pos listlengths 1 20 | cell listlengths 3 3 | atomic_numbers listlengths 1 20 | pbc listlengths 3 3 | ids stringlengths 4 18 | space_group stringclasses 179
values | chemical_system stringlengths 1 19 | energy_above_hull float64 0 0.1 | dft_band_gap float64 0 9.72 ⌀ | dft_bulk_modulus float64 0.54 401 ⌀ | dft_mag_density float64 -0.18 0.24 ⌀ | hhi_score float64 0 9.1k | ml_bulk_modulus float64 1.09 399 |
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] | alex<agm001828889> | Pmm2 | Mo-Pd | 0.085454 | null | null | 0.000434 | 7,376.112717 | 188.550354 |
[
[
-2.0643862780936784e-16,
3.3713986425,
0.7926859409194392
],
[
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1.1237995475,
4.181149919080561
],
[
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3.3713986425,
3.2844411252467243
],
[
1.373833505,
1.1237995475,
1.689394734753277
]
] | [
[
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0,
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[
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4.49519819,
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],
[
0,
0,
4.97383586
]
] | [
42,
42,
46,
46
] | [
1,
1,
1
] | alex<agm002162916> | Pmma | Mo-Pd | 0.067761 | null | null | -0.000309 | 6,719.915003 | 218.712234 |
[
[
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],
[
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],
[
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5.60965850637704
],
[
3.368068965,
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0.8133535563770403
],
[
1.12268965499... | [
[
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0,
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],
[
-3.4975623383306787e-16,
5.71195277,
3.4975623383306787e-16
],
[
0,
0,
9.5926099
]
] | [
42,
42,
42,
42,
42,
42,
42,
42,
46,
46,
46,
46,
46,
46,
46,
46
] | [
1,
1,
1
] | alex<agm004463035> | Pnma | Mo-Pd | 0.093745 | null | null | -0.000001 | 6,719.915003 | 218.996841 |
[
[
0,
0,
0
],
[
1.36415796,
1.36415796,
2.06686899
]
] | [
[
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0,
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],
[
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2.72831592,
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],
[
0,
0,
4.13373798
]
] | [
42,
46
] | [
1,
1,
1
] | alex<agm002101700> | P4/mmm | Mo-Pd | 0.097895 | null | null | -0.000141 | 6,719.915003 | 218.153915 |
[
[
2.18262371,
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[
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],
[
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4.421911024400751,
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[
2.18262371,
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4.164583293389817
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[
... | [
[
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0,
2.672943140194621e-16
],
[
-3.1435204511870246e-16,
5.13375849,
3.1435204511870246e-16
],
[
0,
0,
5.68883035
]
] | [
71,
71,
29,
29,
29,
29,
29,
29
] | [
1,
1,
1
] | alex<agm002207994> | Pmmn | Cu-Lu | 0.045612 | null | null | -0.000181 | 2,265.709441 | 99.5998 |
[
[
0.05813349815617043,
1.2533147556824071,
0.6441053589610032
],
[
2.123311632078641,
3.1088184192094284,
1.723360783623225
],
[
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3.448244071494136,
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],
[
0.9367472050353906,
0.9138891033976997,
3.3023672732411007
]
] | [
[
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0,
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],
[
-0.5038963933488035,
4.362133174891835,
-2.3436388408394233
],
[
0,
0,
5.28362636
]
] | [
42,
42,
46,
46
] | [
1,
1,
1
] | alex<agm002101707> | P-1 | Mo-Pd | 0.098967 | null | null | -0.00002 | 6,719.915003 | 207.058456 |
[
[
0,
0,
0
],
[
-2.4721549293335703,
0,
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],
[
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0,
2.550826334404773
],
[
-2.480177079885919,
-3.9716111754162187,
1.222994273436063
],
[
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-3.9970283732374283,
-1.2418989065806438
],
... | [
[
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0,
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[
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-5.914882811254186,
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],
[
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0,
4.991601497383201
]
] | [
42,
46,
46,
46,
46,
46,
46,
46,
46
] | [
1,
1,
1
] | alex<agm003300249> | I4/mmm | Mo-Pd | 0 | null | null | -0.000001 | 7,726.551251 | 183.140137 |
[
[
0,
0,
0
],
[
1.275718177666074,
0,
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[
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0,
1.1554394276586957
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[
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[
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1.97782519,
3.1375109674024575
],
[
0.6114901196... | [
[
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0,
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],
[
-2.4221372882065054e-16,
3.95565038,
2.4221372882065054e-16
],
[
0,
0,
6.21776956
]
] | [
42,
46,
46,
46,
46,
46
] | [
1,
1,
1
] | alex<agm002361045> | Cmmm | Mo-Pd | 0.029385 | null | null | 0.000941 | 7,587.545379 | 187.43956 |
[
[
-1.414127765,
-0.8164470457912741,
-2.296951992764
],
[
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0.8164470457912737,
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],
[
0,
0,
0
]
] | [
[
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[
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],
[
0,
0,
-6.935786
]
] | [
13,
13,
30
] | [
1,
1,
1
] | mp-1206713 | P-3m1 | Al-Zn | 0.009803 | 0 | null | -0.000011 | 1,493.147991 | 83.010231 |
[
[
-1.9668258790433208,
1.232864060245784,
-1.6639143632806188
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[
-0.7223830850725286,
-1.2328640602457837,
-2.401361041079587
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[
0,
0,
0
]
] | [
[
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0,
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[
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3.6961745868635756,
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[
0.5234762713379555,
-3.6961745868635756,
-3.1340987522302117
]
] | [
13,
13,
30
] | [
1,
1,
1
] | alex<agm003157878> | Immm | Al-Zn | 0.029285 | null | null | 0.00007 | 1,493.147991 | 72.991905 |
[
[
-1.4679210902360682e-8,
0.048257326986183985,
0.009180087707010063
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[
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1.8549737696207937
],
[
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3.278634046723289,
3.643864593414296
],
[
-1.374856230129048e-8,
3.7463853371812026,
0.763195592... | [
[
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0,
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],
[
-1.4691355037716693,
4.881029886199149,
-1.4601820210015606
],
[
0,
0,
6.90161078
]
] | [
13,
13,
13,
13,
30,
30
] | [
1,
1,
1
] | alex<agm003195731> | Cm | Al-Zn | 0.065494 | null | null | -0.000207 | 1,493.147991 | 74.761536 |
[
[
2.329184375316401,
-1.0672971834421499,
1.1680625363520598
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[
0.9139870972884764,
1.0672971834421496,
2.3302868840796367
],
[
0,
0,
0
]
] | [
[
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-3.2045654397293593,
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[
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0,
-1.2720394395683023
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[
-0.498920377625798,
3.2045654397293593,
3.4983494204316976
]
] | [
13,
13,
30
] | [
1,
1,
1
] | alex<agm003157877> | I4/mmm | Al-Zn | 0.094128 | null | null | -0 | 1,493.147991 | 80.536781 |
[
[
3.0118488,
3.609865443628284,
4.2045093686621176
],
[
1.0039495999999999,
1.9084852063717168,
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[
3.0118488,
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2.201293196337883
],
[
1.0039495999999999,
4.667660531371717,
10.610311933662118
],
[
3.0118487999... | [
[
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0,
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],
[
-3.3790152300476083e-16,
5.51835065,
3.3790152300476083e-16
],
[
0,
0,
12.81160513
]
] | [
71,
71,
71,
71,
71,
71,
71,
71,
29,
29,
29,
29
] | [
1,
1,
1
] | alex<agm002208655> | Pnma | Cu-Lu | 0.069274 | null | null | -0.000193 | 2,854.102738 | 69.741905 |
[
[
3.445916595,
2.1611959650886874,
2.096717781022709
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[
1.1486388649999997,
2.150107981147599,
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[
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[
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],
[
3.445916595,
... | [
[
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0,
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],
[
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4.311303946236286,
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],
[
0,
0,
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]
] | [
13,
13,
13,
13,
30,
30
] | [
1,
1,
1
] | alex<agm003195727> | Cmcm | Al-Zn | 0.07421 | null | null | 0.000022 | 1,493.147991 | 68.641983 |
[
[
1.414234104415059,
4.79731876374254,
3.2433975051710697
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[
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[
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5.490870287801152
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[
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0.274994821630218,
2.025344727715738
... | [
[
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0,
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],
[
-1.414234089711649,
5.072313585372759,
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],
[
0,
0,
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]
] | [
13,
13,
13,
13,
30,
30
] | [
1,
1,
1
] | alex<agm003195728> | C2/m | Al-Zn | 0.058712 | null | null | -0.000176 | 1,493.147991 | 75.113251 |
[
[
1.0252670924999998,
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[
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[
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[
3.0758012775,
3.4099981713507628,
6.517043125943751
],
[
3.075... | [
[
4.10106837,
0,
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],
[
-3.3595971936609237e-16,
5.48663859,
3.3595971936609237e-16
],
[
0,
0,
8.66348125
]
] | [
13,
13,
13,
13,
13,
13,
13,
13,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm002251156> | Pnma | Al-Zn | 0.033899 | null | null | -0.000197 | 1,493.147991 | 66.460464 |
[
[
-1.2320590565628515e-16,
2.012105135,
2.012105135
],
[
2.012105135,
0,
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],
[
2.012105135,
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],
[
0,
0,
0
]
] | [
[
4.02421027,
0,
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[
-2.464118113125703e-16,
4.02421027,
2.464118113125703e-16
],
[
0,
0,
4.02421027
]
] | [
13,
13,
13,
30
] | [
1,
1,
1
] | mp-983585 | Pm-3m | Al-Zn | 0.026135 | 0 | null | null | 1,402.231948 | 76.710434 |
[
[
-0.5536024749812379,
-1.1124726701675363,
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[
-1.3751553257750182,
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[
-2.1967081765687992,
1.1124726701675367,
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[
-2.463950577211721,
-2.187950768595415,
-3.7620891800... | [
[
-2.7503106515500364,
0,
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[
-0.5727201486766306,
4.37590153719083,
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],
[
0.5727201486766306,
-4.37590153719083,
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]
] | [
13,
13,
13,
30
] | [
1,
1,
1
] | alex<agm003162439> | Immm | Al-Zn | 0.089861 | null | null | 0 | 1,402.231948 | 77.540398 |
[
[
1.5222508603103282,
-2.407488111200255,
-0.010642369999008488
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[
0.7662532636872971,
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[
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[
0,
0,
0
]
] | [
[
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0,
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[
0.263206761476233,
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],
[
-2.7812949591444234,
0,
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]
] | [
13,
13,
13,
30
] | [
1,
1,
1
] | alex<agm003190369> | C2/m | Al-Zn | 0.024568 | null | null | 0.000022 | 1,402.231948 | 79.412224 |
[
[
1.128302233880067,
-0.9088087767932242,
2.4446318150000006
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[
2.592330874390921,
0.9088087767932246,
0.7274003618525401
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[
2.256604467760134,
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6.520225356613335e-17
],
[
0,
0,
0
]
] | [
[
0.7925758272492799,
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[
3.720633108270988,
0,
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[
-0.7925758272492799,
3.6352351071728983,
3.1720321768525404
]
] | [
13,
13,
13,
30
] | [
1,
1,
1
] | alex<agm002134137> | I4/mmm | Al-Zn | 0.031059 | null | null | 0.000129 | 1,402.231948 | 68.239433 |
[
[
0,
0,
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[
0,
0,
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[
-1.395544435,
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],
[
-1.395544435,
0.8057179552133343,
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]
] | [
[
-1.3955444350000001,
-2.4171538656400027,
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[
-1.3955444349999997,
2.4171538656400027,
1.7090490253906514e-16
],
[
0,
0,
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]
] | [
13,
13,
13,
30
] | [
1,
1,
1
] | alex<agm003162437> | P-6m2 | Al-Zn | 0.052375 | null | null | 0.000039 | 1,402.231948 | 72.61068 |
[
[
0,
0,
2.580676261365191
],
[
1.372961565,
0,
8.406964929647954e-17
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[
0,
0,
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],
[
1.372961565,
0,
5.07092754
]
] | [
[
2.74592313,
0,
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[
-1.3729615660593038,
2.4338984053637054,
1.7110999046457797e-16
],
[
0,
0,
10.14185508
]
] | [
13,
13,
13,
30
] | [
1,
1,
1
] | alex<agm003162438> | Cmmm | Al-Zn | 0.084398 | null | null | 0.00026 | 1,402.231948 | 75.089134 |
[
[
1.87891588815492,
3.6970053752434775,
3.5704377469743126e-16
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[
1.225834028602801,
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[
0.5727521690506823,
1.2476311934853028,
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],
[
0,
0,
2.48659179
]
] | [
[
2.78177773,
0,
1.703347596491945e-16
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[
-0.3301096727943979,
4.9446365687287805,
3.0344565178578316e-16
],
[
0,
0,
4.97318358
]
] | [
13,
13,
13,
30
] | [
1,
1,
1
] | alex<agm003807169> | P2/m | Al-Zn | 0.078861 | null | null | 0 | 1,402.231948 | 78.245872 |
[
[
1.100704305771789,
1.1855531932452492,
4.042909717662959
],
[
2.1785113365282816,
-1.1855531932452492,
1.5330115700069116
],
[
0,
0,
0
]
] | [
[
0.24306544425379392,
-3.2701948594105477,
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],
[
3.2792156423000707,
0,
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],
[
-0.24306544425379392,
3.2701948594105477,
5.575921287669869
]
] | [
71,
71,
29
] | [
1,
1,
1
] | alex<agm002146644> | I4/mmm | Cu-Lu | 0.044932 | null | null | 0.000061 | 2,854.102738 | 78.217789 |
[
[
3.6243977175,
0.8052707167810335,
1.3948977253458117
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[
3.6243977175,
3.2208922547205,
2.7936820680604373
],
[
3.6243977175,
3.22205469083969,
0.006690732596153719
],
[
1.2081325724999998,
4.026067665299716,
1.403419241833687
],
[
1.2081325725,... | [
[
4.83253029,
0,
2.959071375715565e-16
],
[
-2.9583415426064713e-16,
4.83133838208075,
-2.771992351101043
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[
0,
0,
5.57007829
]
] | [
13,
13,
13,
13,
13,
13,
30,
30
] | [
1,
1,
1
] | alex<agm002134139> | P6_3/mmc | Al-Zn | 0.065012 | null | null | -0.000061 | 1,402.231948 | 69.763939 |
[
[
0.41314788583241113,
4.815449773631356,
7.090693912500001
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[
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[
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],
[
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2.3635646375000006
],
... | [
[
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0,
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[
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5.50896658,
3.3732691444033707e-16
],
[
0,
0,
9.45425855
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] | [
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13,
13,
13,
13,
13,
13,
13,
13,
13,
13,
13,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003217937> | Pnma | Al-Zn | 0.028397 | null | null | 0.000027 | 1,402.231948 | 77.336876 |
[
[
0.002294047734187506,
0.010278167321777627,
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[
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[
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[
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3.3860423281521284
... | [
[
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0,
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[
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[
0,
0,
5.37845263
]
] | [
13,
13,
13,
30
] | [
1,
1,
1
] | alex<agm003162440> | P1 | Al-Zn | 0.066912 | null | null | 0.00006 | 1,402.231948 | 74.547707 |
[
[
1.4128329049999997,
2.334144197932448,
-0.8180142200560583
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[
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0,
2.473333055
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[
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2.334144197932448,
1.6553188349439414
],
[
0,
0,
0
]
] | [
[
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0,
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[
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4.668288395864896,
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],
[
0,
0,
4.94666611
]
] | [
13,
13,
13,
30
] | [
1,
1,
1
] | alex<agm003190367> | Cmmm | Al-Zn | 0.023184 | null | null | 0.000046 | 1,402.231948 | 77.58445 |
[
[
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-0.6368576863171573,
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[
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[
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[
0,
0,
0
]
] | [
[
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[
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0,
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],
[
0,
0,
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]
] | [
13,
13,
13,
30
] | [
1,
1,
1
] | alex<agm003190366> | R-3m | Al-Zn | 0.034436 | null | null | -0.000025 | 1,402.231948 | 80.003517 |
[
[
0,
0,
0
],
[
2.5474739431735274,
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[
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1.0058940866384987,
4.962110855430115
],
[
3.0332133676730533,
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6.192519477247315
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[
0.4825538853622792,
0.501292423304695... | [
[
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],
[
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0,
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],
[
-0.1338754794127461,
3.5132174332835726,
8.665412652925427
]
] | [
13,
13,
13,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003257737> | I4/mmm | Al-Zn | 0.068121 | null | null | -0 | 1,687.348872 | 78.443977 |
[
[
0,
0,
0
],
[
-0.5296362216629888,
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-2.567863656651482
],
[
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-1.7542047060590924
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[
0.14796527221866254,
-4.154167022774611,
0.7173880454882413
],
[
0.40995246013881187,
-1.728956362... | [
[
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0,
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[
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2.7049824972894254
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[
-2.780452648756971,
0,
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]
] | [
13,
13,
13,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003290138> | C2/m | Al-Zn | 0.059307 | null | null | -0.000161 | 1,687.348872 | 76.922447 |
[
[
1.284824919949727,
2.053010155,
3.707305534112958
],
[
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0,
1.8497225666186883
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[
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2.053010155,
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],
[
3.2158909312757835,
0,
3.0464524683374434
],
[
2.5721164310322346,
2.05301... | [
[
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0,
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[
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4.10602031,
2.5142123149377614e-16
],
[
0,
0,
6.23285862
]
] | [
13,
13,
13,
13,
13,
30
] | [
1,
1,
1
] | alex<agm003203405> | Cmmm | Al-Zn | 0.012154 | null | null | -0 | 1,293.875159 | 76.651649 |
[
[
-7.4750077236542556e-34,
-9.759502863212915e-17,
1.6529782096251096
],
[
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-1.4315211214374641,
4.086269815187445
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[
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4.086269815187446
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[
2.395732095,
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2.45637946
],
[
2... | [
[
4.79146419,
0,
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],
[
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4.254574027388603,
2.456379460000001
],
[
2.6051752321884584e-16,
-4.254574027388603,
2.456379459999999
]
] | [
13,
13,
13,
13,
13,
30
] | [
1,
1,
1
] | alex<agm003195738> | P-62m | Al-Zn | 0.055379 | null | null | 0.000038 | 1,293.875159 | 73.745155 |
[
[
2.8590228992654048,
0,
6.626944263952312
],
[
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0,
4.622694762558379
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[
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0,
2.0018124030120665
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[
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2.42018125,
6.167236421584325
],
[
2.220293838833174,
2.42018125,
3.533786446856... | [
[
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0,
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[
-2.9638672211689406e-16,
4.8403625,
2.9638672211689406e-16
],
[
0,
0,
7.21837673
]
] | [
13,
13,
13,
13,
13,
30
] | [
1,
1,
1
] | alex<agm003195739> | Amm2 | Al-Zn | 0.05626 | null | null | -0 | 1,293.875159 | 76.293335 |
[
[
0,
0,
0
],
[
1.1547825149810087,
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2.5839729
],
[
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[
2.3095650299620174,
-1.88629935949214,
1.0387598849135381e-16
]
] | [
[
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[
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0,
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[
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3.7725987189842805,
3.4472977411502637
]
] | [
40,
22,
22,
22
] | [
1,
1,
1
] | alex<agm002190826> | I4/mmm | Ti-Zr | 0.085394 | null | null | 0.000055 | 1,988.476525 | 112.944672 |
[
[
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2.901609789719165,
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[
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[
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[
0,
0,
0
],
[
-1.0685745858343551e-16,
1.7451147328002463... | [
[
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0,
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],
[
-2.4468466500378694e-16,
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-0.43307201842218246
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[
0,
0,
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]
] | [
3,
3,
3,
3,
3,
3,
3,
20,
20,
12,
12,
12
] | [
1,
1,
1
] | alex<agm003353073> | Cmmm | Ca-Li-Mg | 0.091799 | null | null | 0.000052 | 1,788.954071 | 19.152285 |
[
[
-1.2587183472406591,
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[
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[
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[
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1.481566256211991,
0.6334796674370605
... | [
[
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[
0,
0,
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],
[
-3.0864587103400227,
4.530769525465063,
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]
] | [
71,
71,
71,
71,
29,
29
] | [
1,
1,
1
] | alex<agm002208656> | I4/mcm | Cu-Lu | 0.070853 | null | null | 0.013551 | 2,854.102738 | 58.695522 |
[
[
-1.7080483510251161e-16,
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[
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[
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[
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0,
0
],
[
-1.7080483510251161e-16,
2.7894546447421833,... | [
[
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0,
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[
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[
0,
0,
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]
] | [
13,
13,
13,
30,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm002134141> | Cmmm | Al-Zn | 0.03546 | null | null | -0.000345 | 1,721.441156 | 60.00069 |
[
[
0,
0,
0
],
[
-2.5790721071595137,
0,
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[
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0,
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[
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[
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],
... | [
[
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0,
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[
-1.9313777732013575,
-5.893264293170352,
-0.6699635915669283
],
[
-3.8627555453023614,
0,
4.897831656864657
]
] | [
13,
13,
13,
13,
13,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003268303> | I4/mmm | Al-Zn | 0.026507 | null | null | 0 | 1,593.811991 | 72.142609 |
[
[
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],
[
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[
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[
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],
[
... | [
[
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0,
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[
-1.3041483398983122,
6.871172642443505,
-0.06708498536729263
],
[
0,
0,
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]
] | [
13,
13,
13,
13,
13,
13,
13,
13,
13,
13,
30,
30,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003217938> | P-1 | Al-Zn | 0.0718 | null | null | -0 | 1,533.330707 | 72.109428 |
[
[
0,
0,
0
],
[
-1.7630413601177919e-16,
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[
0,
0,
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],
[
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[
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],
[
-1.76304... | [
[
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0,
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],
[
-3.5260827202355837e-16,
5.758530088333354,
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],
[
0,
0,
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]
] | [
13,
13,
13,
13,
13,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003260894> | Cmmm | Al-Zn | 0.029954 | null | null | -0 | 1,533.330707 | 73.20813 |
[
[
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4.823885700621247,
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[
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[
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],
[
1.4757663001026697e-8,
4.164233342608344,
2.261336789872629... | [
[
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0,
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],
[
-1.4097528590916968,
5.729721561742036,
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],
[
0,
0,
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]
] | [
13,
13,
13,
13,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003290139> | C2/m | Al-Zn | 0.053796 | null | null | -0.000597 | 1,580.642671 | 77.278999 |
[
[
1.443332175,
0,
1.017233334921016
],
[
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1.443332175,
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],
[
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0,
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],
[
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1.443332175,
2.939308116089467
]
] | [
[
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0,
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],
[
-1.7675721282201376e-16,
2.88666435,
1.7675721282201376e-16
],
[
0,
0,
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]
] | [
13,
13,
30,
30
] | [
1,
1,
1
] | alex<agm003190362> | P4/nmm | Al-Zn | 0.011683 | null | null | -0.000586 | 1,637.165893 | 80.112144 |
[
[
2.1781460041900336,
2.4398917174098544,
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[
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[
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],
[
1.401230798503744,
4.305056428843653,
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]
] | [
[
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0,
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[
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],
[
0,
0,
5.34283853
]
] | [
13,
13,
30,
30
] | [
1,
1,
1
] | alex<agm003162415> | P-1 | Al-Zn | 0.066509 | null | null | -0 | 1,637.165893 | 70.851166 |
[
[
-1.41507262,
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[
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[
-1.41507262,
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[
-1.4150726200000001,
-0.8169925580798693,
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]
] | [
[
-1.4150726200000001,
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[
-1.4150726199999997,
2.450977674239607,
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],
[
0,
0,
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]
] | [
13,
13,
30,
30
] | [
1,
1,
1
] | alex<agm003162412> | P-3m1 | Al-Zn | 0.04385 | null | null | 0.000084 | 1,637.165893 | 78.464096 |
[
[
0,
0,
0
],
[
-2.5525005512450174,
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[
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[
-5.1327564532305585,
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1.0531128308613298
],
[
-6.750555161851373,
-3.205628764... | [
[
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0,
-1.8250162611808958
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[
-1.860611140339666,
-4.225493605158094,
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],
[
-3.721222286378362,
0,
2.8812923888191047
]
] | [
71,
29,
29,
29,
29
] | [
1,
1,
1
] | alex<agm002209215> | I4/m | Cu-Lu | 0.067041 | null | null | 0.000086 | 2,152.327968 | 107.705238 |
[
[
0,
0,
0
],
[
1.077730178596319,
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],
[
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],
[
2.55156960693296,
0.8911793395056757,
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]
] | [
[
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-3.5647173580227025,
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],
[
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0,
-1.5728339680046768
],
[
-0.6816209288559969,
3.5647173580227025,
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]
] | [
13,
13,
30,
30
] | [
1,
1,
1
] | alex<agm003162417> | I4_1/amd | Al-Zn | 0.032975 | null | null | 0.000065 | 1,637.165893 | 77.696182 |
[
[
-2.2569566646187886,
-0.5762426125180045,
-3.403542686529954
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[
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0.5762426125180047,
-1.5666169605794056
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[
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-2.7669974593265048,
-2.5539379950848975
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[
-2.0103287000096604,
2.7669974593265048,
-2.416221652024... | [
[
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0,
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[
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4.452084583645406,
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[
0.5565424536656753,
-4.452084583645406,
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]
] | [
13,
13,
30,
30
] | [
1,
1,
1
] | alex<agm003162416> | Imma | Al-Zn | 0.083455 | null | null | -0 | 1,637.165893 | 74.461876 |
[
[
0,
0,
0
],
[
1.31215961,
0,
2.48323611
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] | [
[
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0,
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[
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[
0,
0,
4.96647222
]
] | [
13,
30
] | [
1,
1,
1
] | alex<agm004027300> | Cmmm | Al-Zn | 0.071194 | null | null | 0 | 1,637.165893 | 87.704506 |
[
[
1.395687515,
1.395687515,
1.7092242478546736e-16
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[
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0,
2.04610521
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] | [
[
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0,
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[
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2.79137503,
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[
0,
0,
4.09221042
]
] | [
13,
30
] | [
1,
1,
1
] | alex<agm003162413> | P4/mmm | Al-Zn | 0.027887 | null | null | 0.000059 | 1,637.165893 | 77.70668 |
[
[
0,
0,
0
],
[
-1.413634835,
0.8161624525230824,
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]
] | [
[
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[
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[
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0,
-4.69475595
]
] | [
13,
30
] | [
1,
1,
1
] | alex<agm003157205> | P-6m2 | Al-Zn | 0.05315 | null | null | 0 | 1,637.165893 | 75.202477 |
[
[
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-0.31121546626480556,
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[
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[
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[
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[
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[
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0,
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[
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0,
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] | [
13,
13,
30,
30
] | [
1,
1,
1
] | alex<agm003190364> | R-3m | Al-Zn | 0.019471 | null | null | -0.000063 | 1,637.165893 | 80.820602 |
[
[
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[
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[
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[
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[
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[
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0,
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] | [
13,
13,
13,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003278504> | Cm | Al-Zn | 0.038931 | null | null | -0 | 1,637.165893 | 72.922173 |
[
[
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[
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[
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[
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[
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0,
... | [
[
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[
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[
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0,
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] | [
83,
83,
8,
8,
8
] | [
1,
1,
1
] | mp-1017552 | P-3m1 | Bi-O | 0.070916 | 1.1218 | 117.399639 | -0.000003 | 5,433.447793 | 117.935036 |
[
[
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[
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[
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[
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[
1.238337... | [
[
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[
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[
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] | [
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13,
13,
13,
13,
13,
30,
30,
30,
30,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm004469707> | Pnma | Al-Zn | 0.070508 | null | null | 0 | 1,637.165893 | 72.889427 |
[
[
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[
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[
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[
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0.0255467227299881... | [
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[
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[
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0,
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] | [
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13,
13,
13,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm004469701> | I4/mmm | Al-Zn | 0.069536 | null | null | -0.000129 | 1,637.165893 | 74.428436 |
[
[
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[
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[
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[
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[
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0,
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[
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[
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] | [
13,
13,
30,
30
] | [
1,
1,
1
] | alex<agm003162419> | Pmma | Al-Zn | 0.07247 | null | null | -0.0002 | 1,637.165893 | 67.74527 |
[
[
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[
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[
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[
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[
0.985... | [
[
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[
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[
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] | [
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13,
13,
13,
30,
30,
30,
30,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm002250713> | Pnma | Al-Zn | 0.02865 | null | null | 0 | 1,746.112448 | 67.324036 |
[
[
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[
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[
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[
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[
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[
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[
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0,
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] | [
13,
13,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003195733> | C2/m | Al-Zn | 0.057466 | null | null | -0 | 1,746.112448 | 73.614685 |
[
[
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[
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[
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[
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[
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[
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0,
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[
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] | [
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13,
13,
13,
30,
30,
30,
30,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003212257> | I4_1/amd | Al-Zn | 0.027749 | null | null | 0.000117 | 1,746.112448 | 60.586937 |
[
[
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0
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[
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[
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1.1796884933877647,
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] | [
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[
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] | [
13,
30,
30
] | [
1,
1,
1
] | alex<agm003278498> | Immm | Al-Zn | 0.030642 | null | null | -0 | 1,746.112448 | 75.840698 |
[
[
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[
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[
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[
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[
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[
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0,
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[
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] | [
13,
13,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003195735> | I4_1/amd | Al-Zn | 0.045949 | null | null | 0.000739 | 1,746.112448 | 46.723759 |
[
[
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[
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[
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[
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... | [
[
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[
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[
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] | [
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83,
83,
83,
83,
83,
8,
8,
8,
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8,
8,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | mp-1105780 | P31c | Bi-O | 0.046611 | 1.4875 | null | null | 5,433.447793 | 34.577381 |
[
[
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0
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[
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[
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0.911910348961319,
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] | [
[
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[
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0,
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[
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2.744754427062926,
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] | [
13,
30,
30
] | [
1,
1,
1
] | alex<agm003161328> | I4/mmm | Al-Zn | 0.025185 | null | null | -0 | 1,746.112448 | 79.866997 |
[
[
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0
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[
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[
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[
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] | [
[
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[
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0,
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[
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0,
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]
] | [
13,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003190358> | R-3m | Al-Zn | 0.010118 | null | null | -0.000163 | 1,791.207635 | 82.607819 |
[
[
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0
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[
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[
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0,
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[
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] | [
[
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0,
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[
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[
0,
0,
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]
] | [
13,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003190357> | Cmmm | Al-Zn | 0.023932 | null | null | 0 | 1,791.207635 | 79.000999 |
[
[
0,
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0
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[
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[
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[
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]
] | [
[
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0,
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[
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[
0,
0,
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]
] | [
13,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003190359> | P4/mmm | Al-Zn | 0.023611 | null | null | 0 | 1,791.207635 | 69.770889 |
[
[
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[
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[
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[
-1.340328172135594,
-1.4375575983784181,
-5.609128742116... | [
[
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[
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0,
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[
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]
] | [
13,
13,
30,
30,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm002197908> | I4/mmm | Al-Zn | 0.02593 | null | null | 0 | 1,791.207635 | 80.292244 |
[
[
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0
],
[
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[
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[
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] | [
[
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[
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[
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] | [
13,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003190360> | Pmmm | Al-Zn | 0.026115 | null | null | -0.000347 | 1,791.207635 | 80.54509 |
[
[
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0
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[
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[
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[
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1.98264314,
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] | [
[
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[
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[
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0,
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] | [
13,
30,
30,
30
] | [
1,
1,
1
] | alex<agm002135761> | Pm-3m | Al-Zn | 0.027779 | null | null | -0 | 1,791.207635 | 78.351768 |
[
[
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[
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[
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[
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-0.310746272545221,
-2.11648968315... | [
[
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0,
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[
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[
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-4.205334180841437,
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] | [
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30,
30,
30
] | [
1,
1,
1
] | alex<agm003162405> | Imm2 | Al-Zn | 0.048595 | null | null | 0 | 1,791.207635 | 63.449856 |
[
[
1.5142665590915674,
0,
9.272208473236823e-17
],
[
3.0101087309084322,
2.57444128,
2.7744445500000006
],
[
3.011522824405322,
2.57444128,
3.4204165303059946e-16
],
[
1.512852465594678,
0,
2.77444455
],
[
3.7779973327717276,
0,
1.4019266646... | [
[
4.52437529,
0,
2.770380858519939e-16
],
[
-3.1527812731448147e-16,
5.14888256,
3.1527812731448147e-16
],
[
0,
0,
5.5488891
]
] | [
13,
13,
30,
30,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003260891> | Pmmn | Al-Zn | 0.052039 | null | null | -0 | 1,791.207635 | 69.783188 |
[
[
-6.095032159759656,
-4.431989907564268,
-9.842570645205965
],
[
-0.9750879936706025,
-0.7090331984574169,
-1.5746221203488298
],
[
-4.510148070385733,
-3.2795447514682587,
-7.2832185031262275
],
[
-2.559972083044526,
-1.861478354553426,
-4.13397426242856... | [
[
-1.6659179685838015,
-5.141023106021684,
-2.6902098077773973
],
[
-5.404202184846458,
0,
-2.6902098077773973
],
[
0,
0,
-6.03677315
]
] | [
83,
83,
83,
83,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | mp-1183524 | R-3c | Bi-O | 0.028656 | 2.0782 | null | null | 5,433.447793 | 51.429642 |
[
[
-1.3772233976596064e-16,
2.249176495,
1.5353185146549757
],
[
0,
0,
4.568240695001849
],
[
1.52023396,
0,
2.283331417120952
],
[
1.5202339599999999,
2.249176495,
3.8165597547884933
]
] | [
[
3.04046792,
0,
1.8617496530691055e-16
],
[
-2.754446795319213e-16,
4.49835299,
2.754446795319213e-16
],
[
0,
0,
4.57629502
]
] | [
13,
30,
30,
30
] | [
1,
1,
1
] | alex<agm001828520> | Pmm2 | Al-Zn | 0.056439 | null | null | 0.000034 | 1,791.207635 | 71.401787 |
[
[
0,
0,
0
],
[
1.4704622957409779,
-2.316720217292377,
-0.02252351212467121
],
[
0.733638597740611,
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-2.453326069716045
],
[
-0.49866642037634235,
-3.464103103201778,
-1.645114854173911
]
] | [
[
2.7059524141176876,
0,
-0.8202269903593862
],
[
0.2349721773642681,
-4.633440434584754,
0.7751799661100438
],
[
-2.7059524141176876,
0,
-4.053393899640613
]
] | [
13,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003190361> | C2/m | Al-Zn | 0.025705 | null | null | 0.000023 | 1,791.207635 | 73.089745 |
[
[
0,
0,
0
],
[
1.0908256079044694,
-0.8921276174900896,
2.448889855
],
[
2.5500720357867253,
0.8921276174900896,
0.8271001367709382
],
[
2.181651215808939,
-1.7842552349801792,
6.1551969849378e-17
]
] | [
[
0.7224047879266834,
-3.5685104699603585,
1.621789718229062
],
[
3.640897643691195,
0,
-1.621789718229062
],
[
-0.7224047879266834,
3.5685104699603585,
3.2759899917709383
]
] | [
13,
30,
30,
30
] | [
1,
1,
1
] | alex<agm002135759> | I4/mmm | Al-Zn | 0.030239 | null | null | 0.000036 | 1,791.207635 | 73.644073 |
[
[
1.4318250140145163,
5.095576192764669,
4.60857529889483
],
[
1.4318250146785716,
1.6619893668759942,
1.5500912837533882
],
[
-6.585407461762732e-10,
3.405073432393348,
3.0399559540858294
],
[
-7.701877803587618e-10,
3.982359287120131,
0.34833998366958124... | [
[
2.86365003,
0,
1.753479921558861e-16
],
[
-1.4318250159906845,
5.122467096031999,
-1.9368186209711764
],
[
0,
0,
6.56988649
]
] | [
13,
30,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003278551> | Cm | Al-Zn | 0.039224 | null | null | 0 | 1,831.40801 | 71.168259 |
[
[
2.6638913895362855,
0,
7.016144038823492
],
[
0.8626493776707088,
0,
4.743872843627899
],
[
1.764151684907974,
0,
2.068304439558965
],
[
1.21898572773118,
2.341187455,
6.703434141653457
],
[
2.117562107113361,
2.341187455,
4.0117754280099... | [
[
2.6872219309575165,
0,
-0.4886577707619835
],
[
-2.867127722969688e-16,
4.68237491,
2.867127722969688e-16
],
[
0,
0,
7.63310089
]
] | [
13,
30,
30,
30,
30,
30
] | [
1,
1,
1
] | alex<agm003195744> | Amm2 | Al-Zn | 0.043609 | null | null | -0.000174 | 1,831.40801 | 61.652863 |
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