American Mineralogist Crystal Structure Database

23 matching records for this search.

Yusupovite
 
Agakhanov A A, Pautov L A, Karpenko V Y, Sokolova E, Abdu Y A, Hawthorne F C,
Pekov I V, Siidra O I
 
American Mineralogist 100 (2015) 1502-1508
Yusupovite, Na2Zr(Si6O15)(H2O)3, a new mineral species from the Darai-Pioz alkaline
massif and its implications as a new microporous filter for large ions
Locality: Darai-Pioz alkaline massif, Tajikistan
_database_code_amcsd 0020332
14.5975 14.1100 14.4394 90 90.0399 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)
Zr1      .25    .25     .5  .82 .00751 .00725 .00838 .00689  .00023 -.00024 -.00052
Y1       .25    .25     .5  .16 .00751 .00725 .00838 .00689  .00023 -.00024 -.00052
Hf1      .25    .25     .5  .02 .00751 .00725 .00838 .00689  .00023 -.00024 -.00052
Nb1      .25    .25     .5  .04 .00751 .00725 .00838 .00689  .00023 -.00024 -.00052
Zr2      .25    .25      0  .82 .00762 .00717 .00861 .00707 -.00039 -.00020 -.00066
Y2       .25    .25      0  .18 .00762 .00717 .00861 .00707 -.00039 -.00020 -.00066
Na1   .26322 .24852 .75107  .95  .0348  .0149  .0579  .0316  -.0004  -.0015   .0113
Na2    .2658      0  .9641  .84  .0421  .0508  .0182  .0571       0  -.0361       0
Na3    .2289      0  .4604  .78  .0532   .067  .0198   .072       0    .052       0
Si1   .40226 .10964 .12184      .01024  .0117  .0082  .0109  -.0010  -.0016   .0003
Si2   .09773 .10957 .62292      .01015  .0118  .0082  .0105   .0012   .0010   .0003
Si3   .11967 .11179 .83638      .01068  .0130  .0071  .0119   .0002  -.0035  -.0005
Si4   .37685 .11193 .33527      .01102  .0138  .0073  .0120  -.0002   .0036  -.0007
Si5   .04951 .23600 .14315      .01065  .0087  .0125  .0108   .0014   .0012   .0005
Si6   .45223 .23339 .64091      .01080  .0088  .0129  .0107  -.0018  -.0014   .0000
Cs1    .1546      0  .1072  .06  .0400   .035  .0176   .067       0    .004       0
K1     .1546      0  .1072  .06  .0400   .035  .0176   .067       0    .004       0
K2     .1454      0  .3871  .10  .0562  .0294  .0308   .108       0   .0073       0
Cs2    .1454      0  .3871  .08  .0562  .0294  .0308   .108       0   .0073       0
Cs3    .3490      0  .5975  .08  .0570   .052   .038   .081       0   -.004       0
K3     .3490      0  .5975  .08  .0570   .052   .038   .081       0   -.004       0
O1    .42304 .24713 .74887       .0221  .0177  .0377  .0108  -.0004  -.0004  -.0013
O2     .1271      0  .8578       .0206  .0290  .0059  .0271       0  -.0071       0
O3    .32442 .13087 .04805       .0169  .0172  .0170  .0163  -.0005  -.0057   .0007
O4    .14180 .21603 .08931       .0187  .0145  .0212  .0206   .0050   .0061   .0006
O5    .36157 .21273 .58484       .0202  .0153  .0245  .0208  -.0056  -.0075   .0004
O6     .3689      0  .3565       .0216  .0307  .0065  .0277       0   .0054       0
O7     .4357      0  .1189       .0200  .0214  .0074  .0312       0  -.0025       0
O8   -.00603 .32790 .10747       .0195  .0175  .0179  .0232   .0072   .0009   .0022
O9    .01651 .14345 .86301       .0216  .0160  .0168  .0321   .0040   .0023   .0006
O10   .17591 .13037 .54935       .0173  .0179  .0177  .0162  -.0002   .0041   .0004
O11    .0636      0  .6197       .0196  .0213  .0083  .0292       0   .0006       0
O12   .50610 .32775 .60866       .0199  .0176  .0176  .0245  -.0073  -.0015   .0015
O13   .52078 .14284 .63442       .0219  .0181  .0186  .0289   .0048  -.0030  -.0017
O14   .36265 .13228 .22537       .0206  .0251  .0252  .0117   .0033   .0019  -.0001
O15   .13732 .13192 .72676       .0207  .0266  .0237  .0117  -.0026  -.0021  -.0009
O16   .19624 .16703 .89243       .0191  .0211  .0163  .0199  -.0037  -.0082  -.0029
O17   .29891 .16735 .38874       .0202  .0228  .0157  .0221   .0039   .0093  -.0022
Wat1   .5181      0  .4851  .50   .050
Wat2   .3534  .0249  .8096  .42   .050
Wat3   .3552      0  .8995  .50   .050
Wat4   .1438      0  .3120  .78   .050
Wat5   .3556      0  .8599  .48   .050
Wat6   .1386      0  .0774  .84   .050
Wat7       0      0      0  .28   .050
Wat8   .3708      0  .5575  .40   .050
Wat9   .3338      0  .6338  .36   .050
Wat10   .173   .017   .156  .10   .050
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Telyushenkoite
 
Sokolova E V, Huminicki D M C, Hawthorne F C, Agakhanov A A, Pautov L A, Grew E S
Download cm/vol40/CM40_183.pdf
The Canadian Mineralogist 40 (2002) 183-192
The crystal chemistry of telyushenkoite and leifite, A Na6[Be2Al3Si15O39F2],
A = Cs, Na
_database_code_amcsd 0005761
14.3770 14.3770 4.8786 90 90 120 P-3m1
atom      x       y     z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
SiT1      0  .21677   1/2 .61 .0129  .0137  .0143  .0105  .0068 -.0015 -.0007
AlT1      0  .21677   1/2 .34 .0129  .0137  .0143  .0105  .0068 -.0015 -.0007
ZnT1      0  .21677   1/2 .05 .0129  .0137  .0143  .0105  .0068 -.0015 -.0007
SiT2      0  .34441     0     .0105  .0117  .0106  .0096  .0058 -.0004 -.0002
SiT3 .44759 -.44759 .3068     .0078  .0092  .0092  .0074  .0063 -.0002  .0002
BeT4    1/3     2/3  .367     .0083  .0082  .0082  .0086  .0041      0      0
Na   .75039 -.75039 .2029     .0212  .0213  .0213  .0161  .0072  .0033 -.0033
CsA       0       0     0 .74 .0275  .0312  .0312  .0200  .0156      0      0
RbA       0       0     0 .02 .0275  .0312  .0312  .0200  .0156      0      0
KA        0       0     0 .14 .0275  .0312  .0312  .0200  .0156      0      0
NaA       0       0     0 .10 .0275  .0312  .0312  .0200  .0156      0      0
O1    .1009  -.1009 .3920     .0340  .0349  .0349  .0200  .0084 -.0067  .0067
O2    .3081   .2612 .2473     .0193  .0229  .0160  .0187  .0097  .0089  .0075
O3    .3597   .4585 .1047     .0127  .0144  .0112  .0135  .0072 -.0038 -.0030
O4      1/2       0   1/2     .0145  .0186  .0082  .0132  .0041 -.0019 -.0038
O5   .39440 -.39440 .4825     .0107  .0141  .0141  .0085  .0106  .0006 -.0006
F       1/3     2/3 .0438     .0136  .0175  .0175  .0058  .0088      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Leifite
Download hom/leifite.pdf
Sokolova E V, Huminicki D M C, Hawthorne F C, Agakhanov A A, Pautov L A, Grew E S
Download cm/vol40/CM40_183.pdf
The Canadian Mineralogist 40 (2002) 183-192
The crystal chemistry of telyushenkoite and leifite, A Na6[Be2Al3Si15O39F2],
A = Cs, Na
_database_code_amcsd 0005762
14.3608 14.3608 4.8570 90 90 120 P-3m1
atom      x       y     z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
SiT1      0  .21681   1/2 .64 .0137  .0141  .0145  .0123  .0070 -.0020 -.0010
AlT1      0  .21681   1/2 .33 .0137  .0141  .0145  .0123  .0070 -.0020 -.0010
ZnT1      0  .21681   1/2 .03 .0137  .0141  .0145  .0123  .0070 -.0020 -.0010
SiT2      0  .34443     0     .0113  .0120  .0113  .0108  .0060 -.0003 -.0002
SiT3 .44762 -.44762 .3059     .0075  .0093  .0093  .0062  .0062 -.0001  .0001
BeT4    1/3     2/3  .366     .0091  .0091  .0091  .0092  .0045      0      0
Na   .75042 -.75042 .2033     .0214  .0212  .0212  .0165  .0066  .0030 -.0031
CsA       0       0     0 .05 .0444  .0495  .0495  .0343  .0247      0      0
RbA       0       0     0 .11 .0444  .0495  .0495  .0343  .0247      0      0
KA        0       0     0 .10 .0444  .0495  .0495  .0343  .0247      0      0
NaA       0       0     0 .57 .0444  .0495  .0495  .0343  .0247      0      0
WatB      0       0   1/2 .63 .0297  .0119  .0119  .0653  .0060      0      0
O1    .1008  -.1008 .3946     .0325  .0328  .0328  .0190  .0067 -.0063  .0063
O2    .3078   .2614 .2486     .0178  .0201  .0156  .0181  .0094  .0080  .0068
O3    .3595   .4585 .1035     .0124  .0138  .0111  .0132  .0069 -.0042 -.0033
O4      1/2       0   1/2     .0133  .0165  .0092  .0116  .0046 -.0017 -.0034
O5   .39431 -.39431 .4821     .0105  .0137  .0137  .0084  .0099  .0006 -.0005
F       1/3     2/3 .0421     .0136  .0167  .0167  .0073  .0084      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Moskvinite-(Y)
 
Sokolova E V, Hawthorne F C, Agakhanov A A, Pautov L A
Download cm/vol41/CM41_513.pdf
The Canadian Mineralogist 41 (2003) 513-520
The crystal structure of moskvinite-(Y), Na2K(Y,REE)[Si6O15], a new silicate
mineral with [Si6O15] three-membered double-rings from the Dara-I-Pioz Moraine,
Tien-Shan mountains, Tajikistan
Locality: Dara-I-Pioz Moraine, Tien-Shan mountains, Tajikistan
_database_code_amcsd 0005835
10.623 14.970 8.553 90 90 90 Ibmm
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       1/2 .25636       0      .0178  .0168  .0167  .0197       0  .0051      0
K     .43056      0     1/4      .0254  .0234  .0373  .0154       0      0      0
Y        1/4    1/4     1/4 .77 .00679 .00714 .00699 .00624 -.00077      0      0
Dy       1/4    1/4     1/4 .09 .00679 .00714 .00699 .00624 -.00077      0      0
Gd       1/4    1/4     1/4 .04 .00679 .00714 .00699 .00624 -.00077      0      0
Er       1/4    1/4     1/4 .04 .00679 .00714 .00699 .00624 -.00077      0      0
Ho       1/4    1/4     1/4 .02 .00679 .00714 .00699 .00624 -.00077      0      0
Sm       1/4    1/4     1/4 .02 .00679 .00714 .00699 .00624 -.00077      0      0
Nd       1/4    1/4     1/4 .01 .00679 .00714 .00699 .00624 -.00077      0      0
Tb       1/4    1/4     1/4 .01 .00679 .00714 .00699 .00624 -.00077      0      0
Si1   .53384 .40003     1/4     .00943  .0083  .0093  .0108  -.0013      0      0
Si2   .22002 .39603 -.07776     .00934  .0100  .0091  .0089  .00008 .00047 .00111
O1    .15917 .37118    -1/4      .0138  .0116  .0192  .0107  -.0025      0      0
O2    .43311 .32256     1/4      .0129  .0109  .0123  .0154  -.0038      0      0
O3    .37260 .38915 -.09771      .0129  .0101  .0173  .0114   .0000  .0003  .0011
O4    .18101    1/2  -.0448      .0155  .0170  .0086  .0211       0  .0034      0
O5    .16655 .33667  .05854      .0136  .0139  .0143  .0127  -.0012 -.0010  .0050
O6     .4751    1/2     1/4      .0140  .0139  .0097  .0184       0      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Maleevite
 
Pautov L A, Agakhanov A A, Sokolova E V, Hawthorne F C
Download cm/vol42/CM42_107.pdf
The Canadian Mineralogist 42 (2004) 107-119
Maleevite, BaB2Si2O8, and pekovite, SrB2Si2O8, new mineral species from the
Dara-i-Pioz alkaline massif, Northern Tajikistan: Description and crystal structure
Locality: Dara-i-Pioz alkaline massif, Northern Tajikistan
_database_code_amcsd 0005928
8.141 8.176 9.038 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)
BaA  .38853    1/4 .08357 .01211 .01426 .01121 .01087      0 .00045      0
BT1   .2711  .0855  .4117  .0074  .0086  .0073  .0064 -.0002  .0001  .0004
SiT2 .07232 .93355 .18988 .00831  .0093  .0088  .0069 -.0002 -.0001 -.0000
O1    .2181  .9538 .07000  .0123  .0134  .0167  .0068 -.0028  .0029 -.0005
O2    .1458  .9685 .35401  .0110  .0132  .0119  .0077 -.0032 -.0020 -.0002
O3    .4293  .0653  .3369  .0115  .0119  .0114  .0113  .0013  .0021  .0009
O4    .4966    3/4  .3126  .0116  .0123  .0089  .0136      0 -.0008      0
O5    .2083    1/4  .3807  .0101  .0096  .0083  .0126      0 -.0018      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pekovite
 
Pautov L A, Agakhanov A A, Sokolova E V, Hawthorne F C
Download cm/vol42/CM42_107.pdf
The Canadian Mineralogist 42 (2004) 107-119
Maleevite, BaB2Si2O8, and pekovite, SrB2Si2O8, new mineral species from the
Dara-i-Pioz alkaline massif, Northern Tajikistan: Description and crystal structure
Locality: Dara-i-Pioz alkaline massif, Northern Tajikistan
_database_code_amcsd 0005929
8.155 7.919 8.921 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)
SrA  .38756    1/4 .07841 .00898  .0129  .0037  .0103      0 -.0005      0
BT1   .2650  .0808  .4153  .0049  .0083  .0000  .0063 -.0007  .0007 -.0006
SiT2 .06105 .94094 .19163  .0050  .0082  .0006  .0061 -.0002 -.0001 -.0002
O1    .2002  .9833  .0688  .0085  .0137  .0047  .0071 -.0033  .0021 -.0018
O2    .1344  .9637  .3597  .0071  .0114  .0044  .0055 -.0017 -.0012 -.0002
O3    .4103  .0725  .3207  .0075  .0113  .0007  .0106  .0015  .0033 -.0005
O4    .4924    3/4  .3277  .0077  .0127  .0001   .010      0  .0019      0
O5    .1951    1/4  .4127  .0086  .0078  .0046   .013      0  .0026      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Zeravshanite
 
Uvarova Y A, Sokolova E V, Hawthorne F C, Pautov L A, Agakhanov A A
Download cm/vol42/CM42_125.pdf
The Canadian Mineralogist 42 (2004) 125-134
A novel (Si18O45)18- sheet in the crystal structure of zeravshanite,
Cs4Na2Zr3(Si18O45)(H2O)2
_database_code_amcsd 0005930
26.3511 7.5464 22.9769 90 107.237 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)
Na    .25296   .1907 .23718       .0375  .0170  .0481  .0449 -.0042  .0057  .0226
CsA1  .11036  .48491 .31362 .955  .0231  .0222  .0239  .0255  .0027  .0107  .0034
NaA1  .11036  .48491 .31362 .045  .0231  .0222  .0239  .0255  .0027  .0107  .0034
CsA2  .07532  .00166 .50643 .945  .0266  .0219  .0327  .0275  .0009  .0111  .0035
NaA2  .07532  .00166 .50643 .045  .0266  .0219  .0327  .0275  .0009  .0111  .0035
KA2   .07532  .00166 .50643 .010  .0266  .0219  .0327  .0275  .0009  .0111  .0035
ZrM1  .17912 -.00648 .32024 .910  .0089  .0081  .0100  .0084  .0001  .0023 -.0002
TiM1  .17912 -.00648 .32024 .070  .0089  .0081  .0100  .0084  .0001  .0023 -.0002
FeM1  .17912 -.00648 .32024 .020  .0089  .0081  .0100  .0084  .0001  .0023 -.0002
ZrM2       0     1/2    1/2 .910  .0085  .0075  .0095  .0088      0  .0030 -.0004
SnM2       0     1/2    1/2 .040  .0085  .0075  .0095  .0088      0  .0030 -.0004
TiM2       0     1/2    1/2 .050  .0085  .0075  .0095  .0088      0  .0030 -.0004
Si1   .04249 -.00854 .31620       .0097  .0088  .0101  .0103  .0002  .0032 -.0001
Si2  -.00924  .68043 .36302       .0109  .0102  .0103  .0118  .0009  .0027  .0016
Si3   .13751  .49717 .49844       .0101  .0084  .0111  .0107  .0003  .0027 -.0003
Si4   .12536  .78656 .18612       .0113  .0097  .0112  .0121  .0002  .0022 -.0011
Si5   .12873  .17752 .18188       .0117  .0105  .0110  .0125 -.0011  .0016  .0010
Si6  -.01291  .29072 .36739       .0105  .0099  .0102  .0116 -.0006  .0035 -.0016
Si7   .18290  .48317 .13367       .0109  .0101  .0123  .0099 -.0004  .0027 -.0002
Si8   .19452  .19610 .45256       .0115  .0098  .0122  .0122  .0001  .0029 -.0021
Si9   .19345  .80347 .45413       .0121  .0107  .0123  .0127 -.0002  .0027  .0022
O1    .03541   .8041  .3479       .0175  .0136  .0144  .0254 -.0016  .0074  .0071
O2    .00615   .4802  .3470       .0150  .0166  .0111  .0209 -.0006  .0111  .0009
O3    .12111   .9785 .15214       .0164  .0237  .0108  .0123 -.0014  .0018  .0010
O4         0   .0053    1/4       .0202  .0165  .0278  .0132      0 -.0001      0
O5    .02927   .1465  .3589       .0178  .0174  .0167  .0183  .0064  .0037 -.0052
O6    .15326   .2964  .1382       .0190  .0214  .0202  .0155 -.0085  .0056  .0011
O7    .16780   .1764  .2498       .0148  .0138  .0136  .0157 -.0016  .0024 -.0010
O8    .25862  -.0178 .31938       .0157  .0111  .0212  .0136  .0008  .0017  .0001
O9    .06632   .7267  .1860       .0174  .0111  .0233  .0167 -.0043  .0026 -.0029
O10   .16334   .7971  .2546       .0137  .0102  .0145  .0146 -.0007  .0008  .0002
O11   .07111   .2526  .1810       .0178  .0107  .0251  .0153  .0026  .0001  .0017
O12   .10194   .0107  .3144       .0174  .0113  .0209  .0213 -.0004  .0068  .0016
O13   .14828   .6448  .1486       .0233  .0231  .0230  .0228  .0075  .0055 -.0073
O14   .18302   .4936 .56416       .0147  .0125  .0210  .0103  .0018  .0028 -.0013
O15      1/4     3/4    1/2       .0257  .0153  .0327  .0241 -.0008 -.0017  .0132
O16   .14702   .6757  .4639       .0202  .0158  .0188  .0243 -.0028  .0035  .0078
O17   .14826   .3305 .45897       .0185  .0136  .0220  .0174  .0055  .0011 -.0074
O18   .17815   .0013  .4719       .0187  .0283  .0121  .0202 -.0002  .0139  .0004
O19   .19696   .1933 .38368       .0145  .0161  .0150  .0127 -.0006  .0047 -.0009
O20   .19362   .8007  .3848       .0172  .0211  .0147  .0159 -.0006  .0056 -.0001
O21      1/4     1/4    1/2       .0242  .0117  .0345  .0218  .0001 -.0021 -.0099
O22   .07918   .4893  .5036      .01845  .0105  .0251  .0211 -.0004  .0069 -.0013
O23  -.01509   .2945  .4360       .0152  .0189  .0142  .0129 -.0015  .0051  .0001
O24  -.01099   .6938  .4317       .0161  .0212  .0145  .0129  .0015  .0054  .0008
Ow25   .2501  -.0217  .1590       .0885  .0595  .1340  .0700  .0410  .0162 -.0354
H1      .237   -.069   .182      .10615
H2      .261   -.110   .132      .10615
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Turanite
Download hom/turanite.pdf
Sokolova E V, Hawthorne F C, Karpenko V V, Agakhanov A A, Pautov L A
Download cm/vol42/CM42_731.pdf
The Canadian Mineralogist 42 (2004) 731-739
Turanite, Cu5(VO4)2(OH)4, from the Tyuya-Muyun radium-uranium deposit,
Osh Region, Kyrgyzstan: A new structure for an old mineral
Locality: Osh Region, Kyrgyzstan
_database_code_amcsd 0005935
5.3834 6.2736 6.8454 86.169 91.681 92.425 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)
Cu1         0     .5      0 .00884 .00821 .00867 .00937 .00188  .00157  .00302
Cu2   -.00879 .15238 .33553 .00897 .01027 .00822 .00849 .00342  .00262  .00202
Cu3   -.50426 .32074 .17404 .00894 .00786 .00699 .01183 .00053 -.00061  .00012
V     -.56313 .80958 .31396 .00732 .00783 .00639 .00786 .00050  .00104 -.00081
O1      .1473 -.1188  .4007  .0104  .0106  .0099  .0108  .0030   .0039   .0014
O2     -.6197  .6156  .1464  .0101  .0115  .0077  .0114  .0016  -.0002  -.0019
O3     -.6049 -.0228 -.2017  .0106  .0117  .0081  .0120  .0007   .0013   .0002
O4     -.3827  .7093  .4952  .0120  .0148  .0107  .0102  .0004  -.0009  -.0002
O5      .1586  .2236  .0820  .0100  .0097  .0108  .0096  .0016   .0012  -.0000
O6     -.1633  .4229  .2514  .0086  .0088  .0085  .0087  .0003   .0006  -.0006
H1       .193   .119  -.012   .043
H2      -.185   .529   .346 .01037
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Arapovite
 
Uvarova Y A, Sokolova E V, Hawthorne F C, Agakhanov A A, Pautov L A
Download cm/vol42/CM42_1005.pdf
The Canadian Mineralogist 42 (2004) 1005-1011
The crystal structure of arapovite, U4+(Ca,Na)2(K1-x_x)[Si8O20],x~0.5,
a new mineral species of the steacyite group from the Dara-i-Pioz moraine,
Tien-Shan Mountains, Tajikistan
Locality: Dara-i-Pioz moraine, Tien-Shan Mountains, Tajikistan
_database_code_amcsd 0005955
7.5505 7.5505 14.7104 90 90 90 P4/mcc
atom      x     y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U4+A      0     0    .25 .59 .0097  .0071  .0071  .0149      0      0      0
ThA       0     0    .25 .26 .0097  .0071  .0071  .0149      0      0      0
CaA       0     0    .25 .10 .0097  .0071  .0071  .0149      0      0      0
DyA       0     0    .25 .02 .0097  .0071  .0071  .0149      0      0      0
SmA       0     0    .25 .01 .0097  .0071  .0071  .0149      0      0      0
PrA       0     0    .25 .01 .0097  .0071  .0071  .0149      0      0      0
CaB       0    .5    .25 .62 .0141  .0134  .0124  .0165      0      0      0
NaB       0    .5    .25 .34 .0141  .0134  .0124  .0165      0      0      0
NdB       0    .5    .25 .02 .0141  .0134  .0124  .0165      0      0      0
CeB       0    .5    .25 .01 .0141  .0134  .0124  .0165      0      0      0
BaB       0    .5    .25 .01 .0141  .0134  .0124  .0165      0      0      0
KC        0     0      0 .52 .0339  .0288  .0288  .0442      0      0      0
Si    .2594 .3354 .10846     .0107  .0093  .0097  .0132  .0001  .0008  .0001
O1   -.2362 .6845      0     .0229  .0263  .0295  .0129  .0000      0      0
O2    .4538 .2567  .1361     .0172  .0105  .0191  .0221  .0005  .0004  .0036
O3   -.1026 .2508  .3357     .0157  .0130  .0138  .0202 -.0001  .0037 -.0026
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Nickelalumite
 
Uvarova Y A, Sokolova E, Hawthorne F C, Karpenko V V, Agakhanov A A, Pautov L A
Download cm/vol43/CM43_1511.pdf
The Canadian Mineralogist 43 (2005) 1511-1519
The crystal chemistry of the "nickelalumite"-group minerals
_database_code_amcsd 0006062
10.2567 8.8815 17.0989 90 95.548 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)
NiM  .74867 .49993 .49280 .55 .0068  .0026  .0023  .0157 -.0001  .0017 -.0003
ZnM  .74867 .49993 .49280 .39 .0068  .0026  .0023  .0157 -.0001  .0017 -.0003
VM   .74867 .49993 .49280 .02 .0068  .0026  .0023  .0157 -.0001  .0017 -.0003
FeM  .74867 .49993 .49280 .01 .0068  .0026  .0023  .0157 -.0001  .0017 -.0003
Al1   .0001  .3286  .5016     .0081  .0061  .0053  .0128 -.0001  .0004 -.0002
Al2   .5005  .6741  .5045     .0083  .0055  .0054  .0140  .0003  .0006 -.0004
Al3   .2485  .1611  .4976     .0076  .0059  .0032  .0136  .0002  .0014 -.0001
Al4   .2496 -.1606  .5001     .0075  .0057  .0024  .0143 -.0004  .0007 -.0004
S     .4887  .1094  .7406     .0107  .0115  .0112  .0094 -.0005  .0011  .0002
O13   .5242  .0252  .6717     .0186  .0295  .0138  .0132 -.0013  .0056  .0033
O14   .9158  .4892  .2890     .0297  .0403  .0351  .0150  .0223  .0089  .0004
O15   .6095  .1637  .7855     .0212  .0206  .0242  .0171 -.0075 -.0067  .0008
O16   .4075  .2392  .7142     .0241  .0248  .0211  .0257  .0144 -.0003 -.0037
Oh1   .5816  .4971  .5540     .0066  .0052  .0054  .0092  .0016  .0003 -.0020
Oh2   .9219  .4993  .4427     .0078  .0065  .0060  .0104 -.0013 -.0016 -.0008
Oh3   .6497  .3211  .4375     .0072  .0089  .0060  .0065 -.0001 -.0005 -.0002
Oh4   .8473  .3246  .5567     .0073  .0085  .0030  .0099 -.0024 -.0016 -.0017
Oh5   .1068  .1938  .5588     .0100  .0103  .0083  .0120  .0001  .0034  .0022
Oh6   .1820 -.0011  .4376     .0084  .0073  .0072  .0098  .0004 -.0043  .0002
Oh7   .6477  .6824  .4430     .0063  .0051  .0053  .0083 -.0008 -.0006 -.0025
Oh8   .8500  .6749  .5559     .0079  .0079  .0067  .0094 -.0016  .0018  .0026
Oh9  -.1058  .1949  .4421     .0100  .0092  .0085  .0131 -.0012  .0040 -.0048
Oh10  .6104  .8037  .5629     .0099  .0094  .0081  .0126 -.0038  .0028 -.0033
Oh11  .3947 -.1945  .4453     .0097  .0096  .0059  .0140  .0014  .0037  .0037
Oh12  .3126  .0016  .5595     .0079  .0044  .0072  .0110 -.0010 -.0045 -.0005
Ow17 -.1529 -.2224  .2225     .0245  .0223  .0228  .0293  .0011  .0066  .0024
Ow18  .7271  .4018  .6938     .0518  .0623  .0602  .0342 -.0357  .0110 -.0060
Ow19 -.0255  .0065  .3135     .0339  .0446  .0292  .0265 -.0056 -.0035  .0051
H1    -.246  -.208   .228     .0294
H2    -.124  -.318   .247     .0294
H3     .775   .490   .717     .0622
H4     .703   .334   .735     .0622
H5    -.034   .088   .275     .0406
H6    -.061  -.087   .289     .0406
H7     .620   .484   .609      .008
H8     .892   .497   .386     .0094
H9     .648   .317  .3797     .0087
H10    .844   .320  .6140     .0088
H11    .088   .118   .598      .012
H12    .130   .003   .386     .0101
H13    .626   .697   .386     .0076
H14    .865   .678  .6139     .0095
H15   -.087   .118   .403      .012
H16    .596   .874   .606     .0119
H17    .411  -.134   .399     .0116
H18    .371   .011   .609     .0094
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Senkevichite
 
Uvarova Y A, Sokolova E, Hawthorne F C, Agakhanov A A, Pautov L A, Karpenko V Y
Download cm/vol44/CM44_1341.pdf
The Canadian Mineralogist 44 (2006) 1341-1348
The crystal chemistry of senkevichite, CsKNaCa2TiO[Si7O18(OH)], from the
Dara-I-Pioz alkaline massif, northern Tajikistan
Locality: Dara-i-Pioz moraine, Alai ridge, Tien-Shan Mountains, Tajikistan
_database_code_amcsd 0006127
10.4191 12.2408 7.0569 90.857 99.193 91.895 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)
CsA1 .63686 .89743 .77051 .90 .0182  .0157  .0169  .0219 -.0015  .0034 -.0031
KA1  .63686 .89743 .77051 .08 .0182  .0157  .0169  .0219 -.0015  .0034 -.0031
KA2  .55314 .64832  .2707     .0185  .0162  .0230  .0165  .0017  .0025  .0006
Na    .0195  .8883  .3891     .0149  .0143  .0144  .0162  .0038  .0016  .0024
CaM2 .11883 .59094  .9095     .0085  .0075  .0091  .0087  .0001  .0014  .0008
CaM3 .12262 .57715 .40821 .62 .0091  .0081  .0101  .0090  .0004  .0012  .0002
MnM3 .12262 .57715 .40821 .30 .0091  .0081  .0101  .0090  .0004  .0012  .0002
FeM3 .12262 .57715 .40821 .06 .0091  .0081  .0101  .0090  .0004  .0012  .0002
TiM1 .00917 .89850 .89618 .93 .0066  .0061  .0070  .0068 -.0003  .0013  .0004
NbM1 .00917 .89850 .89618 .04 .0066  .0061  .0070  .0068 -.0003  .0013  .0004
Si1   .1318 .30739  .8740     .0062  .0063  .0076  .0046  .0006  .0009     -0
Si2   .1304 .30134  .4266     .0066  .0065  .0083  .0049  .0004  .0007  .0006
Si3  .31497 .41614  .1982     .0067  .0042  .0085  .0072  .0008  .0002  .0009
Si4   .6883 .18824 -.0015     .0080  .0079  .0093  .0068  .0005  .0013 -.0004
Si5   .6952 .19562  .5723     .0097  .0093  .0116  .0080  .0014  .0009  .0013
Si6   .6055 .35742  .2699     .0074  .0063  .0090  .0072  .0013  .0011  .0006
Si7   .7286 .01788  .2834     .0082  .0084  .0085  .0079  .0010  .0020  .0011
O1    .2751  .3433  .9991     .0107  .0077  .0142  .0093 -.0002 -.0008 -.0027
O2    .0833  .1924  .9472     .0129  .0125  .0134  .0138 -.0018  .0053  .0045
O3    .0346  .4055  .8730     .0101  .0089  .0109  .0101  .0020 -.0001  .0004
O4    .1680  .2824  .6601     .0108  .0134  .0151  .0044  .0044  .0023  .0023
O5    .0841  .1844  .3328     .0123  .0138  .0108  .0109 -.0015 -.0013 -.0039
O6    .0312  .3984  .3829     .0113  .0113  .0121  .0110  .0044  .0025  .0016
O7    .2725  .3402  .3698     .0115  .0095  .0139  .0120  .0012  .0041  .0040
O8    .2535  .5326  .1887     .0111  .0099  .0109  .0123  .0037  .0003  .0009
O9    .4738  .4277  .2401     .0100  .0036  .0117  .0145  .0010  .0010  .0002
O10   .5995  .2828  .0741     .0144  .0181  .0176  .0076  .0083  .0014 -.0032
O11   .6480  .0732  .0918     .0115  .0076  .0145  .0118  .0001 -.0008  .0058
O12   .8395  .2177  .0594     .0110  .0087  .0109  .0134 -.0003  .0015 -.0012
O13   .6359  .1776  .7702     .0124  .0119  .0180  .0079  .0005  .0034      0
O14   .8366  .2455  .5958     .0147  .0091  .0173  .0172  .0014  .0004  .0012
O15   .6793  .0749  .4679     .0141  .0174  .0142  .0124  .0004  .0078 -.0009
O16   .5896  .2739  .4448     .0114  .0098  .0143  .0099  .0019  .0007  .0057
O17   .7321  .4346  .3090     .0119  .0050  .0159  .0145 -.0025  .0015  .0007
O18   .6737  .8920  .2783     .0180  .0111  .0130  .0297  .0008  .0023  .0014
O19   .8822  .0310  .2909     .0104  .0077  .0133  .0106  .0014  .0021  .0003
O20   .9025  .0144  .8809     .0087  .0058  .0096  .0106  .0006  .0010 -.0002
H      .738   .844   .298     .0216
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Faizievite
 
Uvarova Yu A, Sokolova E, Hawthorne F C, Agakhanov A A, Pautov L A
Download cm/vol46/CM46_163.pdf
The Canadian Mineralogist 46 (2008) 163-171
The crystal chemistry of faizievite, K2Li6Na(Ca6Na)Ti4[Si6O18]2[Si12O30]F2,
a novel structure based on intercalated blocks of the baratovite and
berezanskite structures
Locality: Dara-i-Poiz glacier, Alai mountain ridge, Tien-Shan Mountains, Tajikistan
_database_code_amcsd 0006162
9.8156 9.8249 17.3087 99.209 94.670 119.839 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)
Li1   .0806  .1015  .2129      .0114  .0018  .0144  .0245  .0073  .0041  .0092
Li2  -.4128 -.3992  .2143      .0128  .0103  .0127  .0093  .0013  .0075  .0008
Li3  -.4225  .0952  .2119      .0140  .0200  .0119  .0193  .0133  .0049  .0089
KA1   .9146  .3924  .7745 .965 .0249  .0199  .0228  .0342  .0121  .0065  .0081
BaA1  .9146  .3924  .7745 .020 .0249  .0199  .0228  .0342  .0121  .0065  .0081
RbA1  .9146  .3924  .7745 .015 .0249  .0199  .0228  .0342  .0121  .0065  .0081
NaA2  .3337  .1676  .0032  .86 .0350
CaM1  .2884  .3543 .49983      .0074  .0072  .0075  .0091  .0047  00026  .0025
CaM2  .1489  .9347 .51649 .935 .0084  .0059  .0075  .0116  .0032  .0016  .0024
SrM2  .1489  .9347 .51649 .065 .0084  .0059  .0075  .0116  .0032  .0016  .0024
CaM3  .4259  .7867 .50910  .78 .0090  .0076  .0094  .0103  .0050  .0015  .0008
NaM3  .4259  .7867 .50910  .20 .0090  .0076  .0094  .0103  .0050  .0015  .0008
SrM3  .4259  .7867 .50910  .02 .0090  .0076  .0094  .0103  .0050  .0015  .0008
CaM4      0     .5     .5  .73 .0110  .0084  .0098  .0150  .0057  .0012  .0003
NaM4      0     .5     .5  .27 .0110  .0084  .0098  .0150  .0057  .0012  .0003
Ti1   .4153  .2695 .21637      .0024  .0019  .0026  .0028  .0014 -.0000  .0006
Ti2  -.2525 -.0651 .21454      .0033  .0019  .0032  .0051  .0016  .0005  .0012
Si1   .7618  .4199  .3383      .0062  .0058  .0057  .0068  .0039 -.0010 -.0013
Si2   .5077  .0979  .6625      .0058  .0069  .0066  .0073  .0055  .0027  .0022
Si3   .3974  .6639  .0932      .0066  .0067  .0070  .0066  .0041 -.0009  .0014
Si4   .3730  .5384  .3392      .0059  .0055  .0039  .0080  .0024  .0019  .0008
Si5   .1552  .3031  .0932      .0068  .0056  .0081  .0070  .0033  .0005  .0033
Si6   .2516  .0291  .3403      .0061  .0054  .0061  .0078  .0034  .0019  .0024
Si7   .6721  .4225  .0924      .0068  .0082  .0065  .0067  .0043  .0029  .0014
Si8  -.1130 -.2157  .3392      .0058  .0047  .0050  .0075  .0020  .0019  .0021
Si9   .2757 -.0953  .0935      .0073  .0073  .0082  .0065  .0049  .0000 -.0009
Si10  .0089  .2956  .3378      .0062  .0036  .0073  .0072  .0029  .0010  .0000
Si11 -.2075  .1811  .0921      .0066  .0069  .0083  .0066  .0052  .0015  .0022
Si12  .9132  .7840  .0925      .0069  .0062  .0066  .0061  .0026  .0018 -.0010
O1    .5993  .2869  .2751      .0090  .0030  .0091  .0136  .0025 -.0016  .0032
O2    .4539  .4686  .2789      .0091  .0095  .0078  .0118  .0058  .0057  .0008
O3   -.2345 -.1966  .2795      .0095  .0051  .0077  .0144  .0018 -.0014  .0066
O4   -.0649  .1255  .2744      .0094  .0044  .0064  .0131  .0015 -.0005 -.0027
O5    .2723  .1450  .2796      .0086  .0098  .0115  .0094  .0078  .0050  .0059
O6    .2231  .2278  .1483      .0092  .0102  .0088  .0108  .0049  .0029  .0074
O7    .5431  .4017  .1463      .0106  .0135  .0089  .0102  .0067  .0037  .0003
O8    .3966  .0783  .1480      .0086  .0044  .0044  .0124 -.0001 -.0007 -.0007
O9   -.3883 -.0281  .2761      .0078  .0069  .0091  .0134  .0062  .0081  .0075
O10  -.1101 -.0857  .1469      .0108  .0081  .0124  .0127  .0066  .0027 -.0000
O11  -.2932  .0562  .1451      .0114  .0110  .0092  .0167  .0061  .0059  .0053
O12  -.4335 -.2676  .1475      .0101  .0063  .0057  .0154  .0019 -.0031  .0014
O13   .2609  .5686  .5708      .0144  .0158  .0148  .0096  .0056  .0015  .0043
O14   .8321  .5950  .3150      .0108  .0110  .0059  .0163  .0035  .0053  .0065
O15   .8994  .3758  .3251      .0147  .0125  .0155  .0267  .0139  .0050  .0083
O16   .4194  .0216  .5713      .0130  .0132  .0171  .0092  .0087  .0024  .0012
O17   .6479  .0575  .6820      .0099  .0114  .0138  .0134  .0120  .0070  .0042
O18   .5990  .2941  .6817      .0124  .0132  .0056  .0185  .0048  .0018  .0041
O19   .4104  .6381  .0001      .0227  .0239  .0296  .0086  .0116 -.0010 -.0004
O20   .2677  .4966  .1122      .0168  .0126  .0068  .0274  .0014  .0002  .0092
O21   .3270  .7810  .1134      .0164  .0162  .0113  .0207  .0081 -.0002 -.0006
O22   .4401  .5655  .4314      .0142  .0195  .0168  .0085  .0115  .0020  .0013
O23   .1791  .4189  .3157      .0094  .0013  .0096  .0141  .0006  .0020  .0023
O24   .1387  .2279  .0002      .0216  .0329  .0350  .0043  .0235  .0029  .0024
O25  -.0152  .2697  .1116      .0176  .0117  .0242  .0223  .0130  .0037  .0059
O26   .3022  .1221  .4326      .0119  .0102  .0133  .0118  .0073 -.0008 -.0005
O27   .0658 -.1211  .3186      .0120  .0057  .0102  .0178  .0024  .0036  .0029
O28   .8145  .6089  .1118      .0174  .0158  .0104  .0240  .0038  .0087  .0072
O29   .7594  .3259  .1120      .0180  .0213  .0202  .0281  .0189  .0131  .0121
O30   .0962 -.1685  .1119      .0182  .0080  .0174  .0259  .0055  .0040 -.0002
O31   .1125  .1578  .5684      .0115  .0148  .0153  .0054  .0085  .0025  .0025
O32   .2714 -.0902  .0009      .0228  .0304  .0214  .0071  .0086 -.0011 -.0012
O33   .0306  .2819  .4280      .0139  .0155  .0137  .0104  .0056  .0004  .0050
F     .1739  .7233  .4533 .815 .0209  .0195  .0243  .0202  .0130  .0039  .0029
O     .1739  .7233  .4533 .185 .0209  .0195  .0243  .0202  .0130  .0039  .0029
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Nalivkinite
 
Uvarova Y A, Sokolova E, Hawthorne F C, Agakhanov A A, Pautov L A
Download cm/vol46/CM46_651.pdf
The Canadian Mineralogist 46 (2008) 651-659
The crystal structure of nalivkinite, a new lithium member of the astrophyllite group
Locality: Tien-Shan Mountains, northern Tajikistan
_database_code_amcsd 0006189
5.3745 11.9299 11.6509 113.325 94.524 103.080 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)
FeM1  .8490  .2053 .4796 .855 .0081  .0078  .0065  .0125  .0029  .0032  .0058
CaM1  .8490  .2053 .4796 .035 .0081  .0078  .0065  .0125  .0029  .0032  .0058
PbM1  .8490  .2053 .4796 .010 .0081  .0078  .0065  .0125  .0029  .0032  .0058
FeM2  .2804 .06734 .4895      .0075  .0066  .0065  .0127  .0028  .0035  .0068
FeM3  .4225 .35177 .4848 .550 .0076  .0072  .0055  .0135  .0035  .0038  .0061
MnM3  .4225 .35177 .4848 .450 .0076  .0072  .0055  .0135  .0035  .0038  .0061
FeM4      0     .5    .5 .830 .0073  .0059  .0047  .0131  .0023  .0024  .0052
SnM4      0     .5    .5 .090 .0073  .0059  .0047  .0131  .0023  .0024  .0052
MgM4      0     .5    .5 .040 .0073  .0059  .0047  .0131  .0023  .0024  .0052
ZnM4      0     .5    .5 .040 .0073  .0059  .0047  .0131  .0023  .0024  .0052
TiD   .0781  .0856 .1976 .780 .0105  .0066  .0087  .0191  .0043  .0038  .0074
NbD   .0781  .0856 .1976 .120 .0105  .0066  .0087  .0191  .0043  .0038  .0074
ZrD   .0781  .0856 .1976 .080 .0105  .0066  .0087  .0191  .0043  .0038  .0074
TaD   .0781  .0856 .1976 .020 .0105  .0066  .0087  .0191  .0043  .0038  .0074
SiT1  .6767  .2703 .2308 .981 .0077  .0059  .0104  .0121  .0037  .0035  .0091
AlT1  .6767  .2703 .2308 .019 .0077  .0059  .0104  .0121  .0037  .0035  .0091
SiT2  .8144  .5467 .2564 .981 .0081  .0081  .0060  .0127  .0024  .0021  .0061
AlT2  .8144  .5467 .2564 .019 .0081  .0081  .0060  .0127  .0024  .0021  .0061
SiT3  .3802  .6767 .2584 .981 .0059  .0061  .0041  .0094  .0019  .0017  .0046
AlT3  .3802  .6767 .2584 .019 .0059  .0061  .0041  .0094  .0019  .0017  .0046
SiT4  .5049  .9309 .2347 .981 .0074  .0078  .0060  .0113  .0029  .0019  .0061
AlT4  .5049  .9309 .2347 .019 .0074  .0078  .0060  .0113  .0029  .0019  .0061
KA1a  .1464  .2860 .9977 .375 .0290  .0186  .0589  .0000  .0117  .0008  .0028
LiA1a .1464  .2860 .9977 .070 .0290  .0186  .0589  .0000  .0117  .0008  .0028
CsA1a .1464  .2860 .9977 .045 .0290  .0186  .0589  .0000  .0117  .0008  .0028
NaA1a .1464  .2860 .9977 .010 .0290  .0186  .0589  .0000  .0117  .0008  .0028
LiA1b  .087   .177 -.000 .500 .0290  .0186  .0589  .0000  .0117  .0008  .0028
NaB      .5      0     0 .780 .0074  .0119  .0082  .0037  .0041  .0013  .0036
CaB      .5      0     0 .220 .0074  .0119  .0082  .0037  .0041  .0013  .0036
O1    .7252  .3158 .3840      .0074  .0092  .0092  .0067  .0037  .0020  .0058
O2    .1462  .1600 .3723      .0076  .0105  .0063  .0053  .0029  .0008  .0015
O3    .1261  .3895 .5902      .0073  .0049  .0046  .0136  .0013  .0016  .0049
O4    .2998  .4626 .4003      .0093  .0125  .0065  .0121  .0048  .0029  .0059
O5    .9913  .1171 .5917      .0093  .0096  .0085  .0137  .0044  .0050  .0071
O6    .5571  .2554 .5872      .0070  .0064  .0090  .0100  .0035  .0029  .0076
O7    .5730  .0162 .3885      .0080  .0090  .0060  .0115  .0030  .0019  .0057
O8    .0749  .5898 .2025      .0159  .0132  .0177  .0149  .0010  .0043  .0067
O9    .2491  .0421 .8303      .0226  .0183  .0219  .0184 -.0048  .0080  .0041
O10   .4273  .4131 .7972      .0147  .0169  .0173  .0126  .0107  .0029  .0059
O11   .1266  .8075 .8317      .0230  .0297  .0312  .0206  .0243  .0105  .0140
O12   .2610  .9557 .1696      .0221  .0286  .0204  .0167  .0191 -.0029  .0021
O13   .2706  .6062 .8033      .0180  .0278  .0099  .0186  .0048  .0042  .0086
O14   .5742  .2211 .8002      .0188  .0312  .0105  .0176  .0050  .0041  .0093
O15   .3820  .1889 .1664      .0206  .0135  .0305  .0123 -.0081 -.0028  .0123
F         0      0     0      .0174  .0177  .0149  .0211  .0052  .0022  .0091
H1      .21   .416  .309      .0112
H2      .05   .167  .686      .0112
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Niveolanite
 
Pekov I V, Zubkova N V, Chukanov N V, Agakhanov A A, Belakovskiy D I, Horvath L,
Filinchuk Y E, Gobechiya E R, Pushcharovsky D Y, Rabadanov M K
Download cm/vol46/CM46_1343.pdf
The Canadian Mineralogist 46 (2008) 1343-1354
Niveolanite, the first natural beryllium carbonate, a new mineral species from
Mont Saint-Hilaire, Quebec, Canada
Locality: Poudrette quarry, Mont Saint-Hilaire, Quebec, Canada
_database_code_amcsd 0006196
13.1304 13.1304 5.4189 90 90 90 P4/mcc
atom      x      y     z occ  Uiso
Na   .41084 .10533    .5  .9 .0283
Ca   .41084 .10533    .5 .09 .0283
Be   .84477 .15523   .25     .0140
C     .6772  .1176    .5     .0176
O1   .72297 .13374 .7073     .0262
O2   .58599  .0851    .5     .0307
O3   .90044 .11618    .5 .08 .0134
O3H  .90044 .11618    .5 .92 .0134
H      .959   .124    .5 .92  .024
Wat   .4249  .2935    .5      .243
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Londonite
Download hom/londonite.pdf
Pekov I V, Yakubovich O V, Massa W, Chukanov N V, Kononkova N N,
Agakhanov A A, Karpenko V Y
 
The Canadian Mineralogist 48 (2010) 241-254
Londonite from the Urals, and new aspects of the crystal chemistry
of the rhodozite-londonite series,
Locality: Ministerskaya Yama Pit, Sarapulka pegmatite field, Russia
Note: sample FMM-32135
_database_code_amcsd 0006327
7.3149 7.3149 7.3149 90 90 90 P-43m
atom      x      y      z  occ  Uiso
Cs       .5     .5     .5 .553 .0146
K      .460   .460   .460 .083 .0146
Al   .85964 .85964 .85964      .0032
B        .5  .7482      0  .90 .0029
Be'      .5  .7482      0  .10 .0029
Be    .2415  .7585  .7585  .91 .0050
O1    .1185  .8815  .8815      .0040
O2    .5995 .86343 .86343      .0033
O3   .36488 .63512  .9004      .0040
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Kirchhoffite
 
Agakhanov A A, Pautov L A, Karpenko V Y, Sokolova E, Hawthorne F C
 
The Canadian Mineralogist 50 (2012) 523-529
Kirchhoffite, CsBSi2O6, a new mineral species from the
Darai-Pioz Alkaline Massif,Tajikistan: Description and crystal structure
Locality: Upper Dara-Pioz alkaline massif, Garm district, Tajikistan
_database_code_amcsd 0019219
13.019 13.019 12.899 90 90 90 *I4_1/acd
0 -.25 .125
atom      x      y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3)  U(2,3)
Cs   .12323 .37323   .125 .0193  .0201  .0201  .0176 -.0009 .00231 -.00231
B     .3362  .5862   .125 .0080   .010   .010   .004  -.005   .003   -.003
Si   .09119 .11581 .33656 .0088  .0096  .0073  .0094  .0005  .0002  -.0012
O1    .1296  .1468  .0363 .0164   .020   .015   .015  .0016 -.0009   .0034
O2    .1382  .2191  .3900 .0181   .023   .010   .021 -.0008  -.002  -.0054
O3    .2740  .1018  .1448 .0151   .011   .021   .013 -.0045 -.0017   .0029
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Carlgieseckeite-(Nd)
 
Pekov I V, Zubkova N V, Husdal T A, Kononkova N N, Agakhanov A A, Zadov A E, Pushcharovsky D Y
 
The Canadian Mineralogist 50 (2012) 571-580
Carlgieseckeite-(Nd), NaNdCa3(PO4)3F, a new belovite-group mineral species from
the Ilimaussaq alkaline complex, South Greenland
Locality: the Ilimaussaq alkaline complex, South Greenland
_database_code_amcsd 0019705
9.4553 9.4553 6.9825 90 90 120 P-3
atom      x       y      z occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
NaM1'   1/3     2/3  .0163      .0179  .0207  .0207  .0123  .0104      0      0
CaM2 .23744 -.01473 .24062 .70 .01273  .0156 .01279 .01046 .00760 .00032 .00062
NaM2 .23744 -.01473 .24062 .06 .01273  .0156 .01279 .01046 .00760 .00032 .00062
SrM2 .23744 -.01473 .24062 .15 .01273  .0156 .01279 .01046 .00760 .00032 .00062
BaM2 .23744 -.01473 .24062 .01 .01273  .0156 .01279 .01046 .00760 .00032 .00062
NdM1    1/3     2/3 .51466 .57 .00955 .01023 .01023 .00819 .00511      0      0
LaM1    1/3     2/3 .51466 .05 .00955 .01023 .01023 .00819 .00511      0      0
CeM1    1/3     2/3 .51466 .41 .00955 .01023 .01023 .00819 .00511      0      0
PrM1    1/3     2/3 .51466 .10 .00955 .01023 .01023 .00819 .00511      0      0
SmM1    1/3     2/3 .51466 .11 .00955 .01023 .01023 .00819 .00511      0      0
GdM1    1/3     2/3 .51466 .02 .00955 .01023 .01023 .00819 .00511      0      0
P    .39810  .36995 .25166 .98 .01063  .0113  .0110  .0103  .0061 -.0004 -.0001
Si   .39810  .36995 .25166 .02 .01063  .0113  .0110  .0103  .0061 -.0004 -.0001
O1    .4849   .1570  .7360      .0169  .0202  .0110  .0125  .0026 -.0011  .0003
O2    .3143   .2483  .0882      .0227  .0352  .0179  .0168  .0145 -.0128 -.0067
O3    .3664   .2688  .4384      .0182  .0240  .0204  .0135  .0136  .0032  .0056
O4    .5331   .1184  .2289      .0175  .0157  .0165  .0238  .0107 -.0007  .0006
F         0       0  .2900 .88  .0319  .0227  .0227   .050  .0114      0      0
F         0       0      0 .12  .0319  .0227  .0227   .050  .0114      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Byzantievite
 
Sokolova E, Hawthorne F C, Pautov L A, Agakhanov A A
 
Mineralogical Magazine 74 (2010) 285-308
Byzantievite, Ba5(Ca,REE,Y)22(Ti,Nb)18(SiO4)4[(PO4),(SiO4)]4(BO3)9O21[(OH),F]43(H2O)1.5:
the crystal structure and crystal chemistry of the only known mineral with the
oxyanions (BO3), (SiO4) and (PO4)
Locality: Alai ridge, Tien-Shan Mountains, northern Tajikistan
_database_code_amcsd 0014601
9.1202 9.1202 102.145 90 90 120 R3
atom         x     y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
TiD(1)   .8947 .5614 .98244  .70 .0261   .024   .019   .032   .007   .002   .005
NbD(1)   .8947 .5614 .98244  .30 .0261   .024   .019   .032   .007   .002   .005
TiD(2)       0     0 .97553  .70 .0149   .013   .013   .018  .0067      0      0
NbD(2)       0     0 .97553  .30 .0149   .013   .013   .018  .0067      0      0
TiD(3)       0     0 .35890  .70 .0103   .015   .015   .000  .0077      0      0
NbD(3)       0     0 .35890  .30 .0103   .015   .015   .000  .0077      0      0
TiD(4)       0     0 .02562  .70 .0123   .017   .017   .003  .0086      0      0
NbD(4)       0     0 .02562  .30 .0123   .017   .017   .003  .0086      0      0
TiD(5)       0     0 .30898  .70 .0120   .010   .010   .017  .0048      0      0
NbD(5)       0     0 .30898  .30 .0120   .010   .010   .017  .0048      0      0
TiD(6)   .8981 .5659 .01880  .70 .0160   .012   .016   .017  .0047  .0024 -.0021
NbD(6)   .8981 .5659 .01880  .30 .0160   .012   .016   .017  .0047  .0024 -.0021
TiD(7)   .3348 .3320 .85877  .46  .040   .022   .049   .050   .017   .014   .008
NbD(7)   .3348 .3320 .85877  .23  .040   .022   .049   .050   .017   .014   .008
TiD(8)   .9986 .6664 .80872  .46  .050   .033   .029   .079   .009  -.005  -.003
NbD(8)   .9986 .6664 .80872  .23  .050   .033   .029   .079   .009  -.005  -.003
TiD(9)   .1019 .0933 .18471  .12  .009   .000   .000   .000  -.020  -.033  -.026
NbD(9)   .1019 .0933 .18471  .05  .009   .000   .000   .000  -.020  -.033  -.026
TiD(10)  .5668 .3279 .18534  .12  .004   .020   .023   .000   .034  -.007  -.001
NbD(10)  .5668 .3279 .18534  .05  .004   .020   .023   .000   .034  -.007  -.001
TiD(11)  .3337 .5702 .18499  .12  .003   .019   .011   .000   .025  -.038  -.024
NbD(11)  .3337 .5702 .18499  .05  .003   .019   .011   .000   .025  -.038  -.024
TiD(12) .10241 .0938 .14928  .12  .028   .018   .000   .011  -.037   .007   .005
NbD(12) .10241 .0938 .14928  .05  .028   .018   .000   .011  -.037   .007   .005
TiD(13)  .5543 .3281 .14908  .12  .032   .000   .000    .08  -.015   .014  -.011
NbD(13)  .5543 .3281 .14908  .05  .032   .000   .000    .08  -.015   .014  -.011
TiD(14)  .3222 .5323 .15006  .12  .057   .000    .15   .016   .037  -.014   -.05
NbD(14)  .3222 .5323 .15006  .05  .057   .000    .15   .016   .037  -.014   -.05
YM(1)        0     0 .06042  .50 .0232  .0201  .0201   .029  .0101      0      0
CaM(1)       0     0 .06042  .25 .0232  .0201  .0201   .029  .0101      0      0
CeM(1)       0     0 .06042  .12 .0232  .0201  .0201   .029  .0101      0      0
LaM(1)       0     0 .06042  .05 .0232  .0201  .0201   .029  .0101      0      0
NdM(1)       0     0 .06042  .04 .0232  .0201  .0201   .029  .0101      0      0
DyM(1)       0     0 .06042  .01 .0232  .0201  .0201   .029  .0101      0      0
GdM(1)       0     0 .06042  .01 .0232  .0201  .0201   .029  .0101      0      0
PrM(1)       0     0 .06042  .01 .0232  .0201  .0201   .029  .0101      0      0
SmM(1)       0     0 .06042  .01 .0232  .0201  .0201   .029  .0101      0      0
CaM(2)   .6655 .6320 .08415  .62 .0304   .038   .047  .0114  .0252 -.0029 -.0026
CeM(2)   .6655 .6320 .08415  .17 .0304   .038   .047  .0114  .0252 -.0029 -.0026
LaM(2)   .6655 .6320 .08415  .08 .0304   .038   .047  .0114  .0252 -.0029 -.0026
NdM(2)   .6655 .6320 .08415  .06 .0304   .038   .047  .0114  .0252 -.0029 -.0026
DyM(2)   .6655 .6320 .08415  .02 .0304   .038   .047  .0114  .0252 -.0029 -.0026
GdM(2)   .6655 .6320 .08415  .02 .0304   .038   .047  .0114  .0252 -.0029 -.0026
PrM(2)   .6655 .6320 .08415  .02 .0304   .038   .047  .0114  .0252 -.0029 -.0026
SmM(2)   .6655 .6320 .08415  .01 .0304   .038   .047  .0114  .0252 -.0029 -.0026
CaM(3)       0     0 .39375  .52 .0119  .0007  .0007   .034  .0003      0      0
YM(3)        0     0 .39375  .25 .0119  .0007  .0007   .034  .0003      0      0
CeM(3)       0     0 .39375  .12 .0119  .0007  .0007   .034  .0003      0      0
LaM(3)       0     0 .39375  .04 .0119  .0007  .0007   .034  .0003      0      0
NdM(3)       0     0 .39375  .03 .0119  .0007  .0007   .034  .0003      0      0
DyM(3)       0     0 .39375  .01 .0119  .0007  .0007   .034  .0003      0      0
GdM(3)       0     0 .39375  .01 .0119  .0007  .0007   .034  .0003      0      0
PrM(3)       0     0 .39375  .01 .0119  .0007  .0007   .034  .0003      0      0
SmM(3)       0     0 .39375  .01 .0119  .0007  .0007   .034  .0003      0      0
YM(4)        0     0 .94121      .0149  .0168  .0168   .011  .0084      0      0
CaM(5)   .6667 .5789 .04567  .47 .0257  .0261  .0160   .035  .0106 -.0004 -.0007
YM(5)    .6667 .5789 .04567  .25 .0257  .0261  .0160   .035  .0106 -.0004 -.0007
FeM(5)   .6667 .5789 .04567  .07 .0257  .0261  .0160   .035  .0106 -.0004 -.0007
CeM(5)   .6667 .5789 .04567  .10 .0257  .0261  .0160   .035  .0106 -.0004 -.0007
LaM(5)   .6667 .5789 .04567  .04 .0257  .0261  .0160   .035  .0106 -.0004 -.0007
NdM(5)   .6667 .5789 .04567  .03 .0257  .0261  .0160   .035  .0106 -.0004 -.0007
DyM(5)   .6667 .5789 .04567  .01 .0257  .0261  .0160   .035  .0106 -.0004 -.0007
GdM(5)   .6667 .5789 .04567  .01 .0257  .0261  .0160   .035  .0106 -.0004 -.0007
PrM(5)   .6667 .5789 .04567  .01 .0257  .0261  .0160   .035  .0106 -.0004 -.0007
SmM(5)   .6667 .5789 .04567  .01 .0257  .0261  .0160   .035  .0106 -.0004 -.0007
CaM(6)   .9122 .3332 .95584  .47 .0138  .0120  .0126   .019  .0081 -.0018 -.0034
YM(6)    .9122 .3332 .95584  .25 .0138  .0120  .0126   .019  .0081 -.0018 -.0034
FeM(6)   .9122 .3332 .95584  .07 .0138  .0120  .0126   .019  .0081 -.0018 -.0034
CeM(6)   .9122 .3332 .95584  .10 .0138  .0120  .0126   .019  .0081 -.0018 -.0034
LaM(6)   .9122 .3332 .95584  .04 .0138  .0120  .0126   .019  .0081 -.0018 -.0034
NdM(6)   .9122 .3332 .95584  .03 .0138  .0120  .0126   .019  .0081 -.0018 -.0034
DyM(6)   .9122 .3332 .95584  .01 .0138  .0120  .0126   .019  .0081 -.0018 -.0034
GdM(6)   .9122 .3332 .95584  .01 .0138  .0120  .0126   .019  .0081 -.0018 -.0034
PrM(6)   .9122 .3332 .95584  .01 .0138  .0120  .0126   .019  .0081 -.0018 -.0034
SmM(6)   .9122 .3332 .95584  .01 .0138  .0120  .0126   .019  .0081 -.0018 -.0034
CaM(7)   .3682 .0322 .91743  .62 .0339   .036   .046   .011   .014  .0034  .0030
CeM(7)   .3682 .0322 .91743  .17 .0339   .036   .046   .011   .014  .0034  .0030
LaM(7)   .3682 .0322 .91743  .08 .0339   .036   .046   .011   .014  .0034  .0030
NdM(7)   .3682 .0322 .91743  .06 .0339   .036   .046   .011   .014  .0034  .0030
DyM(7)   .3682 .0322 .91743  .02 .0339   .036   .046   .011   .014  .0034  .0030
GdM(7)   .3682 .0322 .91743  .02 .0339   .036   .046   .011   .014  .0034  .0030
PrM(7)   .3682 .0322 .91743  .02 .0339   .036   .046   .011   .014  .0034  .0030
SmM(7)   .3682 .0322 .91743  .01 .0339   .036   .046   .011   .014  .0034  .0030
CaM(8)       0     0 .27458  .44 .0156  .0175  .0175   .012  .0088      0      0
YM(8)        0     0 .27458  .25 .0156  .0175  .0175   .012  .0088      0      0
CeM(8)       0     0 .27458  .14 .0156  .0175  .0175   .012  .0088      0      0
LaM(8)       0     0 .27458  .07 .0156  .0175  .0175   .012  .0088      0      0
NdM(8)       0     0 .27458  .05 .0156  .0175  .0175   .012  .0088      0      0
DyM(8)       0     0 .27458  .02 .0156  .0175  .0175   .012  .0088      0      0
GdM(8)       0     0 .27458  .01 .0156  .0175  .0175   .012  .0088      0      0
PrM(8)       0     0 .27458  .01 .0156  .0175  .0175   .012  .0088      0      0
SmM(8)       0     0 .27458  .01 .0156  .0175  .0175   .012  .0088      0      0
CaM(9)   .9984 .6633 .10806  .21 .0324  .0373  .0377   .026  .0216  .0018  .0022
SrM(9)   .9984 .6633 .10806  .10 .0324  .0373  .0377   .026  .0216  .0018  .0022
CeM(9)   .9984 .6633 .10806  .11 .0324  .0373  .0377   .026  .0216  .0018  .0022
LaM(9)   .9984 .6633 .10806  .05 .0324  .0373  .0377   .026  .0216  .0018  .0022
NdM(9)   .9984 .6633 .10806  .04 .0324  .0373  .0377   .026  .0216  .0018  .0022
DyM(9)   .9984 .6633 .10806  .01 .0324  .0373  .0377   .026  .0216  .0018  .0022
GdM(9)   .9984 .6633 .10806  .01 .0324  .0373  .0377   .026  .0216  .0018  .0022
PrM(9)   .9984 .6633 .10806  .01 .0324  .0373  .0377   .026  .0216  .0018  .0022
SmM(9)   .9984 .6633 .10806  .01 .0324  .0373  .0377   .026  .0216  .0018  .0022
CaM(10)  .3382 .3364 .89368  .21 .0324  .0373  .0377   .026  .0216  .0018  .0022
SrM(10)  .3382 .3364 .89368  .22 .0324  .0373  .0377   .026  .0216  .0018  .0022
CeM(10)  .3382 .3364 .89368  .06 .0324  .0373  .0377   .026  .0216  .0018  .0022
LaM(10)  .3382 .3364 .89368  .03 .0324  .0373  .0377   .026  .0216  .0018  .0022
NdM(10)  .3382 .3364 .89368  .02 .0324  .0373  .0377   .026  .0216  .0018  .0022
DyM(10)  .3382 .3364 .89368  .01 .0324  .0373  .0377   .026  .0216  .0018  .0022
GdM(10)  .3382 .3364 .89368  .01 .0324  .0373  .0377   .026  .0216  .0018  .0022
PrM(10)  .3382 .3364 .89368  .01 .0324  .0373  .0377   .026  .0216  .0018  .0022
SmM(10)  .3382 .3364 .89368  .00 .0324  .0373  .0377   .026  .0216  .0018  .0022
Si(1)        0     0 .09745       .042   .034   .034   .057  .0171      0      0
Si(2)        0     0 .90406       .042   .034   .034   .057  .0171      0      0
Si(3)        0     0 .23833       .042   .034   .034   .057  .0171      0      0
Si(4)        0     0 .43087       .042   .034   .034   .057  .0171      0      0
PT(1)    .9889 .6554 .07080  .52  .022   .009   .025   .023   .001   .007  -.003
SiT(1)   .9889 .6554 .07080  .11  .022   .009   .025   .023   .001   .007  -.003
PT(2)    .6635 .0060 .93081  .52  .009   .000   .010   .004  -.006   .010  -.011
SiT(2)   .6635 .0060 .93081  .11  .009   .000   .010   .004  -.006   .010  -.011
BaA(1)   .0718 .3330 .00070      .0213  .0186  .0205  .0254  .0102 -.0004  .0008
BaA(2A)  .4115 .0762 .83387  .22 .0202   .028   .029   .010   .019  -.011   .002
BaA(2B)  .2719 .9939 .83386  .22 .0202   .028   .029   .010   .019  -.011   .002
BaA(2C)  .3329 .9353 .83408  .22 .0202   .028   .029   .010   .019  -.011   .002
B(1)     .6695 .8968  .0394        .03
B(2)     .1062 .7737  .9632        .03
B(3)         0     0  .7692        .03
B(4)         0     0 .55946        .03
B(5)         0     0 .48424 .167   .03
B(6)         0     0 .14939 .167   .03
B(7)         0     0 .81612 .167   .03
B(8)         0     0  .5181 .167   .03
B(9)         0     0 .18175 .167   .03
B(10)        0     0 .84736 .167   .03
O(1)         0     0 .08206        .02
O(2)     .1757  .040  .1045        .02
O(3)         0     0 .91972        .02
O(4)     .1616  .004 .89763        .02
O(5)      .260  .786  .9607        .02
O(6)      .120  .929  .9612        .02
O(7)     .8117  .883  .0399        .02
O(8)     .5157 .1848  .1043        .02
O(9)      .953  .628  .9640        .02
O(10)     .669  .046  .0383        .02
O(11)     .529  .741  .0409        .02
O(12)     .847  .329  .0222        .02
O(13)    .7055 .1836 .65222        .02
O(14)    .1893 .1500 .98535        .02
O(15)     .145  .619  .0162        .02
O(16)     .860  .529 .00050        .02
O(17)    .1989  .146 .01582        .02
O(18)    .8551  .331 .97710        .02
O(19)     .655  .063 .91673  .67   .02
OH(19)    .655  .063 .91673  .33   .02
O(20)     .931  .598 .08500  .67   .02
OH(20)    .931  .598 .08500  .33   .02
O(21)    .5103  .983  .9389  .67   .02
OH(21)   .5103  .983  .9389  .33   .02
O(22)    .8373  .144  .0650  .67   .02
OH(22)   .8373  .144  .0650  .33   .02
O(23)    .1584 .8236  .0708  .67   .02
OH(23)   .1584 .8236  .0708  .33   .02
O(24)     .669 .8426  .9335  .67   .02
OH(24)    .669 .8426  .9335  .33   .02
O(25)     .296 .1668  .9375  .67   .02
OH(25)    .296 .1668  .9375  .33   .02
O(26)    .5078  .989 .06369  .67   .02
OH(26)   .5078  .989 .06369  .33   .02
O(27)     .965  .027 .25346  .33   .02
O(28)     .002  .944  .4160  .33   .02
O(29)    .1736  .013  .4354        .02
O(30)    .9864 .1562 .23292        .02
O(31)    .8590 .8631 .56455        .02
OH(32)   .1398 .1302 .18759  .50   .02
O(32)    .1398 .1302 .18759  .17   .02
OH(33)   .5190 .3361  .1823  .50   .02
O(33)    .5190 .3361  .1823  .17   .02
OH(34)   .2909 .5005  .1835  .50   .02
O(34)    .2909 .5005  .1835  .17   .02
OH(35)    .467  .534 .20374  .67   .02
OH(36)    .316  .184  .1272  .67   .02
OH(37)    .462  .522  .1293  .67   .02
OH(38)   .6510 .1785  .1520  .50   .02
O(38)    .6510 .1785  .1520  .17   .02
OH(39)    .329  .186 .20653  .67   .02
OH(40)   .8547 .0034 .15212  .50   .02
O(40)    .8547 .0034 .15212  .17   .02
OH(41)    .143  .299 .20370  .67   .02
OH(42)    .175  .333  .1257  .67   .02
OH(43)   .4008 .5633  .1493  .50   .02
O(43)    .4008 .5633  .1493  .17   .02
OH(44)   .5084  .317  .1855  .33   .02
OH(45)   .3233 .5400  .1474  .33   .02
OH(46)   .1429 .1623  .1503  .33   .02
Wat(47)  .3685 .5199 .16858  .17   .02
Wat(48)   .495  .318  .1660  .17   .02
OH(49)    .552  .373  .1471  .33   .02
Wat(50)   .132  .119 .16727  .17   .02
OH(51)   .3341 .5703 .20605  .17   .02
OH(52)  .56530 .3292 .20560  .17   .02
OH(53)   .0999  .095 .20626  .17   .02
OH(54)   .3248 .5335 .13048  .17   .02
OH(55)  .55690 .3217 .12805  .17   .02
OH(56)  .10573 .0962 .12971  .17   .02
OH(57)    .147 .3035  .1889  .17   .02
OH(58)    .491  .509  .1878  .17   .02
OH(59)    .306  .111  .1878  .17   .02
OH(60)    .151  .325  .1442  .17   .02
OH(61)    .519  .511  .1485  .17   .02
OH(62)   .3408  .163  .1458  .17   .02
OH(63)    .371  .523  .1856  .33   .02
OH(64)   .1414 .1692  .1833  .33   .02
F(1)         0     0  .7171       .007
F(2)         0     0  .6180       .013
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Mendeleevite-(Ce)
 
Sokolova E, Hawthorne F C, Pautov L A, Agakhanov A A, Karpenko V Y
 
Mineralogical Magazine 75 (2011) 2583-2596
The crystal structure and crystal chemistry of mendeleevite-(Ce),
(Cs,_)6(_,Cs)6(_,K)6(REE,Ca,_)30(Si70O175)(H2O,OH,F,_)35,
a potential microporous material
Locality: moraine of the Darai-Pioz glacier, Alai mountain ridge,
Tien-Shan mountains, northern Tajikistan
_database_code_amcsd 0018578
21.9148 21.9148 21.9148 90 90 90 Pm3
atom         x      y      z occ   Uiso
CeM(1)  .28869 .29333 .16693 .50 .01081
LaM(1)  .28869 .29333 .16693 .26 .01081
NdM(1)  .28869 .29333 .16693 .14 .01081
PrM(1)  .28869 .29333 .16693 .07 .01081
SmM(1)  .28869 .29333 .16693 .02 .01081
GdM(1)  .28869 .29333 .16693 .01 .01081
CeM(2A) .40430 .40992 .11371 .39  .0182
LaM(2A) .40430 .40992 .11371 .20  .0182
NdM(2A) .40430 .40992 .11371 .11  .0182
PrM(2A) .40430 .40992 .11371 .05  .0182
SmM(2A) .40430 .40992 .11371 .01  .0182
GdM(2A) .40430 .40992 .11371 .01  .0182
CaM(2A) .40430 .40992 .11371 .02  .0182
CeM(2B)  .3844  .4123  .1193 .05  .0182
LaM(2B)  .3844  .4123  .1193 .02  .0182
NdM(2B)  .3844  .4123  .1193 .01  .0182
PrM(2B)  .3844  .4123  .1193 .01  .0182
CaM(3)  .30685 .31416      0 .74  .0207
SrM(3)  .30685 .31416      0 .17  .0207
CeM(3)  .30685 .31416      0 .02  .0207
LaM(3)  .30685 .31416      0 .01  .0207
NdM(3)  .30685 .31416      0 .01  .0207
CsA(1)  .23200     .5 .24858 .78  .0448
CsA(2)      .5  .4200  .3981 .22  .0459
KB(1)    .0892  .3728      0 .35   .044
KB(2)     .078   .404      0 .02   .044
Si(1)   .42893     .5 .24647      .0132
Si(2)   .23758 .43094 .07310      .0112
Si(3)   .06963 .26204 .16567      .0111
Si(4)   .42934 .25606 .07078      .0124
Si(5)   .14260 .37357 .15483      .0116
Si(6)   .36548 .38330 .27932      .0219
Si(7)   .16716 .16716 .16716      .0098
O(1)     .1704  .4079  .0957      .0161
O(2)     .4035     .5  .1785       .020
O(3)     .1940  .3439  .1973      .0152
O(4)         0  .2518  .1432       .015
O(5)     .3861  .3043  .1037      .0178
O(6)     .4257  .1900  .1037      .0195
O(7)     .0961  .3221  .1288      .0193
O(8)     .2891  .3841  .0941      .0203
O(9)     .2706  .2376  .0762      .0192
O(10)       .5  .2773  .0719       .017
O(11)    .3490  .3730  .2098      .0330
O(12)    .2342  .4333      0       .022
O(13)    .2477     .5  .0992       .014
O(14)    .3992  .3238  .3079      .0304
O(15)    .4111  .4411  .2855       .050
O(16)    .4077  .2479      0       .022
O(17)    .1413  .1073  .2031      .0166
O(18)    .2095  .2095  .2095       .014
O(19)       .5  .5177  .2475  .5   .029
F        .2778  .2778  .2778      .0142
WatO(20) .3779     .5  .0512  .5   .025
OHO(20)  .3779     .5  .0512  .5   .025
WatO(21)    .5  .4304  .0567  .5   .060
OHO(21)     .5  .4304  .0567  .5   .060
WatO(22)    .5      0      0 2/3   .048
WatO(23)    .5  .3849  .1678 .42   .054
OHO(23)     .5  .3849  .1678 .35   .054
FO(23)      .5  .3849  .1678 .23   .054
WatO(24) .1829  .3036      0 .77   .045
WatO(25)     0  .3870  .4029 .42   .057
OHO(25)      0  .3870  .4029 .35   .057
FO(25)       0  .3870  .4029 .23   .057
WatO(26)    .5     .5     .5  .5    .03
WatO(27)     0   .305      0 1/3   .063
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Manganoblodite
 
Kasatkin A V, Nestola F, Plasil J, Marty J, Belakovskiy D I, Agakhanov A A,
Mills S J, Pedron D, Lanza A, Favaro M, Bianchin S, Lykova I S, Golias V, Birch W D
 
Mineralogical Magazine 77 (2013) 367-383
Manganoblodite, Na2Mn(SO4)2*4H2O, and cobaltoblodite, Na2Co(SO4)2*4H2O: two new
members of the blodite group from the Blue Lizard mine, San Juan County, Utah, USA
Locality: Blue Lizard mine, San Juan County, Utah, USA
_database_code_amcsd 0019855
11.137 8.279 5.5381 90 100.423 90 P2_1/a
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   .36212 .07065  .1298      .0222  .0193  .0222  .0245  .0003  .0022 -.0009
Mn        0      0      0 .44 .01783  .0169  .0177  .0193 -.0012  .0046 -.0010
Mg        0      0      0 .29 .01783  .0169  .0177  .0193 -.0012  .0046 -.0010
Ni        0      0      0 .06 .01783  .0169  .0177  .0193 -.0012  .0046 -.0010
Co        0      0      0 .14 .01783  .0169  .0177  .0193 -.0012  .0046 -.0010
S    .13613 .29031 .37014     .01383  .0128  .0154  .0130 -.0009  .0018  .0004
O1   .26526  .2728  .3466      .0223  .0144  .0238  .0291  .0022  .0048  .0028
O2   .07933  .4193  .2078      .0233  .0187  .0253  .0256  .0030  .0033  .0109
O3    .0713  .1369  .3118      .0227  .0297  .0222  .0166 -.0111  .0054 -.0053
O4    .1319  .3304  .6293      .0223  .0309  .0225  .0143 -.0014  .0062 -.0051
O5   .16225  .0390  .8708      .0196  .0189  .0213  .0199  .0011  .0075  .0006
O6    .0814  .7876  .1799      .0208  .0209  .0193  .0202 -.0014 -.0017  .0010
H5A    .179   .145   .758       .080
H5B    .180  -.050   .747       .080
H6A    .024   .713   .222       .080
H6B    .099   .783   .310       .080
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Cobaltoblodite
 
Kasatkin A V, Nestola F, Plasil J, Marty J, Belakovskiy D I, Agakhanov A A,
Mills S J, Pedron D, Lanza A, Favaro M, Bianchin S, Lykova I S, Golias V, Birch W D
 
Mineralogical Magazine 77 (2013) 367-383
Manganoblodite, Na2Mn(SO4)2*4H2O, and cobaltoblodite, Na2Co(SO4)2*4H2O: two new
members of the blodite group from the Blue Lizard mine, San Juan County, Utah, USA
Locality: Blue Lizard mine, San Juan County, Utah, USA
_database_code_amcsd 0019856
11.147 8.268 5.5396 90 100.517 90 P2_1/a
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   .36203 .07052 .12983      .0235  .0203  .0232  .0264   .0010  .0027  -.0007
Co        0      0      0 .36 .01592  .0152  .0151  .0175 -.00108 .00302 -.00065
Mg        0      0      0 .30 .01592  .0152  .0151  .0175 -.00108 .00302 -.00065
Mn        0      0      0 .17 .01592  .0152  .0151  .0175 -.00108 .00302 -.00065
Ni        0      0      0 .12 .01592  .0152  .0151  .0175 -.00108 .00302 -.00065
S    .13624 .28981 .37043     .01457  .0145  .0148 .01413 -.00074 .00179  .00056
O1   .26554 .27159  .3473      .0237  .0152  .0250  .0313   .0024  .0056   .0028
O2   .07923  .4172  .2079      .0255  .0198  .0269  .0293   .0036  .0032   .0115
O3   .07173 .13550  .3131      .0245  .0303  .0221  .0210  -.0106  .0046  -.0039
O4   .13185 .32970  .6293      .0245  .0341  .0232  .0171  -.0024  .0074  -.0043
O5   .16260  .0382  .8720      .0206  .0216  .0203  .0209   .0003  .0065   .0014
O6   .08181  .7872  .1784      .0219  .0222  .0190  .0222  -.0017 -.0017   .0008
H5A    .164   .114   .794       .080
H5B    .174  -.042   .785       .080
H6A    .039   .731   .232       .080
H6B    .125   .796   .304       .080
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Nestolaite
 
Kasatkin A V, Plasil J, Marty J, Agakhanov A A, Belakovskiy D I, Lykova I S
 
Mineralogical Magazine 78 (2014) 497-505
Nestolaite, CaSeO3*H2O, a new mineral from the Little Eva mine, Grand County, Utah, USA
Locality: Little Eva mine, Grand County, Utah, USA
_database_code_amcsd 0020621
7.6502 6.7473 7.9358 90 108.542 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)
Ca   .098  .145 .354 .096
Se   .248 .6559 .492 .067   .074   .055   .095   .066   .060   .104
O1   .264  .574 .699 .013
O2   .203  .437 .379 .013
O3   .063  .806 .460 .013
Wat4 .349  .103 .630  .03
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Ankinovichite
 
Karpenko V Y, Pautov L A, Sokolova E V, Hawthorne F C, Agakhanov A A, Dikaya T V
 
Zapiski Vserossijskogo Mineralogicheskogo Obshchestva 133 (2004) 59-70
Ankinovichite - the nickel analogue of alvanite - a new mineral from Kurumsak
(Kazakhstan) and Kara-Chagyr (Kyrgystan)
Locality: Kara-Chagyr, Kyrgystan
Note: isostructural with alvanite
_database_code_amcsd 0015715
17.8098 5.1228 8.8665 90 92.141 90 P2_1/n
atom      x     y     z occ  Uiso
NiM       0    .5    .5 .72 .0059
ZnM       0    .5    .5 .28 .0059
Al1   .9987 .9979 .3264     .0092
Al2   .0021 .5011 .8393     .0093
V    .24260 .1170 .1359 .94 .0064
O1    .2912  .845 .2247      .022
O2    .1713  .014 .0317      .016
O3    .2994  .267 .0255      .021
OH4   .0562 .3204 .6806      .006
OH5   .4473 .3552 .9932      .005
OH6   .9455 .6803 .6746      .006
OH7   .0573 .3913 .0061      .006
OH8   .0570 .8060 .8107      .007
OH9   .9447  .199 .7995      .010
O10   .2078  .218 .6956      .039
H1     .234  .170  .786
H2     .223  .143  .613
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Download in:

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

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

Total number of retrieved datasets: 23
View in amc, download in amc

Return to AMCSD Home Page