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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|
[
[
-1.1996501751207678e-16,
1.959177415,
2.81182117
],
[
1.557172605,
0,
9.53493223216598e-17
],
[
0,
0,
2.81182117
],
[
1.5571726049999999,
1.959177415,
1.468099183925503
],
[
1.5571726049999999,
1.959177415,
4.155543156074497
]
] | [
[
3.11434521,
0,
1.906986446433196e-16
],
[
-2.3993003502415357e-16,
3.91835483,
2.3993003502415357e-16
],
[
0,
0,
5.62364234
]
] | [
41,
47,
8,
8,
8
] | [
1,
1,
1
] | mp-2349989 | Pmmm | Ag-Nb-O | 0.070192 | 0.9228 | null | null | 3,989.949077 | 115.36763 |
[
[
0,
0,
3.421162365
],
[
-1.9662887628784704e-16,
3.2111932424066714,
-1.180080458110429
],
[
1.5578004999999997,
3.2111932424066714,
2.241081906889571
],
[
1.5578005,
0,
9.538776980175731e-17
],
[
-2.8988248041387394e-16,
4.734140171936944,
... | [
[
3.115601,
0,
1.9077553960351462e-16
],
[
-3.932577525756941e-16,
6.422386484813343,
-2.360160916220858
],
[
0,
0,
6.84232473
]
] | [
41,
41,
47,
47,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | mp-557680 | Cmmm | Ag-Nb-O | 0.070791 | 0.8149 | 118.331044 | -0.000004 | 3,989.949077 | 120.106361 |
[
[
1.363103207741192e-10,
1.2803490486050084,
5.92892170408861
],
[
1.9003156054227812,
3.971137387940034,
0.10802993927137712
],
[
-1.8576774046119394e-8,
4.0049621595629565,
3.3624619332167383
],
[
1.9003156241358654,
1.2465242769820861,
2.674489710143248... | [
[
3.80063121,
0,
2.327215423033016e-16
],
[
-1.9003156044409089,
5.251486436545043,
-0.9639343866400134
],
[
0,
0,
7.00088603
]
] | [
41,
41,
47,
47,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm003710340> | C2/m | Ag-Nb-O | 0.008602 | null | null | 0.000031 | 3,989.949077 | 105.800507 |
[
[
2.7749523108338523,
4.3902669648726,
7.251104466788833
],
[
1.8286424088047375,
3.8534043501927226,
1.5952702009747557
],
[
3.40047827292707,
1.232532195156109,
4.3723844556743705
],
[
4.346788174956185,
1.7693948098359864,
10.028218721488448
],
[
... | [
[
4.154411320965322,
0,
0.9027248670794525
],
[
2.0210192627956,
5.622799160028709,
0.7099366853837513
],
[
0,
0,
10.01082737
]
] | [
57,
57,
57,
57,
14,
14,
14,
14,
77,
77
] | [
1,
1,
1
] | alex<agm003402932> | C2/m | Ir-La-Si | 0.019343 | null | null | -0.000012 | 5,067.588342 | 88.275291 |
[
[
2.9943749885129414,
1.9182027393195078,
-0.29589011808413734
],
[
1.5675691135012617,
0,
2.97439508
],
[
1.6373265762617673,
2.1283164140436366,
1.0495666240513477
],
[
1.6373265762617675,
1.708089064595379,
4.307443299780377
],
[
0.1031909395943... | [
[
3.17596481,
0,
1.9447175693855659e-16
],
[
-2.34912084482332e-16,
3.8364054786390156,
-0.591780236168275
],
[
0,
0,
5.94879016
]
] | [
41,
47,
8,
8,
8
] | [
1,
1,
1
] | alex<agm002171921> | P2 | Ag-Nb-O | 0.047741 | null | null | 0 | 3,989.949077 | 93.761353 |
[
[
-0.06868351423444864,
-0.04810042139791559,
-5.600910991001454
],
[
-3.3497483360470093,
-2.3458949114169267,
-5.489445548908359
],
[
-4.953803246311602,
-3.4692462423600867,
-8.360101802695446
],
[
-1.6727384244990413,
-1.1714517523410752,
-2.7485206047... | [
[
-1.6718739630214876,
-4.595588980038023,
-2.7500578779069036
],
[
-4.890255680603632,
0,
-2.7500578779069036
],
[
0,
0,
-5.72304664
]
] | [
41,
41,
47,
47,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm002171920> | R3c | Ag-Nb-O | 0.038316 | null | null | -0.000003 | 3,989.949077 | 121.382011 |
[
[
0,
0,
0
],
[
3.296921695125638,
1.154134901598968,
1.0263331600799979
],
[
1.8794769157697924,
2.308269803197936,
4.174968215079998
],
[
1.4174447793558456,
-1.1541349015989684,
3.1486350550000006
],
[
2.5649825157495707,
3.1501699420503018,
... | [
[
0.9554126429418982,
-4.616539606395872,
2.1223018949200023
],
[
4.7143664744814835,
0,
-2.1223018949200023
],
[
-0.9554126429418982,
4.616539606395872,
4.174968215079998
]
] | [
41,
47,
47,
47,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm002173527> | I-42m | Ag-Nb-O | 0.070768 | null | null | 0.00001 | 2,710.922215 | 83.899971 |
[
[
-3.745935617041764e-16,
4.971334828356496,
-4.572071365949169e-16
],
[
4.440892098500626e-16,
14.91400448506948,
1.3322676295501878e-15
],
[
4.440892098500626e-16,
9.942669656712987,
8.881784197001252e-16
],
[
0,
0,
0
],
[
2.5453983871615717,
... | [
[
2.3435097124531583,
6.628446437808657,
4.059077890000001
],
[
2.3435097124531583,
6.628446437808657,
-4.059077889999999
],
[
-4.687019424906316,
6.628446437808657,
0
]
] | [
37,
37,
37,
67,
17,
17,
17,
17,
17,
17
] | [
1,
1,
1
] | mp-1205794 | Fm-3m | Cl-Ho-Rb | 0.055441 | 4.6924 | null | -0.000002 | 3,735.943484 | 7.594869 |
[
[
4.79076707499779,
3.1952974596136414,
7.744005650572618
],
[
2.783012199855821,
1.838057798192216,
3.061129085129735
],
[
6.798521950139758,
4.552537121035067,
12.4268822160155
],
[
0,
0,
0
],
[
7.390788077716317,
4.950600057181476,
6.845... | [
[
6.912947332368213,
0,
3.3046532312904113
],
[
2.6685868176273666,
6.390594919227283,
3.3004935698548237
],
[
0,
0,
8.8828645
]
] | [
37,
37,
37,
67,
17,
17,
17,
17,
17,
17
] | [
1,
1,
1
] | alex<agm002262176> | R-3m | Cl-Ho-Rb | 0.029413 | null | null | 0.000011 | 3,735.943484 | 8.497065 |
[
[
4.0896379687797255,
7.6546632546160565,
2.669041464304024
],
[
3.89370442584838,
4.10527782,
-0.047458124164859
],
[
3.6977708829170344,
0.555892385383944,
8.359086647366258
],
[
0.19593354293134574,
4.661170205383945,
8.278021768468882
],
[
0,
... | [
[
7.787408851696761,
0,
-0.0949162483297185
],
[
-5.027515341873625e-16,
8.21055564,
5.027515341873625e-16
],
[
0,
0,
11.12304436
]
] | [
37,
37,
37,
37,
37,
37,
67,
67,
17,
17,
17,
17,
17,
17,
17,
17,
17,
17,
17,
17
] | [
1,
1,
1
] | alex<agm003572738> | P2_1/c | Cl-Ho-Rb | 0 | null | null | -0 | 3,735.943484 | 7.322881 |
[
[
2.6995294973085344,
5.999019366459885,
6.442192535625373
],
[
2.6995294973085344,
5.999019366459885,
0.9629785143746287
],
[
-2.687250152650948e-8,
2.3516813216875314,
8.36814956437463
],
[
-2.687250152650948e-8,
2.3516813216875314,
13.847363585625372
... | [
[
5.39905894,
0,
3.3059701246394505e-16
],
[
-2.699529469563967,
8.350700688147416,
5.373871743716039e-16
],
[
0,
0,
14.8103421
]
] | [
37,
37,
37,
37,
67,
67,
17,
17,
17,
17,
17,
17,
17,
17,
17,
17
] | [
1,
1,
1
] | alex<agm003471161> | Cmcm | Cl-Ho-Rb | 0.033102 | null | null | 0 | 3,513.323836 | 7.442729 |
[
[
0,
0,
0
],
[
2.63643144,
2.1830256923215305,
4.509110603616483
],
[
2.6364314399999995,
5.009346424974005,
-0.06424954149758037
],
[
-1.3041716384559286e-16,
2.129873918527274,
4.59511719200698
],
[
-3.0998861074053966e-16,
5.062498198768262,... | [
[
5.27286288,
0,
3.228697324167447e-16
],
[
-4.4040577458613247e-16,
7.192372117295536,
-3.5966733678810985
],
[
0,
0,
8.04153443
]
] | [
37,
67,
67,
17,
17,
17,
17,
17,
17,
17
] | [
1,
1,
1
] | alex<agm003508593> | Cmmm | Cl-Ho-Rb | 0.036261 | null | null | -0.000022 | 2,875.106095 | 14.279434 |
[
[
4.834814417861537,
2.011273594904593,
7.546867466706753
],
[
3.9489801195711305,
1.545338092253671,
1.9540258166964615
],
[
1.3368264410759334,
3.820516824226647,
3.680664852541993
],
[
2.2226607393663396,
4.286452326877568,
9.273506502552284
],
[
... | [
[
4.177464640587953,
0,
0.985266347148164
],
[
1.9941762183495169,
5.83179041913124,
0.8935448521005811
],
[
0,
0,
9.34872112
]
] | [
57,
57,
57,
57,
14,
14,
14,
14,
77,
77
] | [
1,
1,
1
] | alex<agm002242931> | C2/m | Ir-La-Si | 0.040443 | null | null | 0.000018 | 5,067.588342 | 91.961418 |
[
[
2.4988650224908535,
1.078963,
1.1690343247894337
],
[
1.6189056626233238,
3.2368889999999997,
6.260468925880409
],
[
3.357753749762654,
1.078963,
4.49044230551201
],
[
0.7600169353515237,
3.2368889999999997,
2.9390609451578333
],
[
3.933932812877... | [
[
4.117770685114178,
0,
-1.064821559330157
],
[
-2.642697168696851e-16,
4.315852,
2.642697168696851e-16
],
[
0,
0,
8.49432481
]
] | [
62,
62,
26,
26,
32,
32,
32,
32
] | [
1,
1,
1
] | mp-1206145 | Cmcm | Fe-Ge-Sm | 0.044478 | 0 | null | 0.015405 | 2,333.900451 | 97.624496 |
[
[
3.18059136,
2.648577140090241,
1.0585870469130527
],
[
1.06019712,
1.609643587215572,
6.079290422019754
],
[
1.06019712,
0.5085294087526276,
3.0735987758358694
],
[
3.1805913599999998,
3.749691318553186,
4.064278693096937
],
[
3.18059136,
1.3... | [
[
4.24078848,
0,
2.5967340189464847e-16
],
[
-2.6074081918789893e-16,
4.2582207273058135,
-1.068271381067194
],
[
0,
0,
8.20614885
]
] | [
62,
62,
26,
26,
32,
32,
32,
32
] | [
1,
1,
1
] | alex<agm002212121> | P2_1/m | Fe-Ge-Sm | 0.058978 | null | null | 0.000194 | 2,333.900451 | 95.351242 |
[
[
3.148604175,
1.1890882258969753,
8.853597341352524
],
[
3.1486041749999996,
4.658684665896976,
6.341706273647477
],
[
1.0495347249999996,
5.7501046541030245,
1.2766050686474777
],
[
1.0495347249999998,
2.280508214103025,
3.7884961363525234
],
[
1... | [
[
4.1981389,
0,
2.5706186831304954e-16
],
[
-4.249030174579052e-16,
6.93919288,
4.249030174579052e-16
],
[
0,
0,
10.13020241
]
] | [
62,
62,
62,
62,
26,
26,
26,
26,
32,
32,
32,
32,
32,
32,
32,
32
] | [
1,
1,
1
] | alex<agm003619702> | Pnma | Fe-Ge-Sm | 0.075098 | null | null | 0.009473 | 2,333.900451 | 96.728104 |
[
[
-2.262379617567593e-16,
3.6947463042286963,
5.502331450122017
],
[
2.1118685,
0.41454528345664443,
1.5361543247951381
],
[
-1.7548241040230378e-16,
2.865845246555684,
2.430725052977149
],
[
-1.3831260462550389e-16,
2.258816251702981,
0.18129597265195677
... | [
[
4.223737,
0,
2.586292998745122e-16
],
[
-2.522629179499877e-16,
4.119766092976734,
-1.1117565311165094
],
[
0,
0,
8.18905702
]
] | [
62,
62,
26,
32,
32,
32,
32
] | [
1,
1,
1
] | mp-1219389 | Amm2 | Fe-Ge-Sm | 0.000507 | 0 | null | 0.008918 | 2,414.493336 | 77.990654 |
[
[
0,
0,
0
],
[
1.0575323099415361,
-0.9364828299161276,
3.040606245
],
[
2.716110648368288,
0.9364828299161276,
1.7281214863903318
],
[
2.512410232419969,
-1.4242592767062419,
1.1424441026091816
],
[
1.2612327258898548,
1.4242592767062416,
... | [
[
0.4564862814563202,
-3.7459313196645105,
1.3124847586096682
],
[
3.773642958309824,
0,
-1.3124847586096682
],
[
-0.4564862814563202,
3.7459313196645105,
4.7687277313903325
]
] | [
62,
26,
26,
32,
32
] | [
1,
1,
1
] | mp-22349 | I4/mmm | Fe-Ge-Sm | 0 | 0 | null | 0.054402 | 2,205.862568 | 104.484764 |
[
[
3.639666782279204,
2.5484524987470603,
-3.520028712955536e-11
],
[
4.541177288044475,
1.2609268951635686,
2.6707830809211166
],
[
4.554160216201851,
-1.2609268951635688,
-3.574711971176668
],
[
2.1256416256595996,
4.710763576822067,
-1.623472902232152
... | [
[
1.8552698781167867,
5.0969049974941205,
3.05105688173796
],
[
3.5687938083248345,
-5.0969049974941205,
0.12118238645367971
],
[
0,
0,
-6.22329615
]
] | [
62,
26,
26,
26,
26,
32,
32,
32,
32,
32,
32
] | [
1,
1,
1
] | alex<agm002336870> | I-42m | Fe-Ge-Sm | 0.027487 | null | null | 0.005781 | 1,984.910694 | 110.650871 |
[
[
2.120551949573061,
1.2361462018286753,
5.255736920371862
],
[
0,
0,
0
],
[
-1.3594879416448364e-9,
3.9362196674255108,
1.2230380274370518
],
[
2.1205519705271616,
1.9640968536530945,
2.3498905987222036
],
[
-2.2313588731815123e-8,
3.208269015... | [
[
4.2411039,
0,
2.596927157993178e-16
],
[
-2.120551951786427,
5.172365869254186,
-1.6659614921910866
],
[
0,
0,
8.14473644
]
] | [
62,
62,
62,
26,
26,
32,
32,
32,
32
] | [
1,
1,
1
] | alex<agm003337832> | C2/m | Fe-Ge-Sm | 0.096976 | null | null | 0.000991 | 2,468.890113 | 85.448746 |
[
[
2.1038910448478605,
2.13382083,
-0.35149170169098903
],
[
0.778045375334083,
0,
4.610258334810859
],
[
3.429736714361638,
0,
7.529900421807161
],
[
2.640284336327136,
2.13382083,
2.82297324206765
],
[
1.5674977533685845,
2.13382083,
9.317... | [
[
4.207782089695721,
0,
-0.7029834033819783
],
[
-2.6131768494134484e-16,
4.26764166,
2.6131768494134484e-16
],
[
0,
0,
12.84314216
]
] | [
62,
62,
62,
26,
26,
32,
32,
32,
32,
32,
32,
32
] | [
1,
1,
1
] | alex<agm002273536> | Cmmm | Fe-Ge-Sm | 0.053761 | null | null | 0.000134 | 2,353.163127 | 83.029945 |
[
[
0,
0,
-3.43075831
],
[
0,
0,
-10.29227493
],
[
0,
0,
-6.86151662
],
[
0,
0,
0
],
[
-2.0246353450000005,
1.1689237614465808,
-7.75981031994151
],
[
-2.024635345,
-1.1689237614465813,
-0.898293699941509
],
[
-2.02463... | [
[
-2.0246353450000005,
-3.506771284339743,
-4.958926389389694e-16
],
[
-2.0246353449999996,
3.506771284339743,
2.479463194694847e-16
],
[
0,
0,
-13.72303324
]
] | [
62,
62,
26,
26,
26,
26,
26,
26,
32,
32,
32,
32
] | [
1,
1,
1
] | alex<agm002272096> | P6_3/mmc | Fe-Ge-Sm | 0.017165 | null | null | 0.054009 | 2,108.699736 | 137.788315 |
[
[
2.515348488348522,
-1.7083246151514084,
0.5461033943112452
],
[
0.7747587517311743,
0.9077887877545501,
1.9544002996856675
],
[
3.0643151924063416,
1.2626881218498356,
1.9309225767451739
],
[
0.017243859507219433,
0.020204718285905924,
0.0434992236142444... | [
[
0.6243966993117437,
-3.923962487503724,
1.575098174484818
],
[
3.973330195371109,
0,
-1.575098174484818
],
[
-0.6243966993117437,
3.923962487503724,
4.223996575515182
]
] | [
62,
26,
32,
32,
32
] | [
1,
1,
1
] | alex<agm002212140> | I4mm | Fe-Ge-Sm | 0.042606 | null | null | 0.000388 | 2,259.586207 | 89.480881 |
[
[
2.103156786206614,
1.1399213687181957,
5.307478300465486
],
[
0,
0,
0
],
[
-2.0360888444186367e-8,
4.367538728639136,
1.0433709677326746
],
[
2.103156786405956,
2.438060445292662,
-0.23255557080259512
],
[
-2.056023063084581e-8,
3.06939965206... | [
[
4.20631353,
0,
2.5756242003623524e-16
],
[
-2.1031567641542743,
5.507460097357332,
-1.9404315318018392
],
[
0,
0,
8.2912808
]
] | [
57,
57,
57,
14,
14,
14,
14,
77,
77
] | [
1,
1,
1
] | alex<agm003338170> | C2/m | Ir-La-Si | 0.050299 | null | null | 0.000002 | 5,366.779425 | 98.205406 |
[
[
0,
0,
0
],
[
3.603664361172787,
-1.2712744697420044,
0.3827250727029732
],
[
1.9215052891422237,
1.2712744697420042,
-3.0725710297828472
],
[
1.6821590720305635,
-2.542548939484009,
-2.6898459575141795
],
[
0.6467536600793188,
1.5219952206645... | [
[
2.160851506253884,
5.085097878968018,
2.689845957948485
],
[
3.364318144061127,
-5.085097878968018,
0.765450144971641
],
[
0,
0,
-6.14514206
]
] | [
26,
47,
47,
47,
9,
9,
9,
9,
9,
9
] | [
1,
1,
1
] | mp-1205948 | I4/mmm | Ag-F-Fe | 0.011085 | 1.7972 | null | 0.028963 | 1,423.10117 | 38.788834 |
[
[
1.5486190609498784,
0,
9.482556880454242e-17
],
[
4.6580542890501215,
0,
2.852235637669916e-16
],
[
3.103336676165793,
2.5940632386622036,
2.220981667828119
],
[
3.1033366450632682,
2.4401753650629447,
5.392847893280752
],
[
0,
0,
3.84839... | [
[
6.20667335,
0,
3.80049132571534e-16
],
[
-3.1033366722353346,
6.151791879524869,
-2.141204763117085
],
[
0,
0,
7.69678497
]
] | [
26,
26,
47,
47,
47,
47,
47,
9,
9,
9,
9,
9,
9,
9,
9,
9,
9,
9,
9
] | [
1,
1,
1
] | alex<agm003368890> | C2/m | Ag-F-Fe | 0.009097 | null | null | 0.032081 | 1,425.936037 | 39.49139 |
[
[
0,
0,
2.98878201
],
[
2.59170122,
2.76501938,
2.9887820100000004
],
[
2.59170122,
0,
1.586959301709645e-16
],
[
-1.6930860666486995e-16,
2.76501938,
1.6930860666486995e-16
],
[
0.7487128333960432,
0,
1.2410684171528221
],
[
4.4346... | [
[
5.18340244,
0,
3.17391860341929e-16
],
[
-3.386172133297399e-16,
5.53003876,
3.386172133297399e-16
],
[
0,
0,
5.97756402
]
] | [
26,
26,
47,
47,
9,
9,
9,
9,
9,
9,
9,
9
] | [
1,
1,
1
] | alex<agm003734379> | Pmna | Ag-F-Fe | 0 | null | null | 0.058387 | 1,431.702734 | 28.492582 |
[
[
2.529869205,
2.529869205,
3.0981962241647086e-16
],
[
0,
0,
5.211219495
],
[
2.529869205,
2.529869205,
3.5217958102817986
],
[
2.529869205,
2.529869205,
6.900643179718202
],
[
0,
0,
1.6894236847182016
],
[
0,
0,
8.73301530... | [
[
5.05973841,
0,
3.0981962241647086e-16
],
[
-3.0981962241647086e-16,
5.05973841,
3.0981962241647086e-16
],
[
0,
0,
10.42243899
]
] | [
26,
26,
47,
47,
47,
47,
9,
9,
9,
9,
9,
9,
9,
9,
9,
9,
9,
9
] | [
1,
1,
1
] | alex<agm003485481> | P4_2/mnm | Ag-F-Fe | 0 | null | null | 0.029955 | 1,429.563991 | 32.59444 |
[
[
-5.701717926168818e-33,
2.2061963143818103e-16,
3.3146635954504804
],
[
2.379403032237942e-16,
-3.8858600437196658,
2.24350234227476
],
[
-2.3794030322379415e-16,
3.885860043719666,
2.243502342274761
],
[
2.3986755,
2.073460951917094e-16,
5.9011194736457... | [
[
4.797351,
0,
2.937530273268177e-16
],
[
-4.1371280992567674e-16,
6.7564429223792475,
3.9008341400000015
],
[
4.1371280992567674e-16,
-6.7564429223792475,
3.900834139999999
]
] | [
59,
59,
59,
12,
12,
12,
81,
81,
81
] | [
1,
1,
1
] | mp-1205937 | P-62m | Mg-Pr-Tl | 0 | 0 | null | 0.000043 | 4,809.191402 | 39.414017 |
[
[
0,
0,
-3.824334265
],
[
0,
0,
0
],
[
-2.5113555200000004,
1.4499317855028524,
-1.9121671325
],
[
-2.51135552,
-1.4499317855028526,
-5.7365013975000005
],
[
-2.5113555200000004,
1.4499317855028524,
-5.7365013975000005
],
[
-2.51135... | [
[
-2.5113555200000004,
-4.349795356508558,
-6.151046998178074e-16
],
[
-2.5113555199999995,
4.349795356508558,
3.075523499089037e-16
],
[
0,
0,
-7.64866853
]
] | [
59,
59,
12,
12,
81,
81
] | [
1,
1,
1
] | alex<agm002343973> | P6_3/mmc | Mg-Pr-Tl | 0.06179 | null | null | 0.000048 | 4,809.191402 | 37.757397 |
[
[
2.5461970255155264,
0,
5.04027984
],
[
0.6328742068957639,
1.4550034612075222,
2.52013992
],
[
0.6413848839978303,
-1.4550034612075224,
2.52013992
]
] | [
[
3.82045604,
0,
2.339354630334586e-16
],
[
-2.672797997274168e-16,
4.365010383622566,
2.520139920000001
],
[
2.672797997274168e-16,
-4.365010383622566,
2.520139919999999
]
] | [
59,
12,
81
] | [
1,
1,
1
] | alex<agm001271588> | P-6m2 | Mg-Pr-Tl | 0.093565 | null | null | 0 | 4,809.191402 | 39.120895 |
[
[
4.440892098500626e-16,
3.399021538885858,
-3.9419344788349514e-16
],
[
0,
10.19706461665757,
3.3306690738754696e-16
],
[
0,
6.7980430777717125,
-2.220446049250313e-16
],
[
0,
0,
0
]
] | [
[
1.6023141196968826,
4.532028718514476,
2.7752894650000006
],
[
1.6023141196968826,
4.532028718514476,
-2.7752894649999997
],
[
-3.204628239393765,
4.532028718514476,
0
]
] | [
59,
59,
12,
81
] | [
1,
1,
1
] | mp-861505 | Fm-3m | Mg-Pr-Tl | 0.008179 | 0 | null | 0.000528 | 4,337.425593 | 40.516544 |
[
[
-3.843810632431384,
-2.8596527925220427,
-5.89518398944863
],
[
-2.2992180632089383,
-1.7105331099294037,
-3.5262698427749295
],
[
0,
0,
0
],
[
-2.385769448709849,
0,
-6.26630957305589
],
[
-0.6857448991103119,
-2.285092951225723,
-6.2663... | [
[
-1.3714897982206238,
-4.570185902451446,
-2.10342950611178
],
[
-4.771538897419698,
0,
-2.10342950611178
],
[
0,
0,
-5.21459482
]
] | [
57,
57,
14,
77,
77,
77
] | [
1,
1,
1
] | alex<agm002355854> | R-3m | Ir-La-Si | 0.037056 | null | null | 0.000055 | 6,953.533868 | 140.966537 |
[
[
-1.6466282759329232e-16,
2.68914805,
1.6466282759329232e-16
],
[
0,
0,
2.68914805
],
[
2.08368959,
2.68914805,
2.6891480500000005
],
[
2.08368959,
0,
1.2758918934050803e-16
]
] | [
[
4.16737918,
0,
2.5517837868101607e-16
],
[
-3.2932565518658465e-16,
5.3782961,
3.2932565518658465e-16
],
[
0,
0,
5.3782961
]
] | [
59,
59,
12,
81
] | [
1,
1,
1
] | alex<agm001214492> | P4/mmm | Mg-Pr-Tl | 0.040504 | null | null | 0.000003 | 4,337.425593 | 42.395432 |
[
[
0,
0,
0
],
[
-6.911008863472241e-16,
6.602485884110749,
-5.213000670023504e-16
],
[
-9.131454912722554e-16,
3.301242942055374,
8.205555290796695e-16
],
[
-3.4555044317361206e-16,
9.903728826166121,
3.3306690738754696e-16
]
] | [
[
1.5562208471143892,
4.401657256073832,
2.6954535750000006
],
[
1.5562208471143892,
4.401657256073832,
-2.6954535749999997
],
[
-3.112441694228778,
4.401657256073832,
0
]
] | [
59,
12,
81,
81
] | [
1,
1,
1
] | mp-975914 | Fm-3m | Mg-Pr-Tl | 0.049713 | 0 | null | -0.000039 | 5,411.256792 | 37.702488 |
[
[
0,
0,
0
],
[
-3.148480784800758,
-2.0460463405948754,
-5.0092117187269665
],
[
-4.849183497190754,
-3.1512512946551348,
-7.221896726774776
],
[
-1.4477780724107614,
-0.9408413865346164,
-2.7965267106791596
]
] | [
[
-1.8188536045838717,
-4.092092681189751,
-1.9399498237269672
],
[
-4.478107965017644,
0,
-1.9399498237269672
],
[
0,
0,
-6.13852379
]
] | [
59,
12,
81,
81
] | [
1,
1,
1
] | alex<agm001963230> | R-3m | Mg-Pr-Tl | 0.065861 | null | null | -0.000105 | 5,411.256792 | 39.145958 |
[
[
1.8645812949999998,
1.864581295,
3.8967211200000005
],
[
1.8645812949999998,
1.864581295,
2.283453514671777e-16
],
[
0,
0,
6.059458623400465
],
[
0,
0,
1.733983616599536
]
] | [
[
3.72916259,
0,
2.283453514671777e-16
],
[
-2.283453514671777e-16,
3.72916259,
2.283453514671777e-16
],
[
0,
0,
7.79344224
]
] | [
59,
12,
81,
81
] | [
1,
1,
1
] | alex<agm001146920> | P4/mmm | Mg-Pr-Tl | 0.08558 | null | null | 0.003362 | 5,411.256792 | 35.360336 |
[
[
2.29455225,
2.439937365,
2.4399373650000005
],
[
2.29455225,
0,
1.405008034219429e-16
],
[
-1.4940307420836387e-16,
2.439937365,
1.4940307420836387e-16
],
[
0,
0,
2.439937365
]
] | [
[
4.5891045,
0,
2.810016068438858e-16
],
[
-2.9880614841672774e-16,
4.87987473,
2.9880614841672774e-16
],
[
0,
0,
4.87987473
]
] | [
59,
12,
81,
81
] | [
1,
1,
1
] | alex<agm001214511> | P4/mmm | Mg-Pr-Tl | 0.02682 | null | null | -0.000068 | 5,411.256792 | 37.74181 |
[
[
0,
0,
0
],
[
0,
0,
7.970680302674301
],
[
0,
0,
3.9419133273256985
],
[
1.9473001799999998,
1.94730018,
9.994010148164731
],
[
1.9473001799999998,
1.94730018,
1.918583481835268
],
[
1.9473001799999998,
1.94730018,
5.956296... | [
[
3.89460036,
0,
2.3847549324160647e-16
],
[
-2.3847549324160647e-16,
3.89460036,
2.3847549324160647e-16
],
[
0,
0,
11.91259363
]
] | [
59,
59,
59,
12,
12,
81
] | [
1,
1,
1
] | alex<agm003439068> | P4/mmm | Mg-Pr-Tl | 0.049666 | null | null | 0.000165 | 3,941.354962 | 40.284962 |
[
[
0,
0,
0
],
[
0,
0,
7.909832751715621
],
[
0,
0,
4.049647418284381
],
[
1.9496544799999997,
1.94965448,
5.979740085
],
[
1.9496544799999997,
1.94965448,
9.874960715589255
],
[
1.9496544799999997,
1.94965448,
2.0845194544107... | [
[
3.89930896,
0,
2.387638118375297e-16
],
[
-2.387638118375297e-16,
3.89930896,
2.387638118375297e-16
],
[
0,
0,
11.95948017
]
] | [
59,
59,
59,
12,
81,
81
] | [
1,
1,
1
] | alex<agm003419207> | P4/mmm | Mg-Pr-Tl | 0.037902 | null | null | 0.00103 | 4,650.154111 | 40.946144 |
[
[
1.9539462799999998,
1.95394628,
2.006967655847295
],
[
1.9539462799999998,
1.95394628,
5.91537331700424
],
[
1.9539462799999998,
1.95394628,
9.86068575
],
[
1.9539462799999998,
1.95394628,
13.80599818299576
],
[
1.9539462799999998,
1.95394628... | [
[
3.90789256,
0,
2.392894057507878e-16
],
[
-2.392894057507878e-16,
3.90789256,
2.392894057507878e-16
],
[
0,
0,
19.7213715
]
] | [
59,
59,
59,
59,
59,
12,
12,
12,
12,
81
] | [
1,
1,
1
] | alex<agm003648055> | P4/mmm | Mg-Pr-Tl | 0.044472 | null | null | 0.000034 | 3,539.432424 | 40.600155 |
[
[
-1.5835611036387411,
-4.3471636615158,
-5.572448059067908
],
[
2.2655812949992797,
-7.320272653478816,
-1.340521626249125
],
[
1.2760121537450504,
-6.326609231662011,
-4.822750744800033
],
[
0.4702917302897223,
-2.1372158128473484,
-7.658028413350178
]... | [
[
4.897544493720014,
0,
-1.3917690658066797
],
[
0.7473426210870951,
-7.834034260807222,
2.6298499002102327
],
[
-4.897544493720014,
0,
-7.921185154193321
]
] | [
59,
59,
59,
59,
59,
59,
59,
59,
12,
12,
81
] | [
1,
1,
1
] | alex<agm003532528> | C2/m | Mg-Pr-Tl | 0.061539 | null | null | 0.000659 | 3,511.893039 | 31.419708 |
[
[
-2.84047722,
1.6399502875940002,
-3.5328888948508563
],
[
-2.84047722,
-1.639950287594,
-4.590856995149144
],
[
-2.84047722,
-1.639950287594,
-7.5947618398508565
],
[
-2.84047722,
1.6399502875940002,
-0.5289840501491438
],
[
0,
0,
-4.0618... | [
[
-2.8404772200000004,
-4.919850862782,
-6.957162671047945e-16
],
[
-2.8404772199999995,
4.919850862782,
3.4785813355239723e-16
],
[
0,
0,
-8.12374589
]
] | [
57,
57,
57,
57,
14,
14,
77,
77,
77,
77,
77,
77
] | [
1,
1,
1
] | alex<agm002355855> | P6_3/mmc | Ir-La-Si | 0.070953 | null | null | -0.000005 | 6,953.533868 | 145.401398 |
[
[
2.285087053416841,
-3.2605107463996905,
-1.8635280763772126
],
[
-1.7274077070260139,
-0.4780482543481945,
-5.951444898734853
],
[
-0.8429040210763147,
-1.96702150045707,
-2.904060650637049
],
[
0.09866144217009935,
-5.385357720793553,
0.3399186804463687... | [
[
5.212799568091135,
0,
-1.5130157706397602
],
[
0.35513130663722386,
-7.268414209565158,
1.2235353773420325
],
[
-5.212799568091135,
0,
-8.223332189360239
]
] | [
59,
59,
59,
59,
59,
59,
59,
59,
12,
81,
81
] | [
1,
1,
1
] | alex<agm003516535> | C2/m | Mg-Pr-Tl | 0.070523 | null | null | -0 | 3,950.211852 | 36.842854 |
[
[
5.562302253205183,
5.082408347911546,
4.940292092185248
],
[
0.656087294901975,
3.5136689420884544,
1.6516166743173948
],
[
3.765282068955554,
0.7843697029115461,
0.4165217925687159
],
[
2.4531074791516034,
7.8117075870884545,
6.175386973933927
],
[
... | [
[
6.218389548107158,
0,
-2.4701897634973573
],
[
-5.263579269210877e-16,
8.59607729,
5.263579269210877e-16
],
[
0,
0,
9.06209853
]
] | [
59,
59,
59,
59,
12,
12,
12,
12,
12,
12,
81,
81,
81,
81,
81,
81,
81,
81
] | [
1,
1,
1
] | alex<agm003335950> | Cmce | Mg-Pr-Tl | 0.073049 | null | null | 0.000074 | 5,309.429774 | 34.417603 |
[
[
-0.4159649390048787,
-1.3279747864372753,
-1.4881966794555268
],
[
1.1957557727262356,
-5.956621622458808,
-4.789423104639034
],
[
2.1432812880099577,
-6.704485169956829,
-1.3994635351592808
],
[
0.212438368459365,
-5.091204648715365,
0.76004019783768
... | [
[
4.701576001622663,
0,
-1.3141346179082092
],
[
0.7797908337213573,
-7.284596408896084,
2.789855635905439
],
[
-4.701576001622663,
0,
-7.75334080209179
]
] | [
59,
59,
12,
12,
12,
12,
12,
12,
81,
81,
81,
81
] | [
1,
1,
1
] | alex<agm003426867> | C2/m | Mg-Pr-Tl | 0.075373 | null | null | 0.000001 | 5,027.799813 | 38.268337 |
[
[
0,
0,
3.892442659555684
],
[
0,
0,
8.549386050444316
],
[
0,
0,
0
],
[
-1.5491034301110798e-16,
2.52987789,
6.220914355
],
[
2.52987789,
0,
6.220914355
],
[
2.52987789,
2.52987789,
3.9127459821543855
],
[
2.5298778... | [
[
5.05975578,
0,
3.0982068602221597e-16
],
[
-3.0982068602221597e-16,
5.05975578,
3.0982068602221597e-16
],
[
0,
0,
12.44182871
]
] | [
59,
59,
12,
81,
81,
81,
81,
81,
81,
81,
81
] | [
1,
1,
1
] | alex<agm003534519> | P4/mmm | Mg-Pr-Tl | 0.031357 | null | null | -0 | 5,931.274684 | 33.058041 |
[
[
-4.204222075585485,
0.8416250818131698,
-6.2479019057858345
],
[
-0.45667317170397503,
-0.8416250818131698,
-1.6773626907056576
],
[
-4.218390462389456,
-3.4793811955021168,
-6.299942544822481
],
[
-3.251011566571478,
0.9256931943826529,
-2.7467555415819... | [
[
-4.66089524728946,
0,
1.2689598635085069
],
[
-0.8850095698000086,
6.9587623910042335,
-3.2506441033380216
],
[
0.8850095698000086,
-6.9587623910042335,
-5.943580356661977
]
] | [
59,
59,
59,
12,
12,
12,
12,
81,
81,
81,
81
] | [
1,
1,
1
] | alex<agm003381690> | Immm | Mg-Pr-Tl | 0.02728 | null | null | 0.000057 | 4,989.260515 | 35.829163 |
[
[
2.9406764299292885,
3.5422274559151807,
7.992279032163667
],
[
0,
0,
0
],
[
3.899754974580621,
2.2557909602294153,
4.572986802379394
],
[
3.6550921222919275,
5.703596468653814,
5.445255172583047
],
[
3.185339282217982,
0.09442194749078214,
... | [
[
4.804444774879094,
0,
1.347600495899915
],
[
2.0359866296308153,
5.798018416144596,
1.979498398643148
],
[
0,
0,
9.23816694
]
] | [
59,
59,
59,
12,
12,
81,
81,
81,
81
] | [
1,
1,
1
] | alex<agm003340047> | C2/m | Mg-Pr-Tl | 0.070566 | null | null | 0.000002 | 5,158.574414 | 35.953785 |
[
[
1.9592220649999998,
1.959222065,
1.926187406669036
],
[
1.9592220649999998,
1.959222065,
5.899248637914086
],
[
1.9592220649999998,
1.959222065,
9.88962185
],
[
1.9592220649999998,
1.959222065,
13.879995062085912
],
[
1.9592220649999998,
1.95... | [
[
3.91844413,
0,
2.399355030721118e-16
],
[
-2.399355030721118e-16,
3.91844413,
2.399355030721118e-16
],
[
0,
0,
19.7792437
]
] | [
59,
59,
59,
59,
59,
12,
81,
81,
81,
81
] | [
1,
1,
1
] | alex<agm003648054> | P4/mmm | Mg-Pr-Tl | 0.028195 | null | null | 0.000231 | 4,856.635572 | 38.787067 |
[
[
0,
0,
0
],
[
3.136496250174517,
1.0797789678521876,
2.113090177086501
],
[
1.211096976401118,
-1.0797789678521885,
3.582736795
],
[
2.8556598229585646,
-1.6733758370072336,
1.2823036906400835
],
[
1.4919334036170695,
1.6733758370072336,
4... | [
[
0.49679467902883667,
-4.3191158714087505,
1.469646617913499
],
[
4.3475932265756345,
0,
-1.469646617913499
],
[
-0.49679467902883667,
4.3191158714087505,
5.695826972086501
]
] | [
59,
12,
12,
81,
81
] | [
1,
1,
1
] | alex<agm003398373> | I4/mmm | Mg-Pr-Tl | 0.085074 | null | null | 0 | 5,211.739428 | 41.990131 |
[
[
0,
0,
-3.3625345425000015
],
[
0,
0,
-10.0876036275
],
[
-2.62539531,
1.5157726889576821,
-5.2564981292275474
],
[
-2.6253953100000005,
-1.5157726889576817,
-8.193640040772456
],
[
-2.6253953100000005,
-1.5157726889576817,
-11.98156721422... | [
[
-2.6253953100000005,
-4.547318066873044,
-6.430363925775947e-16
],
[
-2.6253953099999996,
4.547318066873044,
3.2151819628879734e-16
],
[
0,
0,
-13.45013817
]
] | [
59,
59,
12,
12,
12,
12,
81,
81,
81,
81,
81,
81
] | [
1,
1,
1
] | alex<agm003435541> | P6_3/mmc | Mg-Pr-Tl | 0.085026 | null | null | 0.000177 | 5,539.769317 | 33.727955 |
[
[
-2.4762597598997486e-16,
4.0440390839608895,
3.936858890724837
],
[
2.124966595,
1.1058372698327634,
2.6600408514587968
],
[
-1.7210785707087014e-16,
2.810734608389918,
0.9702014621506277
],
[
2.124966595,
2.2990796911099665,
-0.2605609826892642
]
] | [
[
4.24993319,
0,
2.6023335388618e-16
],
[
-2.5137733016347036e-16,
4.105303346866853,
-1.706664561646313
],
[
0,
0,
5.79089177
]
] | [
57,
57,
14,
77
] | [
1,
1,
1
] | alex<agm003192472> | Amm2 | Ir-La-Si | 0.02404 | null | null | -0.000002 | 5,296.934196 | 82.460564 |
[
[
2.305899795,
0,
1.4119564015506442e-16
],
[
-2.6973177630503027e-16,
4.4050542,
4.4050542
],
[
-1.8662693590288863e-16,
3.0478491599835245,
0.8442196511194323
],
[
-3.5283661670717196e-16,
5.762259240016477,
7.965888748880569
],
[
2.3058997949999... | [
[
4.61179959,
0,
2.8239128031012884e-16
],
[
-5.394635526100605e-16,
8.8101084,
5.394635526100605e-16
],
[
0,
0,
8.8101084
]
] | [
59,
59,
12,
12,
12,
12,
12,
12,
12,
12,
81,
81,
81,
81
] | [
1,
1,
1
] | alex<agm003457034> | P4_2/mnm | Mg-Pr-Tl | 0.080667 | null | null | 0.000085 | 4,857.682094 | 38.029224 |
[
[
-3.2628758321196236,
-1.1081916530451617,
-1.466521908208086
],
[
-1.3945067037213497,
-2.348694783891834,
-4.73431128724289
],
[
-0.48099509734622314,
3.577184726814139,
-1.6329649142082623
],
[
-3.815296460288509,
2.3486947838918337,
-3.341974599558342... | [
[
-5.209803164009859,
0,
1.5345643731987684
],
[
-0.9619901946924464,
7.154369453628279,
-3.2659298284165246
],
[
0.9619901946924464,
-7.154369453628279,
-6.344920431583475
]
] | [
59,
59,
59,
59,
59,
12,
81,
81,
81,
81,
81,
81
] | [
1,
1,
1
] | alex<agm003677732> | Immm | Mg-Pr-Tl | 0.050725 | null | null | 0.000184 | 5,200.217843 | 37.384335 |
[
[
0,
0,
4.017145351922307
],
[
0,
0,
8.504544711103014
],
[
0,
0,
12.966927228896987
],
[
0,
0,
17.45432658807769
],
[
0,
0,
0
],
[
1.8387583799999998,
1.83875838,
1.7850357581704466
],
[
1.8387583799999998,
1.83... | [
[
3.67751676,
0,
2.2518295644723727e-16
],
[
-2.2518295644723727e-16,
3.67751676,
2.2518295644723727e-16
],
[
0,
0,
21.47147194
]
] | [
59,
59,
59,
59,
12,
81,
81,
81,
81,
81
] | [
1,
1,
1
] | alex<agm003648056> | P4/mmm | Mg-Pr-Tl | 0.048191 | null | null | 0.000155 | 5,219.028885 | 37.606159 |
[
[
1.1737297318952993,
4.844046141697924,
8.574800238280442
],
[
3.2723054218952994,
5.3880208883020755,
5.069828571719559
],
[
3.0234216481047005,
1.4333571316979243,
11.89214297671956
],
[
0.9248459581047006,
1.9773318783020757,
1.752485833280442
],
[... | [
[
4.19715138,
0,
2.570014001526948e-16
],
[
-4.176889378983555e-16,
6.82137802,
4.176889378983555e-16
],
[
0,
0,
13.64462881
]
] | [
71,
71,
71,
71,
47,
47,
47,
47,
34,
34,
34,
34,
34,
34,
34,
34
] | [
1,
1,
1
] | mp-1189356 | P2_12_12_1 | Ag-Lu-Se | 0.005984 | 1.3047 | null | null | 2,253.997639 | 49.777458 |
[
[
0,
0,
0
],
[
0,
0,
-3.34809748
],
[
-2.020091075,
1.1663001259388106,
-5.090192283564023
],
[
-2.0200910750000003,
-1.1663001259388108,
-1.6060026764359765
]
] | [
[
-2.0200910750000003,
-3.4989003778164314,
-4.947796137969772e-16
],
[
-2.0200910749999994,
3.4989003778164314,
2.473898068984886e-16
],
[
0,
0,
-6.69619496
]
] | [
71,
47,
34,
34
] | [
1,
1,
1
] | alex<agm002185033> | P-3m1 | Ag-Lu-Se | 0.013033 | null | null | -0 | 2,253.997639 | 57.594036 |
[
[
0.05369324606610748,
0.12184093419395563,
0.1069569556113981
],
[
0.6562458977188323,
3.8786461667756815,
1.5776791984800018
],
[
2.1107541000128744,
2.0086017469745605,
5.142659116964047
],
[
3.3024450489647306,
1.6614691180226087,
0.7953446069099038
... | [
[
5.075492980070168,
0,
-2.0739978110634265
],
[
-0.8891331833582463,
5.18487284069003,
-2.1757250876318133
],
[
0,
0,
7.24526398
]
] | [
71,
71,
47,
47,
34,
34,
34,
34
] | [
1,
1,
1
] | alex<agm002185034> | Cm | Ag-Lu-Se | 0.032034 | null | null | -0.000018 | 2,253.997639 | 46.92738 |
[
[
2.700186412602143,
2.573804084214,
5.957517304869063
],
[
5.4755005797078375,
0.27449641578600004,
1.9898476578924174
],
[
2.8504419216092454,
3.122796915786,
1.9832593011776471
],
[
0.07512775450355082,
5.422104584214001,
5.950928948154293
],
[
... | [
[
5.550628334211389,
0,
0.002718656046709479
],
[
-3.488162090334806e-16,
5.696601,
3.488162090334806e-16
],
[
0,
0,
7.93805795
]
] | [
20,
20,
20,
20,
21,
21,
51,
51,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | mp-1189528 | P2_1/c | Ca-O-Sb-Sc | 0 | 3.6318 | null | -0 | 2,288.10239 | 133.674728 |
[
[
-4.820329384601593,
-3.4155090304038267,
-8.303581603146416
],
[
-1.6914880872556233,
-1.19852656859871,
-2.9137862255108087
],
[
0,
0,
0
],
[
-3.255908735928608,
-2.3070177995012684,
-5.608683914328613
],
[
-2.018175109805577,
-3.38999927336... | [
[
-1.6212403349122306,
-4.614035599002537,
-2.7927762493286123
],
[
-4.890577136944986,
0,
-2.7927762493286123
],
[
0,
0,
-5.63181533
]
] | [
20,
20,
21,
51,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm002364784> | R-3 | Ca-O-Sb-Sc | 0.023063 | null | null | -0 | 2,288.10239 | 137.846878 |
[
[
-1.6111405675554193,
-1.1485964290730073,
-2.915472104413459
],
[
-4.860616283826035,
-3.4651765458104014,
-8.290247867728402
],
[
0,
0,
0
],
[
-3.235878425690727,
-2.3068864874417043,
-5.60285998607093
],
[
-2.053440145505943,
-3.17058428082... | [
[
-1.5912785471260198,
-4.613772974883409,
-2.7904073260709303
],
[
-4.880478304255434,
0,
-2.7904073260709303
],
[
0,
0,
-5.62490532
]
] | [
20,
20,
21,
51,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm002364785> | C2/m | Ca-O-Sb-Sc | 0.0214 | null | null | 0 | 2,288.10239 | 131.769501 |
[
[
3.2957936625,
1.2427815007811316,
3.2777692792630053
],
[
1.0985978874999998,
4.275851871919742,
3.9215590070071698
],
[
1.0985978875,
1.5895657443752735,
0.26215156805184403
],
[
3.2957936624999995,
3.9290676283256,
6.93717671821833
],
[
1.09859... | [
[
4.39439155,
0,
2.690788772953838e-16
],
[
-3.3791883477729435e-16,
5.518633372700873,
-1.1752071337298267
],
[
0,
0,
8.37453542
]
] | [
57,
57,
57,
57,
14,
14,
77,
77
] | [
1,
1,
1
] | alex<agm003629020> | P2_1/m | Ir-La-Si | 0.024278 | null | null | 0.00033 | 5,296.934196 | 80.361053 |
[
[
1.2905798059630977,
1.3321178016413542,
7.252298386240926
],
[
3.0536163554668128,
-1.3321178016413542,
4.567078897338259
],
[
1.8284931791161627,
-0.354664007631362,
10.27505477612368
],
[
3.931805613878555,
1.8163446536034293,
9.501985129702863
],
... | [
[
0.13757129190512712,
-4.342017322469583,
0.7730696464208162
],
[
4.3441961614299105,
0,
-0.7730696464208162
],
[
-0.13757129190512712,
4.342017322469583,
11.819377283579183
]
] | [
20,
20,
21,
21,
21,
21,
51,
51,
51,
8,
8
] | [
1,
1,
1
] | alex<agm004489527> | I4/mmm | Ca-O-Sb-Sc | 0.076767 | null | null | 0.000103 | 3,328.054318 | 69.443756 |
[
[
-1.1102230246251565e-16,
3.4112714677081373,
5.312740791740822e-16
],
[
2.220446049250313e-16,
10.233814403124413,
6.661338147750939e-16
],
[
0,
0,
0
],
[
5.791120453231432e-16,
6.8225429354162745,
4.440892098500626e-16
],
[
1.5745569240422352,
... | [
[
1.608088791523074,
4.548361956944183,
2.7852914900000005
],
[
1.608088791523074,
4.548361956944183,
-2.7852914899999996
],
[
-3.2161775830461474,
4.548361956944183,
0
]
] | [
38,
38,
41,
13,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | mp-1206057 | Fm-3m | Al-Nb-O-Sr | 0 | 2.8384 | null | 0.000002 | 3,626.151111 | 171.518463 |
[
[
1.6066642115911849,
-1.1371775702756581,
2.7864047
],
[
3.216425376380354,
1.1371775702756588,
0.0053709807566838285
],
[
3.2133284231823698,
-2.2743551405513163,
1.878578692878549e-16
],
[
0,
0,
0
],
[
2.300440160444946,
-3.3714271871495205,... | [
[
1.6035672583932008,
-4.5487102811026325,
2.7810337192433163
],
[
4.823089587971539,
0,
-2.7810337192433163
],
[
-1.6035672583932008,
4.5487102811026325,
2.7917756807566834
]
] | [
38,
38,
41,
13,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm002229617> | I4/m | Al-Nb-O-Sr | 0.000308 | null | null | -0 | 3,626.151111 | 162.07547 |
[
[
2.6778145,
0,
1.6396884780676852e-16
],
[
4.023935782263,
3.658346,
1.3223164783920005
],
[
4.023935782263,
3.658346,
5.994375521608
],
[
4.023935782263,
5.994375521607999,
3.6583460000000003
],
[
4.023935782263,
1.3223164783919998,
3.658... | [
[
5.355629,
0,
3.2793769561353704e-16
],
[
-4.480181719073523e-16,
7.316692,
4.480181719073523e-16
],
[
0,
0,
7.316692
]
] | [
28,
28,
28,
28,
28,
28,
28,
28,
28,
83,
52,
16,
16,
16,
16,
16,
16,
16,
16
] | [
1,
1,
1
] | mp-1189904 | P4/mmm | Bi-Ni-S-Te | 0.053655 | 0 | null | -0.000336 | 2,611.16226 | 91.210587 |
[
[
0.6812768214672889,
-4.200862029815435,
-0.44326008780960335
],
[
-4.164535230869941,
-0.8763710469068858,
-4.049992262809603
],
[
-1.7416292047013264,
-2.5386165383611607,
-5.853358350309604
],
[
-1.7416292047013264,
-2.5386165383611607,
-2.246626175309... | [
[
1.9586842210522275,
-5.0772330767223215,
1.3601059996903966
],
[
-5.44194263045488,
0,
1.3601059996903966
],
[
0,
0,
-7.21346435
]
] | [
20,
20,
22,
22,
32,
32,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | mp-1205333 | C2/c | Ca-Ge-O-Ti | 0.002113 | 2.7005 | null | 0.000069 | 1,308.155639 | 113.361664 |
[
[
1.8414897403607706,
3.8221874382205154,
0.4529668047547573
],
[
2.154565748699626,
1.681230713582604,
3.1282248823510446
],
[
-0.23637712802871014,
4.108073337035929,
3.3986159241848517
],
[
4.269371809678518,
1.1427377459706656,
0.49822394650117524
],... | [
[
4.800830367206297,
0,
-0.5618242294692447
],
[
-0.7796282647259067,
5.331454124955255,
-1.152043317269968
],
[
0,
0,
5.50993894
]
] | [
20,
22,
32,
32,
8,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm002230591> | C2 | Ca-Ge-O-Ti | 0.042763 | null | null | 0.000019 | 1,357.780586 | 84.47686 |
[
[
-0.8418984723547053,
-1.4309337255275234,
-3.075132937374469
],
[
-6.658778894076144,
-4.914128122725335,
-3.036604039579305
],
[
-7.47577581309518,
-3.549755985852413,
-6.931260574579307
],
[
-1.6588953913737419,
-0.06656158865460124,
-6.969789472374469... | [
[
-2.667598777906947,
-4.980689711379936,
-1.1085402209768873
],
[
-5.6500755075429385,
0,
-1.1085402209768873
],
[
0,
0,
-7.78931307
]
] | [
57,
57,
57,
57,
14,
14,
77,
77,
77,
77
] | [
1,
1,
1
] | alex<agm002241912> | C2/c | Ir-La-Si | 0.029622 | null | null | 0.000064 | 6,355.867509 | 110.076622 |
[
[
0,
10.297881609554794,
8.662768696821032e-16
],
[
-4.440892098500626e-16,
3.4326272031849303,
1.1555406770336062e-15
],
[
-2.220446049250313e-16,
6.865254406369862,
1.0664199245891124e-15
],
[
0,
0,
0
],
[
-0.841663348063796,
8.05554612815402... | [
[
1.6181559817716524,
4.576836270913242,
2.8027283750000005
],
[
1.6181559817716524,
4.576836270913242,
-2.8027283749999996
],
[
-3.2363119635433044,
4.576836270913242,
0
]
] | [
38,
38,
3,
76,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | mp-1205568 | Fm-3m | Li-O-Os-Sr | 0 | 0 | null | null | 4,982.763722 | 137.650253 |
[
[
0,
0,
0
],
[
0.979497165560638,
-0.9410357404538343,
4.895233895
],
[
2.7876662873255427,
0.9410357404538344,
4.14145460604253
],
[
1.39698470092305,
1.4540813872019263,
6.981711738690465
],
[
2.3701787519631314,
-1.4540813872019267,
2.05... | [
[
0.15082520935637125,
-3.7641429618153377,
0.7537792889574693
],
[
3.767163452886181,
0,
-0.7537792889574693
],
[
-0.15082520935637125,
3.7641429618153377,
9.03668850104253
]
] | [
38,
3,
3,
76,
76,
8,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm004588500> | I4/mmm | Li-O-Os-Sr | 0.036418 | null | null | 0.000281 | 6,464.008554 | 145.330841 |
[
[
-6.1357381750709346,
-3.26836306958687,
-0.4503652149489656
],
[
-1.8706141426358147,
-6.468469917566331,
0.48549642624528977
],
[
-3.8513798524326996,
-4.343514099597973,
2.05204532103758
],
[
-4.154972465274049,
-5.393318887555227,
-2.0169141097412564
... | [
[
-5.190561609491721,
0,
-0.7604766387284546
],
[
-1.407895354107514,
-4.868416493576601,
-2.672747109987611
],
[
-1.407895354107514,
-4.868416493576601,
3.468354960012389
]
] | [
38,
38,
3,
3,
3,
76,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm004625098> | C2/m | Li-O-Os-Sr | 0.050821 | null | null | 0.019345 | 4,960.233005 | 91.024551 |
[
[
-3.1185626403426205,
-2.297610831677826,
-4.88637218982071
],
[
-4.824611781520948,
-3.554547901159082,
-7.559523907243135
],
[
0,
0,
0
],
[
-7.035279903570318,
-2.926079366418454,
-4.267649270297883
],
[
0,
0,
-3.377848535
],
[
-... | [
[
-1.8157890365865001,
-5.852158732836908,
-2.845099513531922
],
[
-6.127385385277068,
0,
-2.845099513531922
],
[
0,
0,
-6.75569707
]
] | [
38,
38,
3,
76,
76,
76,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm004493283> | R-3m | Li-O-Os-Sr | 0.076874 | null | null | 0.004128 | 6,185.174625 | 114.877007 |
[
[
1.8809980259688512,
3.410027081923722,
-0.25730770241399725
],
[
2.2320695049249903,
1.7373127380182094,
2.6892853516086914
],
[
-0.11891538406751434,
0.5665839595748394,
5.060982191035675
],
[
-0.9614150440542397,
4.580755860367092,
-2.010237759712619
... | [
[
5.193397959015596,
0,
-0.6187667821283616
],
[
-1.080330428121754,
5.147339819941932,
-3.008311558676944
],
[
0,
0,
6.05905599
]
] | [
38,
38,
3,
3,
76,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm004571836> | C2/m | Li-O-Os-Sr | 0.074386 | null | null | 0.012348 | 4,971.333868 | 87.466736 |
[
[
-2.805837325,
-1.6199509348910495,
-4.435559313091714
],
[
0,
0,
0
],
[
-2.8058373250000006,
1.619950934891049,
-2.4619083869082874
],
[
0,
0,
-3.44873385
],
[
-2.805837325,
-1.6199509348910495,
-1.1314262521188554
],
[
-2.8058373... | [
[
-2.8058373250000006,
-4.859852804673149,
-6.872319397978844e-16
],
[
-2.8058373249999997,
4.859852804673149,
3.436159698989422e-16
],
[
0,
0,
-6.8974677
]
] | [
38,
38,
38,
3,
76,
76,
8,
8,
8,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm004673350> | P-3m1 | Li-O-Os-Sr | 0 | null | null | 0.001626 | 5,479.238044 | 146.510666 |
[
[
9.873956231934152e-11,
5.061960432081431,
5.35679625
],
[
1.8885960000100195,
0.5136595681404401,
1.7855987500000001
],
[
1.8885960000505357,
2.590778740543095,
5.35679625
],
[
5.822292279270829e-11,
2.984841259678776,
1.7855987500000001
],
[
3.5... | [
[
3.777192,
0,
2.312863046282495e-16
],
[
-1.8885959998912407,
5.575620000221871,
3.6046211758253305e-16
],
[
0,
0,
7.142395
]
] | [
68,
68,
14,
14,
44,
44,
44,
44,
6,
6
] | [
1,
1,
1
] | mp-1205505 | Cmcm | C-Er-Ru-Si | 0 | 0 | null | 0.000002 | 5,298.508383 | 167.07605 |
[
[
2.0950265745846948,
1.5597123251962812,
5.974307613334094
],
[
3.1792081890569386,
3.7194241696333106,
3.0446722782886115
],
[
4.25209974135494,
3.6762151765022395,
5.963249846938705
],
[
1.0221350222866932,
1.6029213183273523,
3.0557300446840006
],
... | [
[
3.7872766117978185,
0,
1.401572222225203
],
[
1.4869581518438146,
5.279136494829592,
1.7997021793975028
],
[
0,
0,
5.81770549
]
] | [
68,
68,
14,
14,
44,
44,
6
] | [
1,
1,
1
] | alex<agm002258902> | C2/m | C-Er-Ru-Si | 0 | null | null | -0.000012 | 4,490.945535 | 138.331223 |
[
[
-1.8796320330988155e-16,
3.069672062847,
7.810141562846999
],
[
-3.9257687665318383e-16,
6.411266937153,
1.6707974371530003
],
[
-1.0230683667165112e-16,
1.6707974371529999,
3.069672062847
],
[
-4.782332432914142e-16,
7.810141562846999,
6.411266937153
... | [
[
2.929644,
0,
1.7938895736206243e-16
],
[
-5.805400799630654e-16,
9.480939,
5.805400799630654e-16
],
[
0,
0,
9.480939
]
] | [
12,
12,
12,
12,
25,
25,
5,
5,
5,
5,
77,
77,
77,
77,
77,
77,
77,
77,
77,
77
] | [
1,
1,
1
] | mp-1189623 | P4/mbm | B-Ir-Mg-Mn | 0 | 0 | null | 0.021124 | 8,204.621025 | 203.678604 |
[
[
4.440892098500626e-16,
3.454846402167232,
-4.04314420832108e-16
],
[
6.661338147750939e-16,
10.364539206501695,
2.419319994340086e-16
],
[
6.661338147750939e-16,
6.909692804334464,
-1.8226981590707668e-16
],
[
0,
0,
0
],
[
1.6304933655835019,
... | [
[
1.6286302126202636,
4.606461869556308,
2.8208702750000003
],
[
1.6286302126202636,
4.606461869556308,
-2.8208702749999994
],
[
-3.257260425240527,
4.606461869556308,
0
]
] | [
38,
38,
24,
42,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | mp-1205606 | Fm-3m | Cr-Mo-O-Sr | 0.059905 | 0 | null | 0.031465 | 3,090.336818 | 154.583099 |
[
[
0.914033095,
0.8004603708147482,
3.9714265923367824
],
[
2.7420992849999997,
4.9718837691852515,
3.0546734276632184
],
[
0.9140330949999997,
3.6866324408147486,
6.5677234376632185
],
[
2.742099285,
2.085711699185252,
0.4583765823367827
],
[
2.742... | [
[
3.65613238,
0,
2.2387354082129973e-16
],
[
-3.534541387313991e-16,
5.77234414,
3.534541387313991e-16
],
[
0,
0,
7.02610002
]
] | [
28,
28,
28,
28,
42,
42,
42,
42,
15,
15,
15,
15
] | [
1,
1,
1
] | alex<agm002178720> | Pnma | Mo-Ni-P | 0.033712 | null | null | 0.00027 | 4,064.973992 | 239.855698 |
[
[
0,
0,
0
],
[
3.7666742825526134,
4.18766320687792,
7.409331060246322
],
[
1.228938792160281,
1.4566961499135571,
2.5505784006195076
],
[
0.6311889761322459,
2.8221796783957385,
4.365014042381823
],
[
3.109409043494303,
3.1141133948833444,
... | [
[
3.733235122448403,
0,
1.2298813761021843
],
[
1.2623779522644918,
5.644359356791477,
2.449075724763645
],
[
0,
0,
6.28095236
]
] | [
57,
14,
14,
77,
77,
77,
77,
77
] | [
1,
1,
1
] | alex<agm003475343> | Immm | Ir-La-Si | 0.01753 | null | null | -0.000007 | 7,985.607285 | 194.396057 |
[
[
5.552664508661108,
5.620950143855625,
2.0083185141555724
],
[
2.876595691338892,
2.8023481686667306,
6.00943092492515
],
[
0.066842291338892,
0.01625380652216378,
6.005899824305275
],
[
2.742911108661108,
2.834855781711058,
2.0047874135356976
],
[
... | [
[
5.6195068,
0,
3.4409555077033926e-16
],
[
-3.451791886985487e-16,
5.637203950377788,
0.00599675846084608
],
[
0,
0,
8.00822158
]
] | [
38,
38,
38,
38,
24,
24,
42,
42,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm004923882> | P2_1/c | Cr-Mo-O-Sr | 0 | null | null | 0.031566 | 3,090.336818 | 141.399567 |
[
[
-2.8020855000000005,
-1.6177848177173475,
-4.790936636507156
],
[
0,
0,
0
],
[
-2.8020855000000005,
1.6177848177173468,
-2.1043994934928447
],
[
-2.8020855000000005,
-1.6177848177173475,
-1.1226995250802976
],
[
-2.8020855000000005,
1.6177848... | [
[
-2.8020855000000005,
-4.853354453152042,
-6.863130077024422e-16
],
[
-2.8020854999999996,
4.853354453152042,
3.431565038512211e-16
],
[
0,
0,
-6.89533613
]
] | [
38,
38,
38,
24,
24,
42,
8,
8,
8,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm004673958> | P-3m1 | Cr-Mo-O-Sr | 0.018109 | null | null | 0.031992 | 2,958.909653 | 146.915802 |
[
[
5.142776157317509,
0.0027573929215249666,
5.3038094533782365
],
[
0.011472080858484007,
3.0612482610335405,
2.7133349169609042
],
[
2.619257123126248,
1.5169613909435868,
2.5856681719565375
],
[
-1.523135170551696,
2.7861781410104594,
1.5875876740764727
... | [
[
5.145054265484838,
0,
-0.06930046908644238
],
[
-2.509195262452132,
4.526326632946973,
-0.024987078038949537
],
[
0,
0,
5.40219702
]
] | [
38,
24,
42,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm005094438> | P3 | Cr-Mo-O-Sr | 0.087706 | null | null | 0.015897 | 3,114.210299 | 83.903801 |
[
[
6.186129821872,
4.22700513136,
3.7833670000000006
],
[
3.084121821872,
2.23077586864,
3.2544362222405903e-16
],
[
0.04198257627199993,
1.1450420646719999,
5.693051760186
],
[
0.04198257627199993,
1.1450420646719999,
1.8736822398140003
],
[
3.1439... | [
[
6.204016,
0,
3.798864168129483e-16
],
[
-3.9542504156222967e-16,
6.457781,
3.9542504156222967e-16
],
[
0,
0,
7.566734
]
] | [
12,
12,
29,
29,
29,
29,
14,
14,
16,
16,
16,
16,
16,
16,
16,
16
] | [
1,
1,
1
] | mp-1205334 | Pmn2_1 | Cu-Mg-S-Si | 0.001209 | 1.6731 | null | 0.000014 | 1,167.001633 | 59.810081 |
[
[
2.996369538370837,
-2.4044592744960025,
6.804200721337576e-17
],
[
3.4276612001376816,
1.2022296372480012,
0.9267253013577772
],
[
1.4981847691854187,
-1.2022296372480015,
3.21918056
],
[
0,
0,
0
],
[
5.130091984766775,
-3.121906353203556,
... | [
[
1.0668931074185741,
-4.808918548992005,
2.2924552586422227
],
[
4.9258459693231,
0,
-2.2924552586422227
],
[
-1.0668931074185741,
4.808918548992005,
4.145905861357777
]
] | [
12,
29,
29,
14,
16,
16,
16,
16
] | [
1,
1,
1
] | alex<agm002221229> | I-42m | Cu-Mg-S-Si | 0.013869 | null | null | -0 | 1,167.001633 | 64.138672 |
[
[
2.7685161753840977e-33,
1.6359003539934447e-16,
2.7816417479443993
],
[
4.15129,
-3.5607016324999745,
2.0557720460278
],
[
4.15129,
3.5607016324999754,
2.0557720460278017
],
[
2.075645,
2.867947879500125e-16,
5.32783984033776
],
[
2.0756449999999... | [
[
4.15129,
0,
2.541932005416208e-16
],
[
-3.6553711089165747e-16,
5.969674050447176,
3.4465929200000014
],
[
3.6553711089165747e-16,
-5.969674050447176,
3.4465929199999987
]
] | [
68,
68,
68,
13,
13,
13,
27,
32,
32
] | [
1,
1,
1
] | mp-1205920 | P-62m | Al-Co-Er-Ge | 0 | 0 | null | 0.000002 | 2,632.498796 | 81.442482 |
[
[
-6.929936142698764e-10,
5.032669397872559,
5.387085750000001
],
[
1.9663269999273056,
0.5279226047267814,
1.7956952500000003
],
[
1.9663269996455708,
2.573942432083209,
5.387085750000001
],
[
-4.1125870223495003e-10,
2.986649570516132,
1.7956952500000003... | [
[
3.932654,
0,
2.4080560666270177e-16
],
[
-1.966327000765688,
5.560592002599341,
3.6114948978725206e-16
],
[
0,
0,
7.182781
]
] | [
62,
62,
14,
14,
76,
76,
76,
76,
6,
6
] | [
1,
1,
1
] | mp-1205528 | Cmcm | C-Os-Si-Sm | 0 | 0 | null | 0.000001 | 6,940.410607 | 184.084015 |
[
[
2.145785584484759,
1.6209874440920538,
6.063882435119137
],
[
3.253817280331999,
3.7914109377320493,
3.0881602036819458
],
[
4.3449474289452645,
3.83410539751544,
6.071123334633279
],
[
1.054655435871494,
1.578292984308662,
3.0809193041678036
],
[
... | [
[
3.867489083338682,
0,
1.4400875909771158
],
[
1.5321137814780759,
5.412398381824103,
1.7986605378239664
],
[
0,
0,
5.91329451
]
] | [
62,
62,
14,
14,
76,
76,
6
] | [
1,
1,
1
] | alex<agm002330686> | C2/m | C-Os-Si-Sm | 0 | null | null | 0.000054 | 5,947.187253 | 137.791107 |
[
[
-3.100703432765861,
-1.8389583815821355,
-6.24310871163947
],
[
-5.68803580098241,
-3.3734477797592435,
-4.234228804808521
],
[
-4.290610777903492,
-2.5446660163478065,
-11.147952031189243
],
[
-0.5133710645493121,
-0.3044689834050284,
-8.251988618470422... | [
[
-2.0100580348683224,
-3.677916763164271,
-0.8471695416394706
],
[
-4.1913488306634,
0,
-0.8471695416394706
],
[
0,
0,
-10.79187834
]
] | [
60,
13,
13,
13,
13,
32,
32,
79
] | [
1,
1,
1
] | mp-12018 | R-3m | Al-Au-Ge-Nd | 0 | 0 | null | -0.000002 | 1,729.558308 | 79.234833 |
[
[
0,
0,
0
],
[
3.70808498,
1.632120182414212,
2.82691508
],
[
9.9938537860868e-17,
-1.6321201824142129,
2.82691508
],
[
1.8540424899999999,
2.4481802736213187,
1.4134575400000007
],
[
1.85404249,
-4.440892098500626e-16,
2.82691508
],
[
... | [
[
3.70808498,
0,
2.2705472008616885e-16
],
[
-2.998156135826039e-16,
4.8963605472426375,
2.826915080000001
],
[
2.998156135826039e-16,
-4.8963605472426375,
2.826915079999999
]
] | [
57,
14,
14,
77,
77,
77
] | [
1,
1,
1
] | alex<agm002186257> | P6/mmm | Ir-La-Si | 0 | null | null | 0.000155 | 7,430.475498 | 183.260834 |
[
[
4.35772555,
2.6048251315801,
5.773099889090328
],
[
9.079631218935627e-35,
-1.8187391573313313e-16,
3.0077929818193456
],
[
4.35772555,
-2.6048251315801,
5.773099889090327
],
[
2.1788627750000003,
-4.838704427026483,
4.483369076527225
],
[
2.1788... | [
[
4.35772555,
0,
2.6683373231850693e-16
],
[
-3.858901086459392e-16,
6.302063728327399,
3.6384981900000013
],
[
3.858901086459392e-16,
-6.302063728327399,
3.6384981899999986
]
] | [
60,
60,
60,
13,
13,
13,
32,
32,
79
] | [
1,
1,
1
] | alex<agm002248650> | P-62m | Al-Au-Ge-Nd | 0.058479 | null | null | 0.000014 | 2,214.459317 | 77.080711 |
[
[
2.228760905,
0,
2.612252332888811
],
[
-1.3647224541865042e-16,
2.228760905,
7.702243187111188
],
[
2.228760905,
2.228760905,
2.7294449083730084e-16
],
[
0,
0,
0
],
[
2.228760905,
0,
6.512179076468867
],
[
-1.3647224541865042e-16,... | [
[
4.45752181,
0,
2.7294449083730084e-16
],
[
-2.7294449083730084e-16,
4.45752181,
2.7294449083730084e-16
],
[
0,
0,
10.31449552
]
] | [
60,
60,
13,
13,
13,
13,
32,
79,
79,
79
] | [
1,
1,
1
] | alex<agm004511734> | P-4m2 | Al-Au-Ge-Nd | 0.005263 | null | null | 0.000151 | 1,633.23033 | 77.126389 |
[
[
2.230384725,
0,
2.6008130795573035
],
[
-1.3657167571691998e-16,
2.230384725,
7.8043962504426965
],
[
0,
0,
5.202604665
],
[
2.230384725,
0,
9.080138594181797
],
[
-1.3657167571691998e-16,
2.230384725,
1.325070735818204
],
[
2.230... | [
[
4.46076945,
0,
2.7314335143383997e-16
],
[
-2.7314335143383997e-16,
4.46076945,
2.7314335143383997e-16
],
[
0,
0,
10.40520933
]
] | [
60,
60,
13,
13,
13,
32,
79,
79,
79,
79
] | [
1,
1,
1
] | alex<agm004511733> | P-4m2 | Al-Au-Ge-Nd | 0.032919 | null | null | 0.000361 | 1,545.713765 | 86.849876 |
[
[
1.8495694999999996,
6.316047662120657,
4.030275672535851
],
[
1.8495695,
0.687208519315817,
1.5914296375396153
],
[
1.8495694999999999,
2.7819804887700066,
4.536525861454349
],
[
1.8495694999999999,
4.2212756926664685,
1.0851794486211184
],
[
-3.... | [
[
3.699139,
0,
2.2650693679755705e-16
],
[
-4.288257633102547e-16,
7.003256181436474,
-2.517412359924533
],
[
0,
0,
8.13911767
]
] | [
66,
66,
66,
66,
12,
12,
12,
27,
27
] | [
1,
1,
1
] | mp-1205839 | P2/m | Co-Dy-Mg | 0 | 0 | null | 0.000152 | 2,818.445771 | 52.310768 |
[
[
2.8605304875,
0.33459082784288774,
1.4675985546821082
],
[
0.9535101624999998,
3.4612252858369543,
6.424402457170708
],
[
0.9535101624999999,
2.6655714403900586,
2.9344671766570105
],
[
2.8605304875,
1.1302446732897837,
4.9575338351958065
],
[
2.... | [
[
3.81404065,
0,
2.3354263369201953e-16
],
[
-2.3242670268849823e-16,
3.7958161136798423,
-0.8653901481471827
],
[
0,
0,
8.75739116
]
] | [
66,
66,
12,
12,
27,
27
] | [
1,
1,
1
] | alex<agm001058377> | Cmcm | Co-Dy-Mg | 0.01152 | null | null | 0.000033 | 2,746.915784 | 61.750347 |
[
[
-1.569075719857592e-16,
2.5624951144281667,
5.712595655887798
],
[
9.21460998723565e-33,
2.2190626785143405e-16,
2.958914488224405
],
[
3.9122504899999995,
3.666005402333377,
2.1165692058877985
],
[
1.956125245,
3.4575813737896523e-16,
5.4414512699684385... | [
[
3.91225049,
0,
2.395562520020582e-16
],
[
-3.8138566106698295e-16,
6.228500516761543,
3.5960264500000014
],
[
3.8138566106698295e-16,
-6.228500516761543,
3.5960264499999988
]
] | [
66,
66,
66,
12,
12,
12,
27,
27,
27
] | [
1,
1,
1
] | alex<agm002220332> | P-62m | Co-Dy-Mg | 0.074381 | null | null | -0.000023 | 2,746.915784 | 79.9888 |
[
[
3.9676146876502294,
3.315902429282227,
6.902758489616852
],
[
1.1751544272067256,
1.3664310518618128,
2.650835649650818
],
[
0,
0,
0
],
[
2.323738842273265,
1.413528584121909,
5.364753377152939
],
[
2.81903027258369,
3.2688048970221306,
4... | [
[
3.8927560408254607,
0,
1.6396190351672872
],
[
1.2500130740314945,
4.68233348114404,
2.4731075041003834
],
[
0,
0,
5.4408676
]
] | [
66,
66,
12,
27,
27
] | [
1,
1,
1
] | alex<agm002285560> | Immm | Co-Dy-Mg | 0.007852 | null | null | 0.000024 | 2,863.813542 | 76.745163 |
[
[
3.5051175505436682,
1.4078182037243416,
0.7435262464098383
],
[
0.7995390364955667,
3.3686229604431284,
1.8019639694086211
],
[
-0.7995390332248834,
3.3686229604431284,
5.645653374408621
],
[
1.9060394808232184,
1.4078182037243416,
4.587215651409839
],... | [
[
5.41115703,
0,
3.313378068236599e-16
],
[
-2.705578512681215,
4.77644116416747,
-1.2981991891815412
],
[
0,
0,
7.68737881
]
] | [
66,
66,
66,
66,
12,
12,
27,
27,
27,
27
] | [
1,
1,
1
] | alex<agm003396356> | C2/c | Co-Dy-Mg | 0.025041 | null | null | -0.000197 | 2,863.813542 | 74.99765 |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.