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
[ [ 0.4614556678380422, -0.7541524999003695, -4.01514846728639 ], [ -0.17870648120405638, -3.7843971194974526, -0.6466543089406668 ], [ -0.5730419390790514, -1.6737673571300884, -2.0735679321579474 ], [ 0.855791125713038, -2.864782262267734, -2.5882348440691...
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[ 73, 73, 5, 5, 76, 76 ]
[ 1, 1, 1 ]
alex<agm003611006>
C2/m
B-Os-Ta
0.009074
null
null
0
6,862.149558
274.182953
[ [ -2.220446049250313e-16, 3.4728159262812555, 8.51661481338084e-16 ], [ 2.220446049250313e-16, 10.418447778843769, 5.551115123125783e-16 ], [ 3.6350947308340727e-16, 6.945631852562511, 7.588976480565889e-16 ], [ -0.8525602264575852, 8.151334087558705, -1.4...
[ [ 1.6371011275240785, 4.630421235041675, 2.8355423300000004 ], [ 1.6371011275240785, 4.630421235041675, -2.8355423299999996 ], [ -3.2742022550481567, 4.630421235041675, 0 ] ]
[ 73, 73, 5, 76, 76, 76, 76, 76, 76 ]
[ 1, 1, 1 ]
alex<agm002255470>
Fm-3m
B-Os-Ta
0
null
null
-0.000009
8,021.521599
302.88562
[ [ 1.8479784139450746, 1.1261637316375728, 1.7319912181307793 ], [ -1.7146130426754295e-8, 3.2279016633251536, 3.10075866793049 ], [ 2.6938292378406984e-10, 0.6519995225686933, 3.483991648338449 ], [ 1.8479783965295613, 3.7020658723940323, 1.348758237722819...
[ [ 3.69595679, 0, 2.263120826330213e-16 ], [ -1.8479783932010556, 4.354065394962726, -0.8064795639387318 ], [ 0, 0, 5.63922945 ] ]
[ 73, 73, 5, 5, 76, 76, 76 ]
[ 1, 1, 1 ]
alex<agm003312398>
C2/m
B-Os-Ta
0.081393
null
null
0.000034
7,308.285407
308.893341
[ [ 1.8717645, 1.262275465858, 4.892988465858 ], [ 1.8717644999999996, 5.999150534142, 2.3684375341420005 ], [ 1.8717644999999998, 2.368437534142, 1.2622754658580002 ], [ 1.8717644999999998, 4.892988465858, 5.999150534142 ], [ 0, 0, 0 ], ...
[ [ 3.743529, 0, 2.292250403682646e-16 ], [ -4.446341054072684e-16, 7.261426, 4.446341054072684e-16 ], [ 0, 0, 7.261426 ] ]
[ 68, 68, 68, 68, 12, 12, 28, 28, 28, 28 ]
[ 1, 1, 1 ]
mp-1205516
P4/mbm
Er-Mg-Ni
0
0
null
-0.000005
2,572.896442
77.917419
[ [ -4.5205689711488235, -4.0253068874414915, -5.155140373384569 ], [ -2.453047052754253, -2.1842974324005002, -2.797391651399087 ], [ -6.252902570895126, -5.5678504068323695, -7.1306489735671 ], [ -0.7207134530079501, -0.6417539130096221, -0.821883051216555...
[ [ -0.7221601107168585, -6.209604319841992, -0.8235327823918278 ], [ -6.251455913186216, 0, -0.8235327823918278 ], [ 0, 0, -6.30546646 ] ]
[ 68, 68, 12, 12, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28 ]
[ 1, 1, 1 ]
alex<agm003302131>
R-3m
Er-Mg-Ni
0.049373
null
null
0.014339
1,885.126736
146.050262
[ [ -5.884857256773168, -3.6027608688044785, -5.910634021516289 ], [ -0.9301795327220875, -0.5694640116541309, -5.399119636610316 ], [ 0, 0, 0 ], [ -4.545012777763886, -2.782496408914211, -10.364800942272867 ], [ -2.2700240117313686, -1.389728471...
[ [ -2.1303821891184938, -4.172224880458609, -1.4091768090633032 ], [ -4.684654600376762, 0, -1.4091768090633032 ], [ 0, 0, -8.49140004 ] ]
[ 68, 68, 12, 28, 28, 28, 28, 28, 28, 28, 28, 28 ]
[ 1, 1, 1 ]
alex<agm003538853>
R-3m
Er-Mg-Ni
0.069767
null
null
-0.011633
2,075.972005
135.783524
[ [ 0, 0, 0 ], [ 0, 0, 8.10584906999697 ], [ 0, 0, 3.3009327300030296 ], [ 1.686516975, 1.686516975, 5.7033909 ], [ 1.686516975, 1.686516975, 9.663898088092248 ], [ 1.686516975, 1.686516975, 1.7428837119077523 ] ]
[ [ 3.37303395, 0, 2.0653876151414268e-16 ], [ -2.0653876151414268e-16, 3.37303395, 2.0653876151414268e-16 ], [ 0, 0, 11.4067818 ] ]
[ 68, 68, 68, 12, 28, 28 ]
[ 1, 1, 1 ]
alex<agm002220831>
P4/mmm
Er-Mg-Ni
0.043414
null
null
0.000109
2,709.908235
83.338417
[ [ -1.3428698169014978e-16, 2.19307284, 2.140608992631457 ], [ 2.19307284, 0, 7.0924749873685435 ], [ 2.19307284, 2.19307284, 2.6857396338029957e-16 ], [ 0, 0, 0 ], [ 2.19307284, 0, 1.5782867559900362 ], [ -1.3428698169014978e-16, ...
[ [ 4.38614568, 0, 2.6857396338029957e-16 ], [ -2.6857396338029957e-16, 4.38614568, 2.6857396338029957e-16 ], [ 0, 0, 9.23308398 ] ]
[ 68, 68, 29, 29, 50, 50, 50, 50 ]
[ 1, 1, 1 ]
alex<agm003631686>
P4/nmm
Cu-Er-Sn
0.005881
null
null
0.000058
2,122.257248
61.364742
[ [ 1.68382235337046, 0, 0.3684789337856338 ], [ 2.3504444440371097, 1.2206080984693721, 5.385214277689412 ], [ 2.3384054310180584, 4.5508655607600055, 5.440228268680882 ], [ 3.478050344751595, 2.975052519936517, 8.2954115502015 ], [ 1.21079953030357...
[ [ 3.36764470674092, 0, 0.7369578675712676 ], [ 1.321205168314248, 5.771473659229377, 2.0255150887990276 ], [ 0, 0, 8.06296959 ] ]
[ 68, 68, 68, 12, 12, 28, 28 ]
[ 1, 1, 1 ]
alex<agm003310660>
C2/m
Er-Mg-Ni
0.092947
null
null
0
2,629.474082
68.047112
[ [ -3.8974028209205227, 4.826236951700012, 0.2908828802415534 ], [ -3.947775703070654, -4.826236951700012, 2.5700374976464366 ], [ -5.373662867993275, 1.9818754140773795, 2.400592128270928 ], [ -2.4715156559979023, -1.9818754140773807, 0.460328249617062 ]...
[ [ -3.5334972768162842, -6.808112365777393, -3.3008626861572488 ], [ 0, 0, 8.35055037 ], [ -4.311681247174893, 6.808112365777393, -2.188767305954761 ] ]
[ 68, 68, 68, 68, 68, 68, 68, 68, 68, 68, 68, 68, 12, 12, 28, 28, 28, 28 ]
[ 1, 1, 1 ]
alex<agm003502568>
Immm
Er-Mg-Ni
0.025096
null
null
0.000473
2,880.822702
63.645443
[ [ 7.348257580492763e-16, 5.555148295717715, 1.923039733009447e-16 ], [ 0, 0, 0 ], [ 4.440892098500626e-16, 8.332722443576573, 5.551115123125783e-16 ], [ 1.1102230246251565e-16, 2.7775741478588576, 2.220446049250313e-16 ] ]
[ [ 1.3093610101329631, 3.7034321971451436, 2.2678797950000003 ], [ 1.3093610101329631, 3.7034321971451436, -2.2678797949999994 ], [ -2.618722020265926, 3.7034321971451436, 0 ] ]
[ 68, 12, 28, 28 ]
[ 1, 1, 1 ]
alex<agm002220829>
Fm-3m
Er-Mg-Ni
0.092229
null
null
-0
2,287.534455
93.991615
[ [ 1.4924908419659608, 1.968488825, 3.996844937047159 ], [ 2.4814565248351865, 0, 1.4269346279687387 ], [ 0.5265171052136931, 1.968488825, 1.4099967614846327 ], [ 0.049990056371746645, 0, 0.13387184745306516 ] ]
[ [ 3.420300811781493, 0, -1.2771993040613503 ], [ -2.4107035386935843e-16, 3.93697765, 2.4107035386935843e-16 ], [ 0, 0, 5.21833032 ] ]
[ 68, 12, 28, 28 ]
[ 1, 1, 1 ]
alex<agm003630192>
Amm2
Er-Mg-Ni
0.064051
null
null
-0.000142
2,287.534455
100.729988
[ [ -2.243509294478426e-16, 3.6639287279245663, 5.0874739126411495 ], [ 2.2435092944784274e-16, -3.6639287279245667, 5.087473912641148 ], [ 2.4506669959983548e-32, 4.2386251275088704e-17, 4.230740474717702 ], [ 1.9418549800000007, -1.5245939402458506, 6.3226...
[ [ 3.88370996, 0, 2.378086485665348e-16 ], [ -3.8195790769422745e-16, 6.237846013400132, 3.601422075000001 ], [ 3.8195790769422745e-16, -6.237846013400132, 3.6014220749999986 ] ]
[ 68, 68, 68, 12, 12, 12, 28, 28, 28 ]
[ 1, 1, 1 ]
alex<agm002220873>
P-62m
Er-Mg-Ni
0.049869
null
null
-0.000093
2,472.236585
74.339417
[ [ 0, 0, 0 ], [ -5.763380445820893, -3.531086829697856, -5.9935075649133775 ], [ -0.9662057955729814, -0.5919714291981893, -5.151322392302061 ], [ -4.484588868720013, -2.74760148836424, -1.8744540594463859 ], [ -2.244997372673862, -1.37545677053...
[ [ -2.101743001680272, -4.123058258896045, -1.4013774536077193 ], [ -4.627843239713602, 0, -1.4013774536077193 ], [ 0, 0, -8.34207505 ] ]
[ 68, 12, 12, 28, 28, 28, 28, 28, 28, 28, 28, 28 ]
[ 1, 1, 1 ]
alex<agm003538852>
R-3m
Er-Mg-Ni
0.010721
null
null
0.00031
1,794.317396
140.858704
[ [ 1.7514478449999995, 6.282996686540545, 4.903719088855254 ], [ 1.751447845, 1.2992527414487176, 7.9404981091084 ], [ 1.751447845, 1.5991942251424451, 4.194911330220989 ], [ 1.7514478449999995, 6.582938170234273, 1.1581323099678433 ], [ -2.62667003...
[ [ 3.50289569, 0, 2.1449049972527795e-16 ], [ -4.826449935130467e-16, 7.882190911682991, -0.48199552092375575 ], [ 0, 0, 9.58062594 ] ]
[ 68, 68, 68, 68, 12, 12, 12, 12, 12, 28, 28 ]
[ 1, 1, 1 ]
alex<agm003367376>
P2/m
Er-Mg-Ni
0.053303
null
null
0.00033
2,545.14004
52.776505
[ [ 0, 0, 6.2950567800014845 ], [ 0, 0, 1.5941354699985149 ], [ 1.70956837, 1.70956837, 3.944596125 ], [ 1.70956837, 1.70956837, 2.093617432244058e-16 ] ]
[ [ 3.41913674, 0, 2.093617432244058e-16 ], [ -2.093617432244058e-16, 3.41913674, 2.093617432244058e-16 ], [ 0, 0, 7.88919225 ] ]
[ 68, 68, 12, 28 ]
[ 1, 1, 1 ]
alex<agm001135295>
P4/mmm
Er-Mg-Ni
0.031918
null
null
-0.000053
2,723.721511
69.15464
[ [ -4.842462371709833, 1.304543987547918, -5.021871538994044 ], [ 1.626661885784486, -1.3045439875479188, -5.711318796328556 ], [ -1.6266618857844857, 1.3045439875479181, -2.7479571236714424 ], [ 4.842462371709833, -1.3045439875479183, -3.4374043810059556 ...
[ [ -3.987740912743246, -6.906969866761224, -2.8197586412501927 ], [ -3.987740910091186, 6.906969866761224, -2.8197586393749035 ], [ 7.975481822834432, 0, -2.8197586393749035 ] ]
[ 68, 68, 68, 68, 68, 68, 68, 68, 68, 68, 68, 68, 29, 29, 29, 29, 29, 29, 50 ]
[ 1, 1, 1 ]
alex<agm003694148>
Im-3
Cu-Er-Sn
0.028666
null
null
0.000265
2,785.649361
59.135929
[ [ 1.9470032090397364, 1.274511748110018, 2.6415899664543545 ], [ -2.0772515966677325e-8, 3.857882664811763, 4.323779856634706 ], [ -1.0858677576926296e-9, 3.2162776767171604, 0.7212727877736353 ], [ 0, 0, 0 ], [ 1.9470031893530877, 1.9161167362...
[ [ 3.89400638, 0, 2.384391224563186e-16 ], [ -1.94700319173278, 5.132394412921781, -0.6426246269109387 ], [ 0, 0, 7.60799445 ] ]
[ 68, 68, 12, 12, 12, 28, 28 ]
[ 1, 1, 1 ]
alex<agm003312417>
C2/m
Er-Mg-Ni
0.060044
null
null
-0
2,380.900073
59.664494
[ [ -2.6031989127413953, -1.5933691538325554, -8.579811449445602 ], [ -6.876718129250701, -4.209109988913735, -2.9718080809061855 ], [ -3.485984037094777, -2.1337053454782557, -5.6397162136372625 ], [ -6.033379775839871, -3.69291842476097, -5.780526685127247...
[ [ -2.161349048828312, -4.230933779990995, -1.4265298305755039 ], [ -4.75102413817694, 0, -1.4265298305755039 ], [ 0, 0, -8.62485214 ] ]
[ 68, 68, 68, 12, 28, 28, 28, 28, 28, 28, 28, 28 ]
[ 1, 1, 1 ]
alex<agm003586067>
R3m
Er-Mg-Ni
0
null
null
-0
2,281.955973
123.201637
[ [ 0, 0, 0 ], [ 0, 3.005163986372154, 4.94460707933797e-16 ], [ 1.9389875719292572e-16, 7.501790258148013, 6.099349614290759e-16 ], [ -0.7030820639286297, 5.513173877609742, 1.2177738566147767 ], [ 1.4061641278572594, 5.513173877609741, 1.15...
[ [ 1.4166478888942324, 4.006885315162873, 2.4537061200000005 ], [ 1.4166478888942324, 4.006885315162873, -2.4537061199999997 ], [ -2.8332957777884644, 4.006885315162873, 0 ] ]
[ 68, 12, 28, 28, 28, 28 ]
[ 1, 1, 1 ]
alex<agm002160914>
F-43m
Er-Mg-Ni
0
null
null
0.001407
2,070.696556
122.698914
[ [ 1.808738, 1.319385825024, 5.186329825024001 ], [ 1.8087379999999995, 6.414502174976, 2.5475581749760003 ], [ 1.8087379999999997, 2.547558174976, 1.3193858250240003 ], [ 1.8087379999999997, 5.186329825024001, 6.4145021749760005 ], [ 0, 0, ...
[ [ 3.617476, 0, 2.2150652021961854e-16 ], [ -4.735640592082063e-16, 7.733888, 4.735640592082063e-16 ], [ 0, 0, 7.733888 ] ]
[ 66, 66, 66, 66, 12, 12, 29, 29, 29, 29 ]
[ 1, 1, 1 ]
mp-1205987
P4/mbm
Cu-Dy-Mg
0
0
null
0.003419
2,540.508232
61.021431
[ [ 0, 0, 0 ], [ -5.967963619707721, -3.663997573251958, -6.245071574738196 ], [ -1.0118362505122616, -0.6212111538620364, -5.253374899126588 ], [ -4.654301069973514, -2.857481866888815, -10.507564846110112 ], [ -2.3254988002464683, -1.4277268602...
[ [ -2.174460081792593, -4.285208727113995, -1.4809629919323921 ], [ -4.80533978842739, 0, -1.4809629919323921 ], [ 0, 0, -8.53652049 ] ]
[ 66, 12, 12, 29, 29, 29, 29, 29, 29, 29, 29, 29 ]
[ 1, 1, 1 ]
alex<agm003538268>
R-3m
Cu-Dy-Mg
0.015316
null
null
0.000111
1,769.966182
101.372284
[ [ -1.1956093129680514, -1.851551346490742, -7.35206432291161 ], [ -2.14954364128352, 1.851551346490742, -2.6609775568585663 ], [ -1.6725764771257856, 0, -10.28504004988509 ], [ -0.9488580369723534, 1.1207689985449911, -5.834736540745971 ], [ -2.396...
[ [ -3.345152954251571, 0, 0.5439963402298217 ], [ -0.1946678621986209, 4.878922279225776, -1.1970554324987657 ], [ 0.1946678621986209, -4.878922279225776, -9.359982787501234 ] ]
[ 66, 66, 66, 12, 12, 29, 29, 29 ]
[ 1, 1, 1 ]
alex<agm003328542>
Immm
Cu-Dy-Mg
0.081851
null
null
-0
2,506.387358
53.628422
[ [ 1.1102230246251565e-16, 3.124406090104391, 2.220446049250313e-16 ], [ 7.711296391793001e-16, 6.248812180208781, 1.3934483444888456e-15 ], [ -0.728753094826175, 8.857912015150902, 1.2622373353906586 ], [ -1.4728590953734334e-8, 10.91913699414124, -2.55106...
[ [ 1.4728591556622415, 4.165874786805855, 2.5510668900000004 ], [ 1.4728591556622415, 4.165874786805855, -2.5510668899999995 ], [ -2.9457183113244825, 4.165874786805855, 0 ] ]
[ 66, 12, 29, 29, 29, 29 ]
[ 1, 1, 1 ]
alex<agm002160498>
F-43m
Cu-Dy-Mg
0
null
null
0
2,034.469114
87.868309
[ [ -3.372965001749069e-33, -7.248572865046617e-17, 4.403631173714063 ], [ 2.335191091659118e-16, -3.8136564653334633, 5.312936333142968 ], [ 1.6497888140971093e-16, -2.6943096005244223, 1.5555603731429677 ], [ 1.9414214399999998, -1.8636056134694137e-17, 1....
[ [ 3.88284288, 0, 2.3775555522920453e-16 ], [ -3.9849799057562267e-16, 6.507966065857886, 3.7573759600000014 ], [ 3.9849799057562267e-16, -6.507966065857886, 3.7573759599999987 ] ]
[ 66, 66, 66, 12, 12, 12, 29, 29, 29 ]
[ 1, 1, 1 ]
alex<agm002160523>
P-62m
Cu-Dy-Mg
0.028737
null
null
0
2,441.458193
64.217369
[ [ 2.9083710562862604, 4.141198156864647, 3.907906496026041 ], [ 2.459763691277376, 0.9585245525038304, 5.4167444826977 ], [ 3.533554525324683, 1.4169932448791802, 1.805175531717956 ], [ 1.8345802222389536, 3.682729464489297, 7.519475447005785 ], [ ...
[ [ 3.7396843886397835, 0, 1.111882105383746 ], [ 1.6284503589238526, 5.099722709368477, 1.367834033339995 ], [ 0, 0, 6.84493484 ] ]
[ 66, 66, 12, 12, 29, 29 ]
[ 1, 1, 1 ]
alex<agm003606723>
C2/m
Cu-Dy-Mg
0.038751
null
null
0.000091
2,441.458193
59.02792
[ [ 0, 5.716291162783372, 0 ], [ 0, 8.57443674417506, 3.3306690738754696e-16 ], [ 1.1102230246251565e-16, 2.8581455813916863, 2.220446049250313e-16 ], [ 0, 0, 0 ] ]
[ [ 1.3473427481469529, 3.810860775188915, 2.3336660950000003 ], [ 1.3473427481469529, 3.810860775188915, -2.3336660949999994 ], [ -2.6946854962939053, 3.810860775188915, 0 ] ]
[ 68, 29, 29, 50 ]
[ 1, 1, 1 ]
alex<agm002207848>
Fm-3m
Cu-Er-Sn
0.083354
null
null
-0
2,176.62016
81.212212
[ [ -2.2656788750000003, -1.3080903083784987, -2.1333804150000004 ], [ -2.265678875, 1.3080903083784987, -6.4001412449999995 ], [ 0, 0, -4.26676083 ], [ 0, 0, 0 ], [ -2.265678875, 1.3080903083784987, -3.5086210905805832 ], [ -2.265678...
[ [ -2.2656788750000003, -3.9242709251354952, -5.549312764329052e-16 ], [ -2.2656788749999994, 3.9242709251354952, 2.774656382164526e-16 ], [ 0, 0, -8.53352166 ] ]
[ 66, 66, 12, 12, 29, 29, 29, 29 ]
[ 1, 1, 1 ]
alex<agm002160450>
P6_3/mmc
Cu-Dy-Mg
0.017677
null
null
0.000046
2,250.867323
74.32859
[ [ 4.440892098500626e-16, 5.745968898815614, -7.677902313929496e-17 ], [ 0, 0, 0 ], [ 2.220446049250313e-16, 8.618953348223421, 5.167220007429307e-16 ], [ 4.1174571699124597e-16, 2.8729844494078063, 2.220446049250313e-16 ] ]
[ [ 1.3543378576131733, 3.8306459325437423, 2.3457819800000004 ], [ 1.3543378576131733, 3.8306459325437423, -2.3457819799999995 ], [ -2.708675715226346, 3.8306459325437423, 0 ] ]
[ 66, 12, 29, 29 ]
[ 1, 1, 1 ]
alex<agm002220381>
Fm-3m
Cu-Dy-Mg
0.027091
null
null
0.000001
2,250.867323
70.257614
[ [ 0, 0, 0 ], [ 2.084396365, 3.3511040677330253, 4.625361271928557 ], [ -1.6778562662440446e-16, 2.7401472284290187, 2.2453462666625854 ], [ 2.084396365, 0.7088781289110975, 2.761472522156558 ], [ -8.081658346136882e-17, 1.3198349682151045, ...
[ [ 4.16879273, 0, 2.5526493365516283e-16 ], [ -2.4860221008577327e-16, 4.059982196644123, -1.042209385914886 ], [ 0, 0, 8.42904318 ] ]
[ 66, 12, 12, 12, 12, 29, 29 ]
[ 1, 1, 1 ]
alex<agm003461740>
Cmmm
Cu-Dy-Mg
0.098101
null
null
-0
1,920.824587
55.705677
[ [ -0.8657693484717831, -0.5299561451381689, -5.838683192239669 ], [ -4.383810408030115, -2.68342517433434, -2.849163735356034 ], [ -6.959733497743007, -4.260203415798196, -2.995525468217076 ], [ -3.5442521109582508, -2.1695133807136266, -5.643670387671604 ...
[ [ -2.186108741566354, -4.280023132920969, -1.4438756905330634 ], [ -4.806003479845958, 0, -1.4438756905330634 ], [ 0, 0, -8.72043439 ] ]
[ 66, 12, 12, 12, 29, 29, 29, 29, 29, 29, 29, 29 ]
[ 1, 1, 1 ]
alex<agm003585739>
R3m
Cu-Dy-Mg
0.026676
null
null
0.000001
1,751.531697
94.185905
[ [ 0, 0, 0 ], [ 0, 0, 8.003344198655942 ], [ 0, 0, 3.395519511344059 ], [ 1.744498985, 1.744498985, 5.699431855 ], [ 1.744498985, 1.744498985, 9.624306275865951 ], [ 1.744498985, 1.744498985, 1.7745574341340498 ] ]
[ [ 3.48899797, 0, 2.1363950980960563e-16 ], [ -2.1363950980960563e-16, 3.48899797, 2.1363950980960563e-16 ], [ 0, 0, 11.39886371 ] ]
[ 66, 66, 66, 12, 29, 29 ]
[ 1, 1, 1 ]
alex<agm002286832>
P4/mmm
Cu-Dy-Mg
0.0349
null
null
0
2,682.81194
58.605549
[ [ -4.689631146777945, -4.173219490135426, -5.3522585071928654 ], [ -2.5625041515003946, -2.2803269455299766, -2.924576414502913 ], [ -6.4891311089752355, -5.774562555229002, -7.406021091054291 ], [ -0.7630041893031029, -0.6789838804364003, -0.8708138306414...
[ [ -0.7546194559996311, -6.453546435665402, -0.8612443658478888 ], [ -6.497515842278708, 0, -0.8612443658478888 ], [ 0, 0, -6.55434619 ] ]
[ 66, 66, 12, 12, 29, 29, 29, 29, 29, 29, 29, 29, 29, 29, 29, 29, 29, 29, 29 ]
[ 1, 1, 1 ]
alex<agm003301739>
R-3m
Cu-Dy-Mg
0.041712
null
null
-0.000106
1,855.283389
100.20652
[ [ 1.761660115, 1.761660115, 2.2399721457064703 ], [ 1.761660115, 1.761660115, 5.558940828065657 ], [ 1.761660115, 1.761660115, 8.9198243 ], [ 1.761660115, 1.761660115, 12.280707771934345 ], [ 1.761660115, 1.761660115, 15.599676454293531 ]...
[ [ 3.52332023, 0, 2.1574114210203081e-16 ], [ -2.1574114210203081e-16, 3.52332023, 2.1574114210203081e-16 ], [ 0, 0, 17.8396486 ] ]
[ 66, 66, 66, 66, 66, 12, 29, 29, 29, 29 ]
[ 1, 1, 1 ]
alex<agm003642977>
P4/mmm
Cu-Dy-Mg
0.028841
null
null
0.000549
2,669.301432
62.78923
[ [ -2.23701885, -1.2915434352297677, -2.1462717550000003 ], [ -2.23701885, 1.2915434352297677, -6.438815265 ], [ -2.23701885, -1.2915434352297677, -7.725131387433649 ], [ -2.23701885, 1.2915434352297677, -0.8599556325663505 ], [ -2.23701885, 1.2...
[ [ -2.2370188500000006, -3.8746303056893017, -5.479115948569587e-16 ], [ -2.2370188499999997, 3.8746303056893017, 2.7395579742847934e-16 ], [ 0, 0, -8.58508702 ] ]
[ 68, 68, 29, 29, 29, 29, 50, 50 ]
[ 1, 1, 1 ]
alex<agm002334879>
P6_3/mmc
Cu-Er-Sn
0.041741
null
null
0.000001
2,176.62016
88.284843
[ [ 0, 0, 3.234345068411312 ], [ 0, 0, 6.748412268767755 ], [ 0, 0, 10.248739821232245 ], [ 0, 0, 13.762807021588687 ], [ 0, 0, 0 ], [ 1.709729805, 1.709729805, 1.4757811296446683 ], [ 1.709729805, 1.709729805, ...
[ [ 3.41945961, 0, 2.0938151331000784e-16 ], [ -2.0938151331000784e-16, 3.41945961, 2.0938151331000784e-16 ], [ 0, 0, 16.99715209 ] ]
[ 66, 66, 66, 66, 12, 29, 29, 29, 29, 29 ]
[ 1, 1, 1 ]
alex<agm003642979>
P4/mmm
Cu-Dy-Mg
0.047301
null
null
0.000012
2,523.849965
69.356209
[ [ 0, 0, 5.986276211557455 ], [ 0, 0, 1.6007532884425448 ], [ 1.78632003, 1.78632003, 3.79351475 ], [ 1.78632003, 1.78632003, 2.1876111069923038e-16 ] ]
[ [ 3.57264006, 0, 2.1876111069923038e-16 ], [ -2.1876111069923038e-16, 3.57264006, 2.1876111069923038e-16 ], [ 0, 0, 7.5870295 ] ]
[ 66, 66, 12, 29 ]
[ 1, 1, 1 ]
alex<agm001130318>
P4/mmm
Cu-Dy-Mg
0.058392
null
null
0.000563
2,700.663193
53.457832
[ [ -6.0998552330916995, -3.736845395651968, -6.137123608600053 ], [ -0.9671250092151998, -0.5924725259215603, -5.569742701234917 ], [ 0, 0, 0 ], [ -4.715215080585279, -2.8885980224260415, -10.713847400962852 ], [ -2.351765161721621, -1.440719899...
[ [ -2.2073937530150696, -4.329317921573528, -1.470217374917486 ], [ -4.8595864892918295, 0, -1.470217374917486 ], [ 0, 0, -8.76643156 ] ]
[ 66, 66, 12, 29, 29, 29, 29, 29, 29, 29, 29, 29 ]
[ 1, 1, 1 ]
alex<agm003538269>
R-3m
Cu-Dy-Mg
0.077292
null
null
0.000464
2,038.085949
98.398338
[ [ 1.927139, 1.4184213542369999, 5.509226854237001 ], [ 1.9271389999999995, 6.763189645763, 2.6723841457630004 ], [ 1.9271389999999997, 2.672384145763, 1.4184213542370003 ], [ 1.9271389999999995, 5.509226854237, 6.763189645763 ], [ 0, 0, 0 ...
[ [ 3.854278, 0, 2.360064607862031e-16 ], [ -5.009791861509387e-16, 8.181611, 5.009791861509387e-16 ], [ 0, 0, 8.181611 ] ]
[ 60, 60, 60, 60, 49, 49, 79, 79, 79, 79 ]
[ 1, 1, 1 ]
mp-1205853
P4/mbm
Au-In-Nd
0
0
null
0.000127
1,903.917007
73.422752
[ [ 3.242327121518365e-16, 6.195164692854663, 7.248829753114805e-16 ], [ 0, 0, 0 ], [ -5.551115123125783e-16, 3.0975823464273304, -8.881784197001252e-16 ], [ 4.440892098500626e-16, 9.292747039281997, 6.661338147750939e-16 ] ]
[ [ 1.4602143216283363, 4.130109795236443, 2.5291653950000006 ], [ 1.4602143216283363, 4.130109795236443, -2.5291653949999997 ], [ -2.920428643256672, 4.130109795236443, 0 ] ]
[ 60, 49, 79, 79 ]
[ 1, 1, 1 ]
mp-568139
Fm-3m
Au-In-Nd
0
0
null
0
1,639.709938
73.095703
[ [ -2.41547971, -1.394577860790579, -2.3304945850000003 ], [ -2.4154797099999996, 1.3945778607905783, -6.991483755 ], [ 0, 0, 0 ], [ 0, 0, -4.66098917 ], [ -2.41547971, -1.394577860790579, -8.44896956849178 ], [ -2.4154797099999996, ...
[ [ -2.4154797100000005, -4.183733582371738, -5.916218990513754e-16 ], [ -2.4154797099999996, 4.183733582371738, 2.958109495256877e-16 ], [ 0, 0, -9.32197834 ] ]
[ 60, 60, 49, 49, 79, 79, 79, 79 ]
[ 1, 1, 1 ]
alex<agm002217308>
P6_3/mmc
Au-In-Nd
0.015611
null
null
0.000364
1,639.709938
84.854156
[ [ 1.9535960349999997, 2.8239618570657434, 1.630415138358143 ], [ 1.953596035, -4.295677731199439e-16, 4.699924593283716 ], [ 1.9535960350000001, -2.8239618570657434, 1.6304151383581422 ], [ 3.9071920699999994, 5.304076348201121, 3.062309907436245 ], [ ...
[ [ 3.90719207, 0, 2.3924651310897107e-16 ], [ -4.221489748340358e-16, 6.894215950720687, 3.980377435000001 ], [ 4.221489748340358e-16, -6.894215950720687, 3.9803774349999985 ] ]
[ 60, 60, 60, 49, 49, 49, 79, 79 ]
[ 1, 1, 1 ]
alex<agm002341472>
P-62m
Au-In-Nd
0.034474
null
null
0.00009
2,070.074751
68.76683
[ [ 2.296171645, 2.296171645, 2.3370302750000005 ], [ -1.4059996276710812e-16, 2.296171645, 1.4059996276710812e-16 ], [ 2.296171645, 0, 1.4059996276710812e-16 ], [ 0, 0, 2.337030275 ] ]
[ [ 4.59234329, 0, 2.8119992553421624e-16 ], [ -2.8119992553421624e-16, 4.59234329, 2.8119992553421624e-16 ], [ 0, 0, 4.67406055 ] ]
[ 60, 49, 49, 79 ]
[ 1, 1, 1 ]
alex<agm001209164>
P4/mmm
Au-In-Nd
0.083755
null
null
0.000011
1,932.905784
61.561646
[ [ 2.5957492910712094, 3.5070576225000005, 1.9461034979380971 ], [ 1.4828068421105474, 1.1690192075, 8.080484431793796 ], [ 3.5133306142460414, 3.5070576225000005, 9.428541167301425 ], [ 0.565225518935715, 1.1690192075, 0.5980467624304667 ], [ 1.022...
[ [ 4.078556133181757, 0, -0.6881438002681095 ], [ -2.863271261213301e-16, 4.67607683, 2.863271261213301e-16 ], [ 0, 0, 10.71473173 ] ]
[ 60, 60, 49, 49, 49, 49, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003634040>
P2_1/m
Au-In-Nd
0.060315
null
null
0.000243
1,932.905784
62.106277
[ [ 0, 0, 0 ], [ 0.507830029357723, 3.7839576089943603, 1.3666528901562578 ], [ 2.835038261932991, 0.6147792523572959, 1.5629287699236527 ], [ 2.174343686572457, 2.433420996280963, -0.1669667555083207 ], [ 1.1685246047182567, 1.9653158650706934, ...
[ [ 3.922611963664298, 0, -1.47049074481839 ], [ -0.5797436723735843, 4.398736861351656, -1.5082415251017 ], [ 0, 0, 5.90831393 ] ]
[ 68, 29, 29, 50, 50 ]
[ 1, 1, 1 ]
alex<agm002207823>
C2/m
Cu-Er-Sn
0.05474
null
null
-0
2,047.898249
71.948433
[ [ 3.718039127405317, 1.4872654063227662, 1.9029949250000004 ], [ -1.130931807417256, 4.63930300086902, 5.708984775 ], [ -1.215670520331936, 4.884440971416732, 1.9029949250000004 ], [ 3.802777840319998, 1.2421274357750542, 5.708984775 ], [ 1.2383999...
[ [ 4.97247118, 0, 3.0447604572197313e-16 ], [ -2.385363860011939, 6.126568407191786, 4.0257551602864863e-16 ], [ 0, 0, 7.6119797 ] ]
[ 60, 60, 49, 49, 79, 79, 79, 79, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003723245>
P2_1/m
Au-In-Nd
0.080219
null
null
0
1,491.465885
77.073921
[ [ -1.6168267716212023e-16, 2.6404785, 1.6168267716212023e-16 ], [ 0, 0, 2.6404785 ], [ 1.9700793299999997, 2.6404785, 2.6404785000000004 ], [ 1.97007933, 0, 1.206325672775431e-16 ] ]
[ [ 3.94015866, 0, 2.412651345550862e-16 ], [ -3.2336535432424046e-16, 5.280957, 3.2336535432424046e-16 ], [ 0, 0, 5.280957 ] ]
[ 60, 60, 49, 79 ]
[ 1, 1, 1 ]
alex<agm001209653>
P4/mmm
Au-In-Nd
0.091369
null
null
0.00288
2,200.519963
62.217819
[ [ 2.220446049250313e-16, 9.92844984823956, 6.661338147750939e-16 ], [ 5.818036634548621e-16, 3.3094832827465184, 5.220470483680017e-16 ], [ 5.684575878837202e-16, 6.6189665654930385, 4.440892098500626e-16 ], [ 0, 0, 0 ] ]
[ [ 1.5601053809690535, 4.41264437699536, 2.7021817850000005 ], [ 1.5601053809690535, 4.41264437699536, -2.7021817849999996 ], [ -3.1202107619381065, 4.41264437699536, 0 ] ]
[ 60, 60, 49, 79 ]
[ 1, 1, 1 ]
alex<agm002341183>
Fm-3m
Au-In-Nd
0.090532
null
null
-0.000003
2,200.519963
60.021896
[ [ 0, 0, 6.034979996875469 ], [ 0, 0, 1.8361291231245311 ], [ 1.8771746399999998, 1.87717464, 3.9355545600000004 ], [ 1.8771746399999998, 1.87717464, 2.298875914316585e-16 ] ]
[ [ 3.75434928, 0, 2.298875914316585e-16 ], [ -2.298875914316585e-16, 3.75434928, 2.298875914316585e-16 ], [ 0, 0, 7.87110912 ] ]
[ 60, 60, 49, 79 ]
[ 1, 1, 1 ]
alex<agm001140806>
P4/mmm
Au-In-Nd
0.035258
null
null
0.002875
2,200.519963
63.370052
[ [ -1.505598140363368e-16, 2.45882836, 0.09667592839072156 ], [ 0, 0, 4.186655441528305 ], [ 1.886738645, 0, 7.1062287172144405 ], [ 1.886738645, 0, 1.474767668750554 ], [ 1.8867386449999999, 2.45882836, 5.6124499045609815 ], [ 1.886...
[ [ 3.77347729, 0, 2.3105884424268644e-16 ], [ -3.011196280726736e-16, 4.91765672, 3.011196280726736e-16 ], [ 0, 0, 8.52158458 ] ]
[ 60, 60, 49, 49, 49, 79 ]
[ 1, 1, 1 ]
alex<agm003413385>
Pmm2
Au-In-Nd
0.042687
null
null
-0.000001
2,145.035749
54.420746
[ [ 2.0242508666248895, -1.354115352950348, -4.542805865 ], [ -2.7536649673815026, -4.116420868038849, -6.992168086899918 ], [ -2.0242508666248886, 1.3541153529503474, -4.542805865 ], [ -0.8696574563912454, -1.3000405437625417, -8.4244641701761 ], [ ...
[ [ -2.2368405213634026, 5.416461411801391, -1.3772956014619913 ], [ 5.860162945136151, 0, -1.3772956014619913 ], [ -3.623322423772749, -5.416461411801391, -6.331020527076017 ] ]
[ 60, 60, 60, 60, 49, 49, 79, 79, 79, 79, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003428119>
Fmmm
Au-In-Nd
0.049664
null
null
0.000192
1,724.837219
73.743187
[ [ -3.891314494689584, 0.8354345073918154, -6.282751519455176 ], [ -0.4132125470308463, -0.8354345073918148, -1.6230303409768152 ], [ -3.875692539265589, -3.484434544309155, -6.2213911614010025 ], [ -2.9969015093152414, 0.9353756861899084, -2.76964596236664...
[ [ -4.30452704172043, 0, 1.0959035295680117 ], [ -0.8576690049096817, 6.968869088618312, -3.3687813980619734 ], [ 0.8576690049096817, -6.968869088618312, -5.6329039919380275 ] ]
[ 60, 60, 60, 49, 49, 49, 49, 79, 79, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003381633>
Immm
Au-In-Nd
0.051493
null
null
0.000001
1,814.34948
67.999893
[ [ 1.8200223649999996, 5.995000524238892, 5.222546094097749 ], [ 1.820022365, 1.3872492848449023, 8.855899264170267 ], [ 1.8200223649999998, 1.9615013755717192, 4.399052433440972 ], [ 1.8200223649999996, 6.569252614965709, 0.7656992633684531 ], [ -2...
[ [ 3.64004473, 0, 2.2288845636738456e-16 ], [ -4.87195229200645e-16, 7.956501899810611, -0.6654503124612801 ], [ 0, 0, 10.28704884 ] ]
[ 60, 60, 60, 60, 49, 49, 49, 49, 49, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003367706>
P2/m
Au-In-Nd
0.076019
null
null
0.000261
2,155.814267
58.02356
[ [ 1.8817658499999999, 1.88176585, 2.071551267505034 ], [ 1.8817658499999999, 1.88176585, 5.71539529676727 ], [ 1.8817658499999999, 1.88176585, 9.37665872 ], [ 1.8817658499999999, 1.88176585, 13.037922143232729 ], [ 1.8817658499999999, 1.8817658...
[ [ 3.7635317, 0, 2.3044985249472987e-16 ], [ -2.3044985249472987e-16, 3.7635317, 2.3044985249472987e-16 ], [ 0, 0, 18.75331744 ] ]
[ 60, 60, 60, 60, 60, 49, 79, 79, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003646143>
P4/mmm
Au-In-Nd
0.04504
null
null
0.000004
2,003.365197
76.426636
[ [ 1.8493319349999997, 1.849331935, 1.8658123565532339 ], [ 1.8493319349999997, 1.849331935, 6.139336378614398 ], [ 1.8493319349999997, 1.849331935, 10.38614723 ], [ 1.8493319349999997, 1.849331935, 14.632958081385603 ], [ 1.8493319349999997, 1....
[ [ 3.69866387, 0, 2.264778434758731e-16 ], [ -2.264778434758731e-16, 3.69866387, 2.264778434758731e-16 ], [ 0, 0, 20.77229446 ] ]
[ 60, 60, 60, 60, 60, 49, 49, 49, 49, 79 ]
[ 1, 1, 1 ]
alex<agm003646144>
P4/mmm
Au-In-Nd
0.00711
null
null
0.000895
2,432.948601
54.1478
[ [ 3.1608515025, 3.196699939333235, 2.3982531769705435 ], [ 1.0536171675, 1.362822524931359, 8.069281837657051 ], [ 3.1608515025, 3.4138197483686015, 6.714648956296485 ], [ 1.0536171675, 1.1457027158959927, 3.7528860583311094 ], [ 3.1608515025, ...
[ [ 4.21446867, 0, 2.580617783411151e-16 ], [ -2.791902295751044e-16, 4.559522464264594, -0.11698591537240541 ], [ 0, 0, 10.58452093 ] ]
[ 68, 68, 29, 29, 29, 29, 50, 50, 50, 50 ]
[ 1, 1, 1 ]
alex<agm003399162>
P2_1/m
Cu-Er-Sn
0.063095
null
null
0.000125
2,047.898249
71.954178
[ [ 1.3243368033556016, 2.7639502098023967, 5.8217954749294805 ], [ 2.298087790957493, 6.090645605099961, 0.9158563971599196 ], [ 6.00400956733455, 1.5346511398711982, 2.2202064178700023 ], [ 3.489168620713599, 0.17491960599285694, 4.485804009849508 ], [...
[ [ 6.273647655215532, 0, -0.45752529366298084 ], [ -0.48639124354443974, 6.2655652110928175, -0.44098420932759186 ], [ 0, 0, 6.30016991 ] ]
[ 60, 60, 60, 60, 60, 60, 49, 79 ]
[ 1, 1, 1 ]
alex<agm003767478>
R-3
Au-In-Nd
0.095186
null
null
0
2,641.358458
60.774204
[ [ -4.313697713756105e-16, 7.04480298606826, 0.22380614209151742 ], [ -1.37041737770947e-17, 0.223806142091517, 7.04480298606826 ], [ -2.3960471738427906e-16, 3.9130419897573923, 6.3930536402426075 ], [ 2.60560608, 1.2400058252426072, 1.2400058252426074 ]...
[ [ 5.21121216, 0, 3.190947145710882e-16 ], [ -6.3106635124930125e-16, 10.30609563, 6.3106635124930125e-16 ], [ 0, 0, 10.30609563 ] ]
[ 60, 60, 60, 60, 60, 60, 60, 60, 60, 60, 60, 60, 49, 49, 49, 49, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003490444>
P4_2/mnm
Au-In-Nd
0.055501
null
null
0.001053
2,584.364352
55.825314
[ [ 2.689060405, 1.53618316074581, 11.130542183727181 ], [ 2.689060405, 1.6592707757573646, 7.1524278623798265 ], [ 2.6890604049999998, 4.681975183744593, 3.1284578903662 ], [ 2.6890604049999998, 4.793861696255406, 9.059414389633801 ], [ 2.6890604049...
[ [ 5.37812081, 0, 3.2931492176971357e-16 ], [ -5.802276652167221e-16, 9.47583688, 5.802276652167221e-16 ], [ 0, 0, 12.18787228 ] ]
[ 60, 60, 60, 60, 60, 60, 60, 60, 60, 60, 60, 60, 49, 49, 49, 49, 49, 49, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003580505>
Pnnm
Au-In-Nd
0.091939
null
null
0.000371
2,536.673077
55.848194
[ [ 0, 0, -3.716759395 ], [ 0, 0, 0 ], [ -2.4246474750000004, -1.399870872381197, -5.753028400607853 ], [ -2.4246474750000004, -1.399870872381197, -1.6804903893921475 ], [ -2.424647475, 1.399870872381197, -1.97976623460356 ], [ -2.424...
[ [ -2.4246474750000004, -4.19961261714359, -5.938673538638924e-16 ], [ -2.4246474749999996, 4.19961261714359, 2.969336769319462e-16 ], [ 0, 0, -7.43351879 ] ]
[ 60, 60, 49, 49, 79, 79 ]
[ 1, 1, 1 ]
alex<agm002281524>
P-6m2
Au-In-Nd
0.064725
null
null
0.000117
1,916.012856
66.566422
[ [ 1.2306836926043823, 2.1286494041547708, 3.0080372063365913e-16 ], [ 1.2306836926043823, 2.1286494041547708, -3.5586893099999997 ], [ -1.2295586771620524, 3.551044354876194, -1.7793446549999998 ], [ 3.6909260623708167, 0.7062544534333476, -5.338033965 ]...
[ [ -2.4511301747912357, 4.2572988083095415, 3.008037206336592e-16 ], [ 4.91249756, 0, 3.008037206336592e-16 ], [ 0, 0, -7.11737862 ] ]
[ 60, 60, 49, 49, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003285154>
P6_3/mmc
Au-In-Nd
0.074742
null
null
0.001916
1,916.012856
63.641212
[ [ 1.8259814349999999, 1.4108341044740547, 2.4436363500000002 ], [ 3.65196287, -1.4108341044740547, 2.4436363499999993 ], [ 0, 0, 0 ] ]
[ [ 3.65196287, 0, 2.236182319675241e-16 ], [ -2.5916602052581105e-16, 4.232502313422164, 2.4436363500000007 ], [ 2.5916602052581105e-16, -4.232502313422164, 2.443636349999999 ] ]
[ 60, 49, 79 ]
[ 1, 1, 1 ]
alex<agm001269575>
P-6m2
Au-In-Nd
0.06621
null
null
0.002278
1,916.012856
67.331421
[ [ 2.753121285, 2.753121285, 2.7531212850000006 ], [ 0, 0, 0 ], [ 2.7531212849999998, 4.14280253267035, 4.222535515236996e-16 ], [ 4.14280253267035, 0, 2.7531212850000006 ], [ -1.6858005846698492e-16, 2.753121285, 1.3634400373296502 ], [...
[ [ 5.50624257, 0, 3.3716011693396984e-16 ], [ -3.3716011693396984e-16, 5.50624257, 3.3716011693396984e-16 ], [ 0, 0, 5.50624257 ] ]
[ 60, 49, 79, 79, 79, 79, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003776506>
Pm-3
Au-In-Nd
0.096195
null
null
0
1,289.914613
77.946007
[ [ -1.8470572344317147, -3.608015004679039, -6.827740516925337 ], [ 2.2001759815063244, -6.611927929031543, -2.004029988130384 ], [ 1.3759160769469976, -4.693767424903316, -5.050948225801712 ], [ 0.1778783816050904, -1.5286535441525348, -9.479555181102562 ...
[ [ 5.110615082899209, 0, -1.3825362181431158 ], [ 0.43691800854343904, -6.74658545693732, 1.6150895254313244 ], [ -5.110615082899209, 0, -8.754555501856885 ] ]
[ 60, 60, 60, 60, 60, 60, 60, 60, 49, 49, 79 ]
[ 1, 1, 1 ]
alex<agm003531776>
C2/m
Au-In-Nd
0.052121
null
null
0
2,678.479508
59.386433
[ [ 6.661338147750939e-16, 10.431532885688748, 4.619522936399889e-16 ], [ 0, 0, 0 ], [ 0.8210695387206732, 7.534939095780931, 1.4221341576113466 ], [ 6.341385008119082e-16, 5.212603741160539, 6.852978578652127e-16 ], [ -1.6421390774413436, 7.5349...
[ [ 1.6391572536979975, 4.636236838083888, 2.8391036450000002 ], [ 1.6391572536979975, 4.636236838083888, -2.8391036449999993 ], [ -3.2783145073959945, 4.636236838083888, 0 ] ]
[ 60, 49, 79, 79, 79, 79 ]
[ 1, 1, 1 ]
alex<agm001177044>
F-43m
Au-In-Nd
0.088372
null
null
0
1,399.002499
90.918373
[ [ 3.4776133199999997, 1.365842600553519, 2.624181526581994 ], [ 1.1592044399999997, 3.388944676709047, 8.457593904630905 ], [ 3.4776133199999997, 0.8797703018692667, 9.702843672663242 ], [ 1.1592044399999997, 3.875016975393299, 1.3789317585496574 ], [ ...
[ [ 4.63681776, 0, 2.8392320140068e-16 ], [ -2.91146750986308e-16, 4.754787277262566, -0.05557477878710097 ], [ 0, 0, 11.13735021 ] ]
[ 60, 60, 49, 49, 49, 49, 79, 79, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003399680>
P2_1/m
Au-In-Nd
0.065939
null
null
0.000092
1,693.58749
65.734917
[ [ 1.7876844299999999, 2.557985446050646, 1.1556323087691005 ], [ 1.78768443, 1.4775987106837616, 4.844450127784342 ], [ 0, 0, 0 ], [ -4.964668628240119e-17, 0.8107919167708949, 2.6582597042429597 ], [ -1.97461574729327e-16, 3.224792239963513, ...
[ [ 3.57536886, 0, 2.1892820150850606e-16 ], [ -2.4710826101172817e-16, 4.035584156734408, -1.2308876734465577 ], [ 0, 0, 7.23097011 ] ]
[ 69, 69, 49, 29, 29 ]
[ 1, 1, 1 ]
alex<agm002266770>
Cmmm
Cu-In-Tm
0.01089
null
null
-0.000025
2,531.425889
65.794144
[ [ 2.169175555, 0, 8.308822152455384 ], [ -1.3282369501097166e-16, 2.169175555, 2.5213873575446155 ], [ -1.3282369501097166e-16, 2.169175555, 6.9427056980834045 ], [ 2.169175555, 0, 3.887503811916595 ], [ 0, 0, 0 ], [ 2.169175555, ...
[ [ 4.33835111, 0, 2.656473900219433e-16 ], [ -2.656473900219433e-16, 4.33835111, 2.656473900219433e-16 ], [ 0, 0, 10.83020951 ] ]
[ 68, 68, 29, 29, 29, 29, 50, 50, 50, 50 ]
[ 1, 1, 1 ]
alex<agm002145921>
P4/nmm
Cu-Er-Sn
0.070498
null
null
0.000107
2,047.898249
69.259964
[ [ -2.212728571607266, 3.445313341850345, -1.5331962913734325 ], [ -1.3878359491997654, 0.9928596494768062, -6.083108891470895 ], [ -2.1536978226903205, -0.9928596494768066, -1.2744549938846237 ], [ -1.0659377182925782, 3.4212173026813124, -4.67217692600586...
[ [ -3.541533771890086, 0, 0.8079861746444805 ], [ -0.883923371324447, 6.890626683700692, -3.8743787573913453 ], [ 0.883923371324447, -6.890626683700692, -4.291171302608654 ] ]
[ 60, 49, 49, 79, 79, 79, 79, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003503319>
Immm
Au-In-Nd
0.097181
null
null
-0.000011
1,342.323026
87.874817
[ [ 0.950319221596301, -1.8836894193533966, 3.262645779999999 ], [ 4.589800458403699, 1.8836894193533968, 3.2626457800000006 ], [ 0, 0, 0 ], [ 3.7581783563525955, -3.5356315433468164, 3.2626457799999997 ], [ 3.7581783563525946, -1.057718357356687...
[ [ 5.54011968, 0, 3.3923449165026297e-16 ], [ -3.4602813269983105e-16, 5.6510682580601905, 3.262645780000001 ], [ 3.4602813269983105e-16, -5.6510682580601905, 3.2626457799999993 ] ]
[ 60, 60, 49, 79, 79, 79, 79, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003490445>
P-3m1
Au-In-Nd
0.05645
null
null
-0.000016
1,454.629839
89.24826
[ [ 5.232111741333435, 4.808153780179073, 5.05881369014619 ], [ 0.6169054992419306, 3.3109351598209265, 1.6455115704661047 ], [ 3.5414141195296143, 0.7486093101790734, 0.549107580772251 ], [ 2.3076031210457524, 7.370479629820926, 6.155217679840043 ], [ ...
[ [ 5.849017240575367, 0, -2.192807979387707 ], [ -4.971508141181838e-16, 8.11908894, 4.971508141181838e-16 ], [ 0, 0, 8.89713324 ] ]
[ 60, 60, 60, 60, 49, 49, 49, 49, 49, 49, 79, 79, 79, 79, 79, 79, 79, 79 ]
[ 1, 1, 1 ]
alex<agm003335693>
Cmce
Au-In-Nd
0.08075
null
null
0.000243
1,668.82569
72.162376
[ [ 0, 0, 0 ], [ -0.22298192362911082, 2.6728403625251618, 2.0641536944365333 ], [ 2.5963335741404636, 0.6729402006121985, 2.0641536944365333 ], [ 5.544576292901459, -0.6729402006121983, 0.22405606763382982 ], [ 4.125933838453323, -2.672840362525...
[ [ 1.990287860987558, -5.683520553809891, 3.4619901721307755 ], [ 6.021930890933067, 0, -3.4619901721307755 ], [ -1.990287860987558, 5.683520553809891, 3.506404477869224 ] ]
[ 60, 50, 50, 50, 50, 50, 50, 44, 44, 44, 44 ]
[ 1, 1, 1 ]
mp-1205655
I-42m
Nd-Ru-Sn
0
0
null
0.000003
3,823.822199
119.458321
[ [ 2.3494009999999994, 4.083655722246874, 5.766828010081845 ], [ -2.778470705814419e-17, 0.4537587013249696, 1.604311218765579 ], [ 2.349401, 2.4662133889197184, 0.04819192996676956 ], [ -1.172240897034446e-16, 1.9144146669073983, 6.768612741795809 ], [...
[ [ 4.698802, 0, 2.877186414563591e-16 ], [ -2.7810710072061574e-16, 4.541833627691588, -1.2845989640330804 ], [ 0, 0, 8.67136275 ] ]
[ 60, 60, 50, 50, 50, 50, 44 ]
[ 1, 1, 1 ]
mp-1220534
Amm2
Nd-Ru-Sn
0.036867
0
null
0.000001
2,848.937406
70.80735
[ [ 2.2706652299999996, 4.860743287017356, 1.3007587020173559 ], [ 2.27066523, 2.2592258829826446, 5.819210467982645 ], [ 2.2706652299999996, 5.819210467982645, 4.860743287017356 ], [ 2.27066523, 1.3007587020173554, 2.259225882982645 ], [ -2.17986186...
[ [ 4.54133046, 0, 2.7807629058546885e-16 ], [ -4.359723727034169e-16, 7.11996917, 4.359723727034169e-16 ], [ 0, 0, 7.11996917 ] ]
[ 60, 60, 60, 60, 50, 50, 44, 44, 44, 44 ]
[ 1, 1, 1 ]
alex<agm002352745>
P4/mbm
Nd-Ru-Sn
0.070596
null
null
0.00003
4,433.293399
105.577408
[ [ 3.749824984914069, 1.4250654022923535, 0.8140007748506359 ], [ 0.8803147043242593, 3.515645502147878, 1.9497299676015432 ], [ -0.8803147063079785, 3.515645502147878, 6.046911212601542 ], [ 1.9891955742818312, 1.4250654022923535, 4.911182019850636 ], ...
[ [ 5.73902056, 0, 3.5141365795224253e-16 ], [ -2.8695102813939095, 4.940710904440231, -1.3334505025478214 ], [ 0, 0, 8.19436249 ] ]
[ 60, 60, 60, 60, 50, 50, 44, 44, 44, 44 ]
[ 1, 1, 1 ]
alex<agm003400463>
C2/c
Nd-Ru-Sn
0
null
null
0.000018
4,433.293399
107.737343
[ [ 1.4422831707496726, 1.0275397513313325, 2.2740595392787837 ], [ 3.857271398890546, 3.89953493836767, 7.967398490140404 ], [ 2.649777284820109, 2.463537344849501, 5.120729014709594 ], [ 0.256257624799022, 1.0234334287434435, 5.166570894761979 ], [ ...
[ [ 4.0658637190884175, 0, 1.6671389105510594 ], [ 1.2336908505518007, 4.927074689699002, 2.7827801588681287 ], [ 0, 0, 5.79153896 ] ]
[ 60, 60, 50, 44, 44 ]
[ 1, 1, 1 ]
alex<agm002310598>
Immm
Nd-Ru-Sn
0.034662
null
null
0.000027
4,433.293399
104.813843
[ [ 2.38236829360924, 1.3820045043227696, 5.596987939465299 ], [ 0, 0, 0 ], [ -2.4448683491534636e-8, 4.02790289974855, 1.4145056507674507 ], [ 2.3823682696503012, 2.2536861677269027, -0.023199843575096413 ], [ -4.897436536043195e-10, 3.156221236...
[ [ 4.76473654, 0, 2.9175596762457176e-16 ], [ -2.3823682708394434, 5.40990740407132, -1.792341019767249 ], [ 0, 0, 8.80383461 ] ]
[ 60, 60, 60, 50, 50, 50, 50, 44, 44 ]
[ 1, 1, 1 ]
alex<agm003338358>
C2/m
Nd-Ru-Sn
0.018344
null
null
0.000454
3,350.720461
81.660652
[ [ 4.5553188449999995, 0.0411040932984465, 3.7654305634156833 ], [ 1.5184396149999995, 6.192408436701553, 8.660727026584318 ], [ 4.5553188449999995, 3.1578603582984464, 8.660727026584318 ], [ 1.5184396149999997, 3.0756521717015533, 3.7654305634156833 ], ...
[ [ 6.07375846, 0, 3.7191044284165786e-16 ], [ -3.8169255836547096e-16, 6.23351253, 3.8169255836547096e-16 ], [ 0, 0, 12.42615759 ] ]
[ 68, 68, 68, 68, 29, 29, 29, 29, 50, 50, 50, 50, 50, 50, 50, 50, 50, 50, 50, 50 ]
[ 1, 1, 1 ]
alex<agm003721047>
Pbcm
Cu-Er-Sn
0.042263
null
null
0.000001
2,016.628587
59.4645
[ [ 0.004604847031583176, 0.7768058737571135, 5.643662325 ], [ 2.2020429724834125, 4.771916502983241, 1.8812207750000007 ], [ 0.0000628052996888402, 3.952864266179115, 7.165097218818659 ], [ 2.2065850142153067, 1.5958581105612388, 0.3597858811813423 ], [...
[ [ 4.40738155, 0, 2.6987428539143e-16 ], [ -2.200733730485005, 5.548722376740354, 3.6550911115218353e-16 ], [ 0, 0, 7.5248831 ] ]
[ 60, 60, 50, 50, 50, 50, 44, 44 ]
[ 1, 1, 1 ]
alex<agm002310245>
Cmcm
Nd-Ru-Sn
0
null
null
-0.000047
3,388.178534
91.068863
[ [ 3.4413762674999995, 3.804361331792825, 6.6619056895889655 ], [ 1.1471254224999996, 7.010687658207176, 2.5706222195889654 ], [ 3.4413762675, 0.19934500179282483, 5.611944720411034 ], [ 1.1471254224999998, 3.405671328207175, 1.5206612504110348 ], [ ...
[ [ 4.58850169, 0, 2.8096469537703605e-16 ], [ -4.4148717094084385e-16, 7.21003266, 4.4148717094084385e-16 ], [ 0, 0, 8.18256694 ] ]
[ 60, 60, 60, 60, 50, 50, 50, 50, 44, 44, 44, 44 ]
[ 1, 1, 1 ]
alex<agm002310283>
Pnma
Nd-Ru-Sn
0.033573
null
null
0.000171
3,971.31547
113.804764
[ [ 2.0892982700000005, -3.8158592698828193, 5.283748783343425 ], [ 2.08929827, -1.4402236767946299e-16, 4.406174753313149 ], [ 2.0892982699999996, -2.6679310386491175, 1.5403307033434253 ], [ 1.8961411537488886e-33, -8.703880421638753e-17, 1.891425473290637...
[ [ 4.17859654, 0, 2.5586524388196023e-16 ], [ -3.970176523843133e-16, 6.483790308531937, 3.7434180800000014 ], [ 3.970176523843133e-16, -6.483790308531937, 3.7434180799999988 ] ]
[ 60, 60, 60, 50, 50, 50, 44, 44, 44 ]
[ 1, 1, 1 ]
alex<agm002310279>
P-62m
Nd-Ru-Sn
0.046208
null
null
0.000101
3,971.31547
108.750694
[ [ -1.5393553341563788, -0.9295674805613603, -3.83955689368895 ], [ 1.9736063257754755, -4.27409234157182, -1.3913413825566945 ], [ -0.24672726791736302, -1.5809858661507632, -0.6154026167652537 ], [ 0.6809782595364607, -3.6226739559824175, -4.6154956594803...
[ [ 4.361751555683037, 0, -1.7487136143375936 ], [ 0.4342509916190963, -5.20365982213318, 1.083136153754355 ], [ -4.361751555683037, 0, -4.565320815662407 ] ]
[ 60, 60, 50, 50, 44, 44 ]
[ 1, 1, 1 ]
alex<agm002236522>
C2/m
Nd-Ru-Sn
0.069822
null
null
0.000036
3,971.31547
93.971695
[ [ -1.5374387846743838, 3.1796082321499655, -3.605511693925268 ], [ -4.241158641605188, -3.179608232149965, -1.9382668994322978 ], [ -1.8155919176258355, -0.750232274592351, -4.257820010402953 ], [ -3.9630055086537372, 0.750232274592351, -1.285958582954613 ...
[ [ -5.778597426279572, 0, 2.4640718866424343 ], [ -1.1064952665227297, 5.796652075929247, -2.594888052568662 ], [ 1.1064952665227297, -5.796652075929247, -5.412962427431339 ] ]
[ 60, 60, 60, 60, 50, 50, 50, 50, 44, 44 ]
[ 1, 1, 1 ]
alex<agm003405836>
Ibam
Nd-Ru-Sn
0.097606
null
null
-0
3,321.880014
75.461571
[ [ 2.00336996216457, 4.252587293046139, 1.3947648072482983 ], [ 3.7162544624258675, 1.9225681846510287, 4.1086807149827775 ], [ 4.710535533482763, 1.4281592894035648, 10.062904624229956 ], [ 2.9976510332214654, 3.758178397798675, 7.348988716495478 ], [ ...
[ [ 4.409157406874178, 0, 0.9721876286069969 ], [ 2.3047480887731546, 5.680746582449704, 0.019317482871256998 ], [ 0, 0, 10.46616432 ] ]
[ 60, 60, 60, 60, 50, 50, 50, 50, 44, 44 ]
[ 1, 1, 1 ]
alex<agm002352884>
C2/m
Nd-Ru-Sn
0.030209
null
null
0
3,321.880014
80.123245
[ [ 2.249855874264546, -3.126972742655382, -1.5244077950194441 ], [ -1.7582722779983757, -0.020956823739766952, -6.761687848345156 ], [ -0.921787654167272, -2.1418153243314415, -3.5448664828744425 ], [ 0.29519387528185337, -5.27559053691125, 1.13521020206778...
[ [ 4.95730611216705, 0, -1.2890707536038999 ], [ 0.46764596951923026, -6.725596358053271, 1.7983995188368918 ], [ -4.95730611216705, 0, -8.8874797763961 ] ]
[ 60, 60, 60, 60, 60, 60, 60, 60, 50, 50, 44 ]
[ 1, 1, 1 ]
alex<agm003527432>
C2/m
Nd-Ru-Sn
0.064926
null
null
0.000219
3,193.212662
61.271164
[ [ 0, 0, 0 ], [ -4.655338796482158, -2.8536439536440623, -1.9578210736938535 ], [ -2.331731331459958, -1.4293118731919623, -9.598153196937906 ], [ -3.4935350639710583, -2.1414779134180124, -5.77798713531588 ], [ -4.004154143756093, -3.9380953502...
[ [ -2.180845318574773, -4.282955826836025, -1.46168778031588 ], [ -4.806224809367344, 0, -1.46168778031588 ], [ 0, 0, -8.63259871 ] ]
[ 68, 29, 29, 29, 29, 29, 29, 29, 29, 29, 50, 50 ]
[ 1, 1, 1 ]
alex<agm003537925>
R-3m
Cu-Er-Sn
0.04329
null
null
0.000508
1,798.339636
105.879875
[ [ 2.32894225, 2.32845571801889, -0.38655997946618703 ], [ -2.3293224490113286e-16, 3.8040722445575224, 8.3734548873122 ], [ -5.2221339301685714e-17, 0.8528391914802578, 5.045257923755425 ], [ 2.32894225, 1.306158551317486, 7.749871913872977 ], [ 2....
[ [ 4.6578845, 0, 2.852131671861535e-16 ], [ -2.851535842028186e-16, 4.65691143603778, -0.7731199589323744 ], [ 0, 0, 14.19183277 ] ]
[ 60, 60, 60, 50, 50, 50, 50, 50, 50, 50, 44, 44 ]
[ 1, 1, 1 ]
alex<agm002236469>
Cmmm
Nd-Ru-Sn
0.022497
null
null
0.000071
2,925.376782
69.993965
[ [ 2.5886187000062733, 4.847424614260257, 0.37945573905501273 ], [ 2.5886187000027334, 2.112402680098482, 7.453526732038914 ], [ 3.9607351044720926e-12, 3.0606658755075795, 0.8479121005831937 ], [ 2.5886186741160016, 1.69116296664867, 3.2482861647758745 ]...
[ [ 5.1772374, 0, 3.1701436051679826e-16 ], [ -2.588618699993306, 5.173068555606061, -1.1374808273778916 ], [ 0, 0, 9.43891966 ] ]
[ 60, 60, 60, 60, 60, 60, 50, 44, 44 ]
[ 1, 1, 1 ]
alex<agm003498106>
C2/m
Nd-Ru-Sn
0.083714
null
null
0.000013
3,784.83489
62.533504
[ [ 0, 0, -1.8745562858505784 ], [ 0, 0, -15.998397154149421 ], [ 0, 0, -10.811033005850577 ], [ 0, 0, -7.061920434149419 ], [ -2.1800194600000005, -1.258634822069623, -9.003968566780125 ], [ -2.18001946, 1.2586348220696228, -...
[ [ -2.1800194600000005, -3.775904466208868, -5.339507707535883e-16 ], [ -2.1800194599999996, 3.775904466208868, 2.6697538537679413e-16 ], [ 0, 0, -17.87295344 ] ]
[ 57, 57, 57, 57, 44, 44, 44, 44, 53, 53 ]
[ 1, 1, 1 ]
mp-1205711
P6_3/mmc
I-La-Ru
0.001372
0
null
null
5,087.662265
63.405266
[ [ 3.3012952499999995, 6.54064228198139, 10.713850110986709 ], [ 1.1004317499999998, 3.0159299660346326, 1.3460463340216828 ], [ 1.1004317499999996, 8.431668128702057, 7.944293690905443 ], [ 3.30129525, 1.124904119313966, 4.115602754102948 ], [ 1.10...
[ [ 4.401727, 0, 2.695280440635241e-16 ], [ -5.851712807176624e-16, 9.556572248016023, -0.56546516499161 ], [ 0, 0, 12.62536161 ] ]
[ 57, 57, 57, 57, 57, 57, 44, 44, 53, 53, 53, 53, 53, 53 ]
[ 1, 1, 1 ]
mp-29824
P2_1/m
I-La-Ru
0
0.1048
null
0.000024
4,371.514776
17.203806
[ [ -1.3722415603993787, -0.8266072050266345, -3.18974691387641 ], [ -4.650555014722174, -2.801388905189024, -7.475261909642768 ], [ -3.0113982875607768, -1.813998055107829, -5.332504411759589 ], [ 0, 0, 0 ] ]
[ [ -1.9186869854631878, -3.627996110215658, -1.0462849567595887 ], [ -4.104109589658366, 0, -1.0462849567595887 ], [ 0, 0, -8.57243891 ] ]
[ 57, 57, 44, 53 ]
[ 1, 1, 1 ]
alex<agm003637733>
R-3m
I-La-Ru
0
null
null
-0
4,505.696141
32.434685
[ [ -5.629018373025057, -3.3851175912155043, -3.5019810396815116 ], [ -4.363533065629222, -2.6240938581932474, -8.568940546858032 ], [ -1.991981334254352, -1.1979159791467466, -0.7043008846519292 ], [ -3.001741204569065, -1.805154341751147, -5.34138266881015...
[ [ -1.9133125136939801, -3.6049112661581515, -1.0192881387207349 ], [ -4.081194679494222, 0, -1.0192881387207349 ], [ 0, 0, -8.68012569 ] ]
[ 57, 57, 44, 53 ]
[ 1, 1, 1 ]
alex<agm005106808>
R3m
I-La-Ru
0.012972
null
null
0.000459
4,505.696141
36.674118
[ [ 0, 0, -2.0371673665348076 ], [ 0, 0, -10.269521083465191 ], [ -2.1616521, 1.24803042182932, -0.076858469109246 ], [ -2.1616521, -1.24803042182932, -12.229829980890752 ], [ -2.1616521, -1.24803042182932, -4.23662291059288 ], [ -2.1...
[ [ -2.1616521000000004, -3.7440912654879597, -5.294520650270309e-16 ], [ -2.1616520999999995, 3.7440912654879597, 2.6472603251351544e-16 ], [ 0, 0, -12.30668845 ] ]
[ 57, 57, 44, 44, 53, 53 ]
[ 1, 1, 1 ]
alex<agm002352665>
P-3m1
I-La-Ru
0.073549
null
null
0.000154
5,037.910803
28.622644
[ [ -1.768717799748817e-33, -2.1399472337102825e-16, 3.2036451413003997 ], [ 4.656706, 2.774438077076733, 5.8739848693498 ], [ 4.656706, 3.6998010797639767, 2.136081149349801 ], [ 2.328353, 4.408676681224885e-16, 5.649348069488961 ], [ 2.328352999999...
[ [ 4.656706, 0, 2.851410048735137e-16 ], [ -3.9643281301697176e-16, 6.474239156840711, 3.737903720000001 ], [ 3.9643281301697176e-16, -6.474239156840711, 3.7379037199999985 ] ]
[ 69, 69, 69, 12, 12, 12, 81, 81, 81 ]
[ 1, 1, 1 ]
mp-1206000
P-62m
Mg-Tl-Tm
0
0
null
0.000015
4,688.718456
40.478184
[ [ 3.3306690738754696e-16, 3.2343442112144736, -7.11465319991333e-17 ], [ 2.220446049250313e-16, 9.703032633643419, 6.661338147750939e-16 ], [ 5.60592568579389e-16, 6.468688422428945, 4.440892098500626e-16 ], [ 0, 0, 0 ] ]
[ [ 1.524684482960806, 4.312458948285964, 2.6408309900000004 ], [ 1.524684482960806, 4.312458948285964, -2.6408309899999995 ], [ -3.0493689659216114, 4.312458948285964, 0 ] ]
[ 69, 69, 12, 81 ]
[ 1, 1, 1 ]
mp-971705
Fm-3m
Mg-Tl-Tm
0.025284
0
null
-0.000003
4,214.999077
47.510975
[ [ 0, 0, 0 ], [ -2.2843389100000002, -1.3188636846088366, -2.7228775000000005 ], [ -2.28433891, 1.3188636846088366, -2.7228775 ] ]
[ [ -2.2843389100000002, -3.956591053826509, -5.595016668598507e-16 ], [ -2.2843389099999993, 3.956591053826509, 2.7975083342992537e-16 ], [ 0, 0, -5.445755 ] ]
[ 19, 30, 51 ]
[ 1, 1, 1 ]
mp-10161
P-6m2
K-Sb-Zn
0.009967
0.3446
23.978486
-0
3,623.010749
24.11795
[ [ 0, 0, 5.452541768479887 ], [ 0, 0, 1.862641581520113 ], [ 1.8967804249999998, 1.896780425, 3.6575916750000004 ], [ 1.8967804249999998, 1.896780425, 2.3228860761616063e-16 ] ]
[ [ 3.79356085, 0, 2.3228860761616063e-16 ], [ -2.3228860761616063e-16, 3.79356085, 2.3228860761616063e-16 ], [ 0, 0, 7.31518335 ] ]
[ 69, 69, 12, 81 ]
[ 1, 1, 1 ]
alex<agm001146926>
P4/mmm
Mg-Tl-Tm
0.045981
null
null
0.000582
4,214.999077
41.082184
[ [ -1.5037009481582987e-16, 2.45573001, 1.5037009481582987e-16 ], [ 0, 0, 2.45573001 ], [ 2.16408803, 2.45573001, 2.4557300100000004 ], [ 2.16408803, 0, 1.3251217395063004e-16 ] ]
[ [ 4.32817606, 0, 2.650243479012601e-16 ], [ -3.0074018963165974e-16, 4.91146002, 3.0074018963165974e-16 ], [ 0, 0, 4.91146002 ] ]
[ 69, 69, 12, 81 ]
[ 1, 1, 1 ]
alex<agm001214907>
P4/mmm
Mg-Tl-Tm
0.035486
null
null
0.000004
4,214.999077
43.367256
[ [ 0, 0, 6.154947709070997 ], [ 0, 0, 2.087331270929003 ], [ 2.44679239, 2.47939806, 6.206812744089387 ], [ 2.44679239, 2.47939806, 2.035466235910614 ], [ -1.5181934489955786e-16, 2.47939806, 1.5181934489955786e-16 ], [ -1.5181934489...
[ [ 4.89358478, 0, 2.9964564685916026e-16 ], [ -3.036386897991157e-16, 4.95879612, 3.036386897991157e-16 ], [ 0, 0, 8.24227898 ] ]
[ 69, 69, 12, 12, 12, 81, 81, 81 ]
[ 1, 1, 1 ]
alex<agm003329721>
Pmmm
Mg-Tl-Tm
0.060662
null
null
-0
4,950.834056
39.122429
[ [ 2.1719563718033315, -1.343643083067657, -4.706268905 ], [ 0.8332381308338868, 1.3469029761700717, -0.6107847803064171 ], [ -2.1719563718033315, 1.3436430830676565, -4.706268905 ], [ -0.8332381308338874, -1.3469029761700728, -8.801753029693582 ], [ ...
[ [ -2.681469834427424, 5.374572332270627, -1.2186130104713493 ], [ 6.006355652785902, 0, -1.2186130104713493 ], [ -3.324885818358478, -5.374572332270627, -6.975311789057301 ] ]
[ 69, 69, 69, 69, 12, 12, 12, 12, 12, 12, 81, 81 ]
[ 1, 1, 1 ]
alex<agm003428149>
Fmmm
Mg-Tl-Tm
0.079816
null
null
0.000001
3,921.442714
44.59005