775      .0144
Si3   .1755   .75  .3120  .96 .0142
Al3   .1755   .75  .3120  .04 .0142
O1    .2385 .5073  .0408      .0176
O2    .2933 .5193  .3418      .0189
O3    .7955 .0134  .3413      .0196
O4    .0514   .25  .1275       .016
O5    .0315   .75  .1452       .018
O6    .0674   .75  .4075      .0118
O7    .5148   .75  .1663       .019
O8    .5269   .25  .3086       .020
O9    .6392   .25  .1085       .024
O10   .0801   .25  .4295      .0145
H       .06   .25   .342        .05
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Christofschaferite-(Ce)
 
Chukanov N V, Aksenov S M, Rastsvetaeva R K, Belakovskiy D I, Gottlicher J,
Britvin S N, Mockel S
 
New Data on Minerals. Moscow 47 (2012) 31-40
Christofschaferite-(Ce), (Ce,La,Ca)4Mn2+(Ti,Fe3+)3(Fe3+,Fe2+,Ti)(Si2O7)2O8,
a new chevkinite-group mineral from the Eifel area, Germany
Locality: near Eifel, Germany
_database_code_amcsd 0020048
13.3722 5.7434 11.0862 90 100.580 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)
CeA1   .39299   -.25 .26638 .425 .00593  .0075  .0031  .0072      0  .0013      0
LaA1   .39299   -.25 .26638  .37 .00593  .0075  .0031  .0072      0  .0013      0
NdA1   .39299   -.25 .26638 .042 .00593  .0075  .0031  .0072      0  .0013      0
PrA1   .39299   -.25 .26638  .01 .00593  .0075  .0031  .0072      0  .0013      0
CaA1   .39299   -.25 .26638 .142 .00593  .0075  .0031  .0072      0  .0013      0
CeA2   .81886   -.25 .73890 .425 .00448  .0046  .0039  .0051      0  .0012      0
LaA2   .81886   -.25 .73890  .37 .00448  .0046  .0039  .0051      0  .0012      0
NdA2   .81886   -.25 .73890 .042 .00448  .0046  .0039  .0051      0  .0012      0
PrA2   .81886   -.25 .73890  .01 .00448  .0046  .0039  .0051      0  .0012      0
CaA2   .81886   -.25 .73890 .142 .00448  .0046  .0039  .0051      0  .0012      0
CeA3   .10733   -.25 .73407 .425  .0193  .0096  .0404  .0079      0  .0014      0
LaA3   .10733   -.25 .73407  .37  .0193  .0096  .0404  .0079      0  .0014      0
NdA3   .10733   -.25 .73407 .042  .0193  .0096  .0404  .0079      0  .0014      0
PrA3   .10733   -.25 .73407  .01  .0193  .0096  .0404  .0079      0  .0014      0
CaA3   .10733   -.25 .73407 .142  .0193  .0096  .0404  .0079      0  .0014      0
CeA4   .68134   -.25 .26116 .425  .0364  .0042  .1008  .0045      0  .0014      0
LaA4   .68134   -.25 .26116  .37  .0364  .0042  .1008  .0045      0  .0014      0
NdA4   .68134   -.25 .26116 .042  .0364  .0042  .1008  .0045      0  .0014      0
PrA4   .68134   -.25 .26116  .01  .0364  .0042  .1008  .0045      0  .0014      0
CaA4   .68134   -.25 .26116 .142  .0364  .0042  .1008  .0045      0  .0014      0
Mn2+M1 .24991   -.25 .49998  .76  .0075  .0090  .0081  .0048      0  .0002      0
Fe2+M1 .24991   -.25 .49998  .26  .0075  .0090  .0081  .0048      0  .0002      0
TiM2        0      0      0 .895  .0072  .0058  .0124  .0032 -.0066  .0002  .0005
Fe2+M2      0      0      0  .07  .0072  .0058  .0124  .0032 -.0066  .0002  .0005
NbM2        0      0      0  .03  .0072  .0058  .0124  .0032 -.0066  .0002  .0005
MgM2        0      0      0 .005  .0072  .0058  .0124  .0032 -.0066  .0002  .0005
TiM2'      .5      0      0 .895  .0102  .0068  .0198  .0037 -.0095  .0005 -.0009
Fe2+M2'    .5      0      0  .07  .0102  .0068  .0198  .0037 -.0095  .0005 -.0009
NbM2'      .5      0      0  .03  .0102  .0068  .0198  .0037 -.0095  .0005 -.0009
MgM2'      .5      0      0 .005  .0102  .0068  .0198  .0037 -.0095  .0005 -.0009
TiM3   .24994   -.25 .00033 .895  .0094  .0077  .0115  .0082      0  .0001      0
Fe2+M3 .24994   -.25 .00033  .07  .0094  .0077  .0115  .0082      0  .0001      0
NbM3   .24994   -.25 .00033  .03  .0094  .0077  .0115  .0082      0  .0001      0
MgM3   .24994   -.25 .00033 .005  .0094  .0077  .0115  .0082      0  .0001      0
Fe3+M4 .74998   -.25 .00015  .48  .0102  .0086  .0160  .0062      0  .0020      0
Fe2+M4 .74998   -.25 .00015  .25  .0102  .0086  .0160  .0062      0  .0020      0
TiM4   .74998   -.25 .00015  .25  .0102  .0086  .0160  .0062      0  .0020      0
AlM4   .74998   -.25 .00015  .02  .0102  .0086  .0160  .0062      0  .0020      0
Si1     .0504   -.25  .2672       .0046  .0033  .0062  .0038      0 -.0001      0
Si2     .4494   -.25  .7326       .0058  .0052  .0077  .0042      0 -.0002      0
Si3     .8949   -.25  .4537       .0055  .0066  .0070  .0031      0  .0013      0
Si4     .6050   -.25  .5465       .0059  .0072  .0070  .0033      0  .0006      0
O1      .8968   -.25  .9770       .0073   .006   .009   .008      0   .004      0
O2      .7725 -.0035  .1255       .0133   .008   .024   .009   .001   .001  -.004
O3      .5129   -.25  .6231       .0262   .031   .034   .020      0   .022      0
O4      .9368   -.25  .5974       .0062   .006   .008   .003      0  -.001      0
O5      .6052   -.25  .0233        .016   .005   .034   .009      0   .002      0
O6      .6757 -.0250  .5952       .0136   .025   .008   .007   .008   .001  -.002
O7      .9848   -.25  .3749       .0137   .017   .013   .016      0   .015      0
O8      .5211  .0126  .1852       .0189   .021   .030   .005  -.022   .001  -.001
O9      .4023   -.25  .0100       .0066   .004   .003   .012      0  -.001      0
O10     .0200 -.0152  .1850       .0119   .017   .013   .005  -.011   .002   .001
O11     .7273 -.0047  .8741       .0104   .007   .017   .007   .004   .001   .002
O12     .5632   -.25  .4023       .0152   .013   .025   .007      0   .001      0
O13     .3327   -.25  .6778       .0046   .003   .003   .007      0  -.003      0
O14     .0989   -.25 -.0099       .0093   .007   .007   .014      0   .002      0
O15     .1689   -.25  .3205       .0096   .012   .009   .006      0  -.003      0
O16     .1739  .0261  .5960       .0284   .029   .045   .010   .028  -.001   .003
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Lammerite-beta
 
Starova G L, Vergasova L P, Filatov S K, Britvin S N, Ananyev V V
 
Zapiski Rossiiskogo Mineralogicheskogo Obshchetstva 140 (2011) 46-51
Lammerite-beta, Cu3(AsO4)2 - a new mineral from fumaroles of the Great
Fissure Tolbachic eruption (Kamchatka, Russia)
Locality: Second cinder cone, North Branch, Tolbach volcano, Kamchatka, Russia
_database_code_amcsd 0018801
6.306 8.643 11.310 90 92.26 90 P2_1/c
atom      x      y     z Uiso
Cu1   .2429  .1645 .6322 .010
Cu2  -.0925  .1900 .4316 .008
Cu3  -.6172  .0312 .1225 .011
As1  -.5861  .1137 .3681 .005
As2  -.1040  .0603 .1509 .006
O1   -.0411  .2404 .1044 .009
O2   -.5177 -.0717 .3641 .012
O3   -.3970  .2394 .4177 .009
O4   -.6597  .1556 .2262 .010
O5    .0840 -.0689 .1188 .010
O6   -.1287  .0510 .2983 .010
O7   -.3289 -.0022 .0835 .011
O8    .2031  .1304 .4554 .013
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Vigrishinite
 
Pekov I V, Britvin S N, Zubkova N V, Chukanov N V, Bryzfalov I A, Lykova I S,
Belakovskiy D I, Pushcharovsky D Y
 
Zapiski Rossiiskogo Mineralogicheskogo Obshchetstva 141(4) (2012) 12-27
Vigrishinite, Zn2Ti4-xSi4O14(OH,H2O,[_])8, a new mineral from Lovozero
alkaline massif (Kola Peninsula, Russia)
Locality: Lovozero alkaline massif, Kola Peninsula, Russia
_database_code_amcsd 0020035
8.743 8.698 11.581 91.54 98.29 105.65 P-1
atom       x      y     z occ  Uiso
Ti1    .1973 -.0235 .2789 .53 .0452
Nb1    .1973 -.0235 .2789 .20 .0452
Zr1    .1973 -.0235 .2789 .06 .0452
Ti2    .3368  .4848 .7294 .53 .0472
Nb2    .3368  .4848 .7294 .21 .0472
Zr2    .3368  .4848 .7294 .06 .0472
Ti3    .6867  .0861 .9854     .0495
Ti4    .8032  .4496 .0057 .60 .0332
Fe4    .8032  .4496 .0057 .18 .0332
Zn1    .5711  .2556 .7149 .90 .0451
Zn2       .5      0    .5 .26 .0384
Mg2       .5      0    .5 .14 .0384
MnB1   .4295  .3169 .9933 .22  .056
KB2    .0494   .135 .0152 .08  .033
BaB2   .0494   .135 .0152 .02  .033
ZnB3    .019   .171  .288 .05  .017
Zn3'   -.085   .252  .284 .03  .032
NaA1    .069   .421 .5051 .23  .049
CaA1    .069   .421 .5051 .06  .049
ZnA2   .2890  .2303 .4893 .20 .0374
Si1    .4245  .8867 .7588     .0422
Si2    .2603  .3751 .2310     .0443
Si3    .0484  .5854 .2453     .0432
Si4    .2093  .0921 .7726     .0438
O1      .231  -.002 .4612 .91  .065
O2     .1198  .4333 .2844      .052
O3     .2547  .2028 .2794      .053
O4     .1888 -.0422 .1163      .055
O5    -.0249 -.0692 .2771      .052
O6     .8067  .2584 .7058      .045
O7     .3890  .7024 .7161      .059
O8     .2543  .9332 .7232      .054
O9     .9857  .4239 .8973      .048
O10    .5678  .4922 .7270      .050
O11    .5589  .0084 .6992      .045
O12    .3290  .2491 .7292      .052
O13    .7605 -.0901 .0812      .058
O14    .8402  .2547 .0802      .048
O15    .5227  .2429 .5299 .78  .046
O16    .1109  .4325 .6922      .052
O17    .7755  .6244 .9128      .060
O18    .5196  .0791 .0982      .044
O19    .6412  .2732 .9098      .051
O20    .3299  .5067 .8903 .84  .044
O21     .319  .4586 .5445 .78  .046
Wat22   .012   .233  .474  .4  .066
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Total number of retrieved datasets: 26
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