American Mineralogist Crystal Structure Database

21 matching records for this search.

FeSnF6.6H2O
 
Benghalem A, Leblanc M, Calage Y
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=46&spage=2453
Acta Crystallographica C46 (1990) 2453-2454
Room-temperature structure of iron(II)
hexafluorostannate(IV)hexahydrate
_database_code_amcsd 0010243
9.826 9.826 10.106 90 90 120 R-3
atom     x     y     z Biso
Fe       0     0    .5 1.99
Sn       0     0     0 1.67
F    .1460 .1718 .1126  4.2
O    .1840 .1701 .3813  4.8
H1    .310  .223  .411  6.0
H2    .161  .151  .271  6.0
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ZnFeF5(H2O)2
 
Laligant Y, Calage Y, Torres Tapia E, Greneche J, Varret F, Ferey G
 
Journal of Magnetism and Magnetic Materials 61 (1986) 283-290
Crystal structure of the inverse weberite ZnFeF5(H2O)2, magnetic and Mossbauer
study of the antiferromagnet ZnFeF5(H2O)2 and ferrimagnet MnFeF5
_cod_database_code 1000247
_database_code_amcsd 0013056
7.475 10.766 6.594 90 90 90 Imma
atom   x     y     z
Zn1    0     0     0
Fe1  .25   .25   .25
F1     0   .25 .3318
F2    .2 .1234 .0509
Wat   .5 .5651 .1971
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F6 Fe Nb
 
Delobbe V, Chassaing J, Bizot D, Quarton M, Lacorre P, Calage Y, Leblanc M, Ferey G
 
Journal of Magnetism and Magnetic Materials 74 (1988) 165-176
Fluorocomplexes of Niobium IV; VI: Mossbauer study and magnetic
structure of Fe Nb F6
_cod_database_code 1000243
_database_code_amcsd 0013062
5.4201 5.4201 14.072 90 90 120 R-3
atom     x     y     z
F1   .2588 .3409 .0866
Fe1      0     0     0
Nb1      0     0    .5
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F6 Fe Nb
 
Delobbe V, Chassaing J, Bizot D, Quarton M, Lacorre P, Calage Y, Leblanc M, Ferey G
 
Journal of Magnetism and Magnetic Materials 74 (1988) 165-176
Fluorocomplexes of Niobium IV; VI: Mossbauer study and magnetic
structure of Fe Nb F6
_cod_database_code 1000244
_database_code_amcsd 0013063
5.3942 5.3942 14.1457 90 90 120 R-3
atom     x     y     z
F1   .2674 .3504 .0883
Fe1      0     0     0
Nb1      0     0    .5
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F6 Fe Nb
 
Delobbe V, Chassaing J, Bizot D, Quarton M, Lacorre P, Calage Y, Leblanc M, Ferey G
 
Journal of Magnetism and Magnetic Materials 74 (1988) 165-176
Fluorocomplexes of Niobium IV; VI: Mossbauer study and magnetic
structure of Fe Nb F6
_cod_database_code 1000245
_database_code_amcsd 0013064
7.793 7.7398 7.7435 86.585 87.046 86.138 P-1
atom      x      y      z
Fe1       0      0      0
Fe2       0     .5     .5
Fe3      .5     .5      0
Fe4      .5      0     .5
Nb1      .5      0      0
Nb2       0     .5      0
Nb3       0      0     .5
Nb4      .5     .5     .5
F1    .0449  .2508 -.0583
F2   -.0583  .0449  .2508
F3    .2508 -.0583  .0449
F4    .0449  .7508  .4417
F5    .4417  .0449  .7508
F6    .7508  .4417  .0449
F7    .5449  .7508 -.0583
F8   -.0583  .5449  .7508
F9    .7508 -.0583  .5449
F10   .5449  .2508  .4417
F11   .4417  .5449  .2508
F12   .2508  .4417  .5449
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F6 Fe Nb
 
Delobbe V, Chassaing J, Bizot D, Quarton M, Lacorre P, Calage Y, Leblanc M, Ferey G
 
Journal of Magnetism and Magnetic Materials 74 (1988) 165-176
Fluorocomplexes of Niobium IV; VI: Mossbauer study and magnetic
structure of Fe Nb F6
_cod_database_code 1000246
_database_code_amcsd 0013065
7.7994 7.7143 7.7206 86.483 86.968 85.687 P-1
atom      x      y      z
Fe1       0      0      0
Fe2       0     .5     .5
Fe3      .5     .5      0
Fe4      .5      0     .5
Nb1      .5      0      0
Nb2       0     .5      0
Nb3       0      0     .5
Nb4      .5     .5     .5
F1    .0576  .2441 -.0527
F2   -.0527  .0576  .2441
F3    .2441 -.0527  .0576
F4    .0576  .7441  .4473
F5    .4473  .0576  .7441
F6    .7441  .4473  .0576
F7    .5576  .7441 -.0527
F8   -.0527  .5576  .7441
F9    .7441 -.0527  .5576
F10   .5576  .2441  .4473
F11   .4473  .5576  .2441
F12   .2441  .4473  .5576
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F3 Fe H0.66 O0.33
 
Leblanc M, Ferey G, Chevalier P, Calage Y, de Pape R
 
Journal of Solid State Chemistry 47 (1983) 53-58
Hexagonal Tungsten Bronze-Type Fe(III) Fluoride: (H2O)0.33FeF3;
Crystal Structure, Magnetic Properties, Dehydration to a New Form of
Iron Trifluoride
_cod_database_code 1000187
_database_code_amcsd 0013503
7.423 12.730 7.526 90 90 90 Cmcm
atom     x      y     z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Fe1      0     .5     0  .0084  .0065  .0066      0      0 -.0001
Fe2    .25    .25     0  .0061  .0088  .0073  .0010  .0002 -.0001
F1       0  .2156 .5511  .0072  .0244  .0176      0      0  .0017
F2   .1876  .3962 .0434  .0193  .0124  .0199  .0062 -.0025 -.0009
F3       0  .5286   .25   .023  .0133  .0066      0      0      0
F4   .2101  .2176   .25  .0179  .0201  .0078 -.0002      0      0
O1       0 -.0006   .25  .0519  .0410  .0721      0      0      0
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F8 Fe3 H4 O2
 
Leblanc M, Ferey G, Calage Y, De Pape R
 
Journal of Solid State Chemistry 53 (1984) 360-368
Idle spin behavior of the shifted hexagonal tungsten bronze type
compounds Fe Fe2 F8 (H2O)2 and Mn Fe2 F8 (H2O)2
_cod_database_code 1000193
_database_code_amcsd 0013528
7.609 7.514 7.453 90 118.21 90 C2/m
atom     x     y     z
Fe1      0    .5     0
Fe2    .25   .25    .5
Wat  .2423     0 .0435
F1       0 .2925    .5
F2   .1845     0 .4411
F3   .1277 .2952 .2138
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Ca3 Mn3 O8.02
 
Nguyen N, Calage Y, Varret F, Ferey G, Caignaert V, Hervieu M, Raveau B
 
Journal of Solid State Chemistry 53 (1984) 398-405
The oxygen defect Perovskite Ca3 Mn1.35 Fe1.65 O8.02: a highly
frustrated antiferromagnet
_cod_database_code 1000194
_database_code_amcsd 0013529
5.332 11.13 5.455 90 90 90 Pm2a
atom    x    y    z occ
Ca1   .25   .5  .75
Ca2   .24 .183   .7  .5
Ca3   .24 .834   .7  .5
Mn1   .27 .332 .259  .5
Mn2   .25 .665 .255
Mn3  .232    0 .237  .5
O1      0 .329    0
O2      0 .665    0
O3      0  .33   .5
O4      0  .66   .5
O5    .25   .5  .25  .7
O6    .25  .17  .25
O7    .25 .829  .25
O8      0  .01    0
O9      0  .01   .5  .3
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F6 Fe2 Li
 
Fourquet J, LeSamedi E, Calage Y
 
Journal of Solid State Chemistry 77 (1988) 84-89
Le trirutile ordonne Li Fe2 F6: Croissance cristalline et etude structurale
_cod_database_code 1000239
_database_code_amcsd 0013624
4.679 4.679 9.324 90 90 90 P4_2nm
atom     x     y     z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Li1      0     0 .6664  .0165  .0165  .0107  .0153      0      0
Fe1      0     0 .3339  .0079  .0079  .0077 -.0022      0      0
Fe2      0     0     0  .0077  .0077  .0070 -.0002      0      0
F1   .6938 .6938 .6568  .0122  .0122  .0081 -.0045  .0002  .0002
F2   .2914 .2914 .0026  .0128  .0128  .0121 -.0055 -.0017 -.0017
F3   .3053 .3053 .3440  .0148  .0148  .0124 -.0052 -.0018 -.0018
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F7 Fe Na2 Ni
 
Laligant Y, Calage Y, Heger G, Pannetier J, Ferey G
 
Journal of Solid State Chemistry 78 (1989) 66-77
Ordered Magnetic Frustration VII. Na2 Ni Fe F7: Reexamination of
Its Crystal Structure in the True Space Group after Corrections from
Renninger Effect and Refinement of Its Frustrated Magnetic Structure at
4.2 and 55 K
_cod_database_code 1000257
_database_code_amcsd 0013630
7.2338 10.3050 7.4529 90 90 90 Imma
atom     x     y     z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na1      0     0     0  .0236  .0568  .0190      0      0  .0189
Na2    .25   .25   .75  .0223  .0230  .0667      0 -.0036      0
Ni1    .25   .25   .25  .0068  .0066  .0082      0  .0011      0
Fe1      0     0    .5  .0090  .0084  .0083      0      0  .0025
F1       0   .25 .1473  .0074  .0286  .0177      0      0      0
F2       0 .4109 .7299  .0229  .0207  .0109      0      0  .0016
F3   .1960 .3840 .4348  .0162  .0188  .0290  .0051  .0011 -.0108
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F7 Fe Na2 Ni
 
Laligant Y, Calage Y, Heger G, Pannetier J, Ferey G
 
Journal of Solid State Chemistry 78 (1989) 66-77
Ordered Magnetic Frustration VII. Na2 Ni Fe F7: Reexamination of
Its Crystal Structure in the True Space Group after Corrections from
Renninger Effect and Refinement of Its Frustrated Magnetic Structure at
4.2 and 55 K
_cod_database_code 1000258
_database_code_amcsd 0013631
7.203 10.255 7.429 90 90 90 Imma
atom    x    y    z
Na1     0    0    0
Na2   .25  .25  .75
Ni1   .25  .25  .25
Fe1     0    0   .5
F1      0  .25 .143
F2      0 .417 .733
F3   .196 .377 .429
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F7 Fe Na2 Ni
 
Laligant Y, Calage Y, Heger G, Pannetier J, Ferey G
 
Journal of Solid State Chemistry 78 (1989) 66-77
Ordered Magnetic Frustration VII. Na2 Ni Fe F7: Reexamination of
Its Crystal Structure in the True Space Group after Corrections from
Renninger Effect and Refinement of Its Frustrated Magnetic Structure at
4.2 and 55 K
_cod_database_code 1000259
_database_code_amcsd 0013632
7.203 10.256 7.429 90 90 90 Imma
atom    x    y    z
Na1     0    0    0
Na2   .25  .25  .75
Ni1   .25  .25  .25
Fe1     0    0   .5
F1      0  .25 .146
F2      0 .416 .734
F3   .196 .376 .428
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Fe1.21PO4X (X=F,OH,H2O)
 
Loiseau T, Lacorre P, Calage Y, Greneche J, Ferey G
 
Journal of Solid State Chemistry 105 (1993) 417-427
Crystal structure and magnetic study of a new iron(III) phosphate,
Fe1.21PO4X (X=F,OH,H2O), isostructural with 3MgSO4*Mg(OH)2*H2O
_cod_database_code 1000351
_database_code_amcsd 0013783
5.184 5.184 13.040 90 90 90 *I4_1/amd
0 -.25 .125
atom x     y     z  occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Fe1  0 .0330 .4988 .303  .0107  .0112  .0122      0      0 -.0002
P1   0   .75  .125       .0104  .0104  .0118      0      0      0
O1   0 .5058 .1912       .0247  .0273  .0322      0      0  .0172
F1   0   .25  .375  .45  .0197  .0197  .0168      0      0      0
O2   0   .25  .375  .55  .0197  .0197  .0168      0      0      0
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Cu6 Fe0.9 O19 V6
 
Permer L, Laligant Y, Ferey G, Calage Y
 
Journal of Solid State Chemistry 107 (1993) 539-546
Crystal structure, magnetic, and Moessbauer studies of
Cu6Fe0.9V6O19: a compound with relaxation effect
_cod_database_code 1000354
_database_code_amcsd 0013787
12.9399 12.9399 7.1275 90 90 120 R-3
atom     x     y     z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Cu1  .0419 .7627 .0997      .0164  .0152  .0189  .0109 -.0005  .0000
Fe1      0     0     0  .9  .0111  .0111  .0078  .0055      0      0
V1   .1552 .0204 .3292      .0072  .0091  .0082  .0043  .0004  .0001
O1   .4801 .5768 .1699      .0091  .0106  .0101  .0068  .0022  .0018
O2   .4566 .6837 .4823      .0083  .0096  .0096  .0040  .0000 -.0002
O3       0     0    .5      .0079   .007  .0081  .0040      0      0
O4   .5980 .7009 .8546      .0111  .0157  .0091  .0080  .0015 -.0005
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Al F5 Fe
 
Fourquet J, Calage Y, Bentrup U
 
Journal of Solid State Chemistry 108 (1994) 189-192
FeAlF5: Synthesis and crystal structure
_cod_database_code 1000363
_database_code_amcsd 0013792
7.4289 6.203 3.5574 90 90 90 Immm
atom    x    y  z
Fe1     0    0  0
Al1     0   .5 .5
F1   .742    0  0
F2     .5    0 .5
F3      0 .209 .5
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F Fe H4 N O4 P
 
Loiseau T, Calage Y, Lacorre P, Ferey G
 
Journal of Solid State Chemistry 111 (1994) 390-396
NH4FePO4F: structural study and magnetic properties
_cod_database_code 1000359
_database_code_amcsd 0013817
12.993 6.468 10.640 90 90 90 Pna2_1
atom     x     y     z
Fe1  .3868 .4911 .0007
Fe2  .2471  .253 .2508
P1   .5015 .3289 .2498
P2   .1841 .4994 .5035
F1   .2748 .4717 .1298
F2   .2279 .0327 .3801
O1   .4867 .4729 .1355
O2   .5168 .4686 .3659
O3   .4037 .2024 .2694
O4   .5964 .1893 .2304
O5   .1164 .3098 .5320
O6   .1166 .6904 .4756
O7   .2538 .5487 .6163
O8   .2552 .4570 .3889
N1   .3897 .7825 .3131
N2   .0996 .6780 .0646
H1    .393  .910  .327
H2    .390  .761  .235
H3    .335  .733  .344
H4    .441  .724  .346
H5    .132  .672     0
H6    .117  .584  .110
H7    .039  .666  .050
H8    .110  .785  .099
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F5 Fe H8 N2
 
Croguennec L, Deniard P, Brec R, Couzi M, Sourisseau C, Fourquet J, Calage Y
 
Journal of Solid State Chemistry 131 (1997) 189-197
Structural and spectroscopic evidence for hydrogen bonding induced (N
H4)(+) cation ordering in beta-(N H4)2 Fe F5 at low temperature
_cod_database_code 1000445
_database_code_amcsd 0013924
6.3385 7.6191 11.0298 90 90 90 Pnma
atom     x     y     z
N1    .428   .25 .1958
N2    .510   .25 .8584
Fe1      0     0     0
F1   .0880   .25 .0082
F2   .2271 .0521 .4367
F3   .1051 .5265 .1595
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F5 Fe H8 N2
 
Croguennec L, Deniard P, Brec R, Couzi M, Sourisseau C, Fourquet J, Calage Y
 
Journal of Solid State Chemistry 131 (1997) 189-197
Structural and spectroscopic evidence for hydrogen bonding induced (N
H4)(+) cation ordering in beta-(N H4)2 Fe F5 at low temperature
_cod_database_code 1000446
_database_code_amcsd 0013925
6.3269 7.6076 10.9802 90 90 90 Pnma
atom    x     y     z
N1   .442   .25  .198
N2   .512   .25  .854
Fe1     0     0     0
F1   .081   .25 -.002
F2   .225  .045  .442
F3   .102  .546  .163
H1   .426 .3573  .872
H2    .64   .25   .90
H3    .55   .25  .766
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Ba7 F26.7 Fe6 H9.3 O7.3
 
Crosnier-Lopez M, Calage Y, Duroy H, Fourquet J
 
Zeitschrift fur Anorganische und Allgemeine Chemie 621 (1995) 1025-1032
Ba7 Fe6 F32 . 2(H2 O): original isolated trimers (Fe3 F16)(7-) in a new
defective jarlite-type compound
_cod_database_code 1000374
_database_code_amcsd 0015811
17.036 11.489 7.620 90 101.48 90 C2/m
atom     x     y     z   occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ba1      0     0     0        .0103  .0079  .0136      0  .0014      0
Ba2  .2646     0 .1298        .0135  .0114  .0140      0  .0049      0
Ba3  .1413 .2957 .3024        .0142  .0198  .0130 -.0011  .0032 -.0016
Fe1  .1740     0 .5443        .0128  .0083  .0097      0  .0027      0
Fe2  .1106 .2433 .7982        .0132  .0095  .0107  .0002  .0059  .0001
F1   .3844 .1306 .0327 .8344  .0283  .0154  .0147 -.0009  .0113 -.0082
O1   .3844 .1306 .0327 .1656  .0283  .0154  .0147 -.0009  .0113 -.0082
F2   .4059 .1436 .3891 .8344  .0300  .0378  .0202  .0071  .0099  .0124
O2   .4059 .1436 .3891 .1656  .0300  .0378  .0202  .0071  .0099  .0124
F3   .2770 .2427 .1898 .8344  .0189  .0238  .0228 -.0059  .0107 -.0002
O3   .2770 .2427 .1898 .1656  .0189  .0238  .0228 -.0059  .0107 -.0002
F4   .1328 .1321 .9981 .8344  .0168  .0140  .0273  .0005  .0061  .0069
O4   .1328 .1321 .9981 .1656  .0168  .0140  .0273  .0005  .0061  .0069
F5   .2372 .1173 .4554 .8344  .0284  .0202  .0231 -.0097  .0063  .0056
O5   .2372 .1173 .4554 .1656  .0284  .0202  .0231 -.0097  .0063  .0056
F6   .0005 .2079 .7935 .8344  .0145  .0191  .0270  .0003  .0043  .0028
O6   .0005 .2079 .7935 .1656  .0145  .0191  .0270  .0003  .0043  .0028
F7   .1086 .1213 .6152 .8344  .0306  .0373  .0387  .0068 -.0012 -.0291
O7   .1086 .1213 .6152 .1656  .0306  .0373  .0387  .0068 -.0012 -.0291
F8   .2560     0 .7614 .8344  .0159  .0262  .0201      0  .0033      0
O8   .2560     0 .7614 .1656  .0159  .0262  .0201      0  .0033      0
F9   .1112     0 .3055 .8344  .0282  .0527  .0132      0  .0002      0
O9   .1112     0 .3055 .1656  .0282  .0527  .0132      0  .0002      0
O10  .4600     0 .7325        .0418  .0245  .0422      0  .0143      0
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Ba7 F32 Fe6 H4 O2
 
Crosnier-Lopez M, Calage Y, Duroy H, Fourquet J
 
Zeitschrift fur Anorganische und Allgemeine Chemie 621 (1995) 1025-1032
Ba7 Fe6 F32 . 2(H2 O): original isolated trimers (Fe3 F16)(7-) in a new
defective jarlite-type compound
_cod_database_code 1000375
_database_code_amcsd 0015812
17.02299 11.482 7.624 90 101.13 90 C2/m
atom     x     y     z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ba1      0     0     0  .0084  .0090  .0132      0  .0005      0
Ba2  .2644     0 .1287  .0121  .0118  .0135      0  .0033      0
Ba3  .1407 .2946 .3026  .0120  .0208  .0130 -.0016  .0018 -.0020
Fe1  .1754     0 .5445  .0113  .0088  .0079      0  .0015      0
Fe2  .1109 .2432 .7998  .0109  .0103  .0104 -.0009  .0032 -.0003
F1   .3852 .1312 .0323  .0249  .0165  .0174 -.0032  .0085 -.0057
F2   .4059 .1437 .3878  .0378  .0309  .0176  .0119  .0098  .0112
F3   .2767 .2413 .1884  .0128  .0247  .0192 -.0042  .0067 -.0010
F4   .1331 .1322 .9990  .0130  .0165  .0245 -.0004  .0007  .0107
F5   .2383 .1171 .4548  .0245  .0234  .0192 -.0095  .0010  .0050
F6   .0013 .2075 .7968  .0103  .0183  .0274  .0017  .0031  .0025
F7   .1104 .1198 .6193  .0234  .0372  .0431  .0103 -.0043 -.0300
F8   .2568     0 .7600  .0204  .0252  .0093      0 -.0024      0
F9   .1129     0 .3083  .0213  .0453  .0134      0 -.0043      0
O10  .4610     0 .7342  .0364  .0302  .0509      0   .020      0
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Total number of retrieved datasets: 21
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