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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|
[
[
-3.735247842197552,
-2.5594261008197448,
-2.894146360550026
],
[
-0.9907527946967026,
-2.5594261008197448,
-1.447073180275013
],
[
-2.744495047500849,
0,
-1.447073180275013
],
[
0,
0,
-3.326118535
],
[
-2.744495047500849,
0,
-4.7731917152... | [
[
-1.981505589393405,
-5.1188522016394895,
-2.8941463605500255
],
[
-5.488990095001698,
0,
-2.8941463605500255
],
[
0,
0,
-6.65223707
]
] | [
20,
20,
20,
73,
73,
73,
24,
7,
7,
7,
7,
7,
7,
7,
7
] | [
1,
1,
1
] | alex<agm004702235> | R-3m | Ca-Cr-N-Ta | 0.034789 | null | null | 0.014978 | 3,693.761691 | 191.359329 |
[
[
2.034902495,
0,
2.6443644949398104
],
[
-1.2460184135393564e-16,
2.034902495,
7.873543195060189
],
[
2.034902495,
2.034902495,
5.258953845
],
[
2.034902495,
2.034902495,
2.4920368270787127e-16
],
[
0,
0,
0
],
[
2.034902495,
0,... | [
[
4.06980499,
0,
2.4920368270787127e-16
],
[
-2.4920368270787127e-16,
4.06980499,
2.4920368270787127e-16
],
[
0,
0,
10.51790769
]
] | [
66,
66,
13,
14,
14,
14,
14,
78,
78,
78
] | [
1,
1,
1
] | alex<agm004515453> | P-4m2 | Al-Dy-Pt-Si | 0.002549 | null | null | 0.000231 | 6,166.889853 | 139.194977 |
[
[
2.220446049250313e-16,
5.704847416148962,
-5.171405981219122e-16
],
[
0,
0,
0
],
[
4.440892098500626e-16,
8.557271124223444,
7.449660832659084e-17
],
[
0,
2.8524237080744808,
4.806149039859874e-16
]
] | [
[
1.3446454311978286,
3.803231610765975,
2.3289942050000003
],
[
1.3446454311978286,
3.803231610765975,
-2.3289942049999994
],
[
-2.689290862395657,
3.803231610765975,
0
]
] | [
40,
21,
76,
46
] | [
1,
1,
1
] | alex<agm001388462> | F-43m | Os-Pd-Sc-Zr | 0.070323 | null | null | -0.000015 | 6,981.811839 | 157.852585 |
[
[
0.2620527818506456,
4.740517847992307,
0.31703560273287085
],
[
3.705960464697611,
1.051528669024928,
4.001471062455872
],
[
0.8004116280822842,
2.3122028090965525,
3.0792632788343735
],
[
3.167601618465973,
3.4798437079206823,
1.2392433863543693
],
... | [
[
5.252113303697078,
0,
-1.0236381609378589
],
[
-1.2841000571488208,
5.792046517017235,
-0.6231770838733982
],
[
0,
0,
5.96532191
]
] | [
66,
66,
29,
29,
1,
1,
1,
1,
1,
1,
1,
1,
1,
1,
1,
1,
77,
77,
77,
77
] | [
1,
1,
1
] | alex<agm004946286> | C2/c | Cu-Dy-H-Ir | 0.080436 | null | null | 0.000026 | 6,711.797929 | 100.815636 |
[
[
0,
0,
0
],
[
3.6976511310902715,
1.2887944150559465,
1.4809526404226991
],
[
1.5387064219011288,
-1.288794415055946,
3.6739933500000004
],
[
3.077412843802258,
-2.577588830111893,
6.543283774530334e-17
],
[
0.5997922331351067,
0.7160988208436... | [
[
0.9184681346131162,
-5.155177660223786,
2.193040709577301
],
[
5.2363575529914,
0,
-2.193040709577301
],
[
-0.9184681346131162,
5.155177660223786,
5.154945990422699
]
] | [
11,
31,
31,
29,
34,
34,
34,
34
] | [
1,
1,
1
] | alex<agm004774069> | I-42m | Cu-Ga-Na-Se | 0.068902 | null | null | 0.000001 | 1,793.684454 | 43.093235 |
[
[
1.7386424392651783,
4.870060481082608,
8.637323331666177
],
[
5.187561403855883e-10,
1.5296494899744966,
7.421308575896622
],
[
1.807529187840314e-8,
2.0312542272497134,
3.2369142566661773
],
[
1.738642456821714,
5.371665218357824,
2.020899500896623
],... | [
[
3.47728491,
0,
2.129222917377446e-16
],
[
-1.7386424526595294,
6.901314708332321,
4.3578769535378203e-16
],
[
0,
0,
10.80081815
]
] | [
57,
57,
57,
57,
40,
40,
42,
42,
7,
7,
7,
7,
7,
7,
7,
7,
7,
7
] | [
1,
1,
1
] | alex<agm005163362> | Cmc2_1 | La-Mo-N-Zr | 0.044413 | null | null | 0.001872 | 3,068.914322 | 142.062088 |
[
[
2.119978,
0,
2.408093169351466
],
[
-1.298112135981404e-16,
2.119978,
8.174822610648535
],
[
2.119978,
2.119978,
2.596224271962808e-16
],
[
0,
0,
0
],
[
2.119978,
0,
6.835147811406952
],
[
-1.298112135981404e-16,
2.119978,
... | [
[
4.239956,
0,
2.596224271962808e-16
],
[
-2.596224271962808e-16,
4.239956,
2.596224271962808e-16
],
[
0,
0,
10.58291578
]
] | [
20,
20,
29,
29,
29,
29,
51,
33,
33,
33
] | [
1,
1,
1
] | alex<agm004529401> | P-4m2 | As-Ca-Cu-Sb | 0.049418 | null | null | 0.000201 | 2,665.071245 | 74.871788 |
[
[
0,
0,
2.7735217
],
[
1.9903126199999999,
1.99031262,
4.142808586703924
],
[
1.9903126199999999,
1.99031262,
1.4042348132960762
],
[
1.99031262,
0,
1.2187149896927912e-16
],
[
-1.2187149896927912e-16,
1.99031262,
1.2187149896927912e-16
]... | [
[
3.98062524,
0,
2.4374299793855824e-16
],
[
-2.4374299793855824e-16,
3.98062524,
2.4374299793855824e-16
],
[
0,
0,
5.5470434
]
] | [
62,
13,
13,
26,
26,
5
] | [
1,
1,
1
] | alex<agm002200173> | P4/mmm | Al-B-Fe-Sm | 0.005514 | null | null | 0.000819 | 2,135.910803 | 133.685806 |
[
[
-2.072532385,
1.1965771303839676,
-4.130947847874839
],
[
-2.0725323850000006,
-1.1965771303839676,
-7.14710618212516
],
[
0,
0,
0
],
[
0,
0,
-8.957731328903424
],
[
0,
0,
-2.320322701096575
],
[
-2.072532385,
1.19657713038396... | [
[
-2.0725323850000006,
-3.589731391151902,
-5.07624030283896e-16
],
[
-2.0725323849999997,
3.589731391151902,
2.53812015141948e-16
],
[
0,
0,
-11.27805403
]
] | [
57,
57,
80,
16,
16,
8,
8
] | [
1,
1,
1
] | alex<agm004543916> | P-3m1 | Hg-La-O-S | 0.078888 | null | null | -0.000031 | 2,720.785723 | 72.949326 |
[
[
0.6725176931311545,
0.7240278732664635,
2.477792594569592
],
[
3.749115368986495,
-0.7240278732664629,
5.067580406050081
],
[
-0.16286592562395202,
2.2048093850203077,
8.145428565309837
],
[
2.2108165310588244,
0,
8.145428565309837
],
[
0,
0,... | [
[
0.32573185124790405,
-4.409618770040615,
1.2001111293803255
],
[
4.421633062117649,
0,
-1.2001111293803255
],
[
-0.32573185124790405,
4.409618770040615,
7.545373000619674
]
] | [
20,
20,
12,
12,
1,
82,
82
] | [
1,
1,
1
] | alex<agm004542260> | I4/mmm | Ca-H-Mg-Pb | 0.092332 | null | null | 0.000077 | 1,639.386486 | 35.243565 |
[
[
8.881784197001252e-16,
16.643621752291086,
1.7763568394002505e-15
],
[
2.220446049250313e-16,
5.547873917430361,
4.440892098500626e-16
],
[
1.4688900863325133e-15,
11.095747834860722,
2.2792678949778985e-15
],
[
0,
0,
0
],
[
2.7643854599890423,
... | [
[
2.6152928454553233,
7.397165223240481,
4.529820085000001
],
[
2.6152928454553233,
7.397165223240481,
-4.529820084999999
],
[
-5.230585690910646,
7.397165223240481,
0
]
] | [
55,
55,
19,
81,
53,
53,
53,
53,
53,
53
] | [
1,
1,
1
] | mp-1112692 | Fm-3m | Cs-I-K-Tl | 0.091618 | 0.5223 | null | 0.000007 | 5,398.291535 | 9.768433 |
[
[
-3.1122286299999997,
1.7968460373101611,
-7.07152913
],
[
0,
0,
-3.535764565
],
[
-3.112228630000001,
-1.7968460373101611,
-3.5357645650000005
],
[
-4.287549105348976,
-0.17733603611795018,
-2.1895456843529617
],
[
-1.9369081546510247,
-0.177... | [
[
-3.112228630000001,
-5.390538111930481,
-7.622761659888505e-16
],
[
-3.1122286299999993,
5.390538111930481,
3.8113808299442524e-16
],
[
0,
0,
-7.07152913
]
] | [
19,
24,
28,
17,
17,
17,
17,
17,
17
] | [
1,
1,
1
] | alex<agm005099319> | P312 | Cl-Cr-K-Ni | 0.002304 | null | null | 0.021035 | 2,487.708804 | 10.54527 |
[
[
1.7406939055560972e-16,
7.7389658176159895,
5.551115123125783e-16
],
[
0,
0,
0
],
[
-3.179950336638745e-16,
5.159310545077327,
4.440892098500626e-16
],
[
-6.99037155420843e-16,
2.5796552725386643,
2.220446049250313e-16
]
] | [
[
1.216061157557147,
3.439540363384884,
2.1062797100000004
],
[
1.216061157557147,
3.439540363384884,
-2.1062797099999995
],
[
-2.4321223151142934,
3.439540363384884,
0
]
] | [
25,
23,
31,
76
] | [
1,
1,
1
] | alex<agm001364186> | F-43m | Ga-Mn-Os-V | 0.013263 | null | null | 0.018453 | 5,837.797403 | 225.788879 |
[
[
2.629661295,
2.629661295,
2.7848921350000007
],
[
-1.6102031438817168e-16,
2.629661295,
1.6102031438817168e-16
],
[
2.629661295,
0,
1.6102031438817168e-16
],
[
0,
0,
2.784892135
],
[
0,
0,
0
]
] | [
[
5.25932259,
0,
3.2204062877634336e-16
],
[
-3.2204062877634336e-16,
5.25932259,
3.2204062877634336e-16
],
[
0,
0,
5.56978427
]
] | [
37,
81,
81,
47,
45
] | [
1,
1,
1
] | alex<agm001618188> | P4/mmm | Ag-Rb-Rh-Tl | 0.075188 | null | null | 0.000035 | 5,878.016409 | 42.018654 |
[
[
-2.1348747724635186e-32,
4.001994355497388e-16,
4.655365909415446
],
[
2.46868290536504e-16,
-4.0316651414658216,
5.3259403752922765
],
[
1.5899387897975938e-16,
-2.5965670933114273,
1.4991287102922766
],
[
2.2181448800000005,
-5.053247068648265,
2.91749... | [
[
4.43628976,
0,
2.71644402733709e-16
],
[
-4.058621695162634e-16,
6.628232234777251,
3.8268116650000015
],
[
4.058621695162634e-16,
-6.628232234777251,
3.826811664999999
]
] | [
65,
65,
65,
49,
49,
49,
50,
50,
78
] | [
1,
1,
1
] | alex<agm002374709> | P-62m | In-Pt-Sn-Tb | 0.042388 | null | null | -0.000004 | 3,447.342086 | 65.901108 |
[
[
6.3782832342526845,
4.48126841476257,
9.66804432652587
],
[
1.7149187156840675,
1.1737685127292956,
3.933256384356594
],
[
0,
0,
0
],
[
4.046600974968376,
2.8275184637459327,
6.800650355441232
],
[
2.902447409747723,
3.8323684221340595,
8... | [
[
6.007516051442137,
0,
3.2370485429394176
],
[
2.085685898494616,
5.6550369274918655,
3.239200127943047
],
[
0,
0,
7.12505204
]
] | [
19,
19,
14,
32,
79,
79,
79,
79,
79,
79
] | [
1,
1,
1
] | alex<agm004921626> | C2/m | Au-Ge-K-Si | 0.050928 | null | null | -0.000311 | 1,404.340575 | 53.304981 |
[
[
1.9919266,
0,
1.0750526598320276
],
[
-1.219703267413235e-16,
1.9919266,
8.386502610167973
],
[
0,
0,
4.730777635
],
[
1.9919265999999998,
1.9919266,
4.730777635
],
[
1.9919266,
0,
6.517067042190909
],
[
-1.219703267413235e-16,
... | [
[
3.9838532,
0,
2.43940653482647e-16
],
[
-2.43940653482647e-16,
3.9838532,
2.43940653482647e-16
],
[
0,
0,
9.46155527
]
] | [
67,
67,
29,
29,
52,
52,
8,
8
] | [
1,
1,
1
] | alex<agm002176330> | P4/nmm | Cu-Ho-O-Te | 0.098993 | null | null | -0.000035 | 3,332.232192 | 62.659534 |
[
[
0,
0,
0
],
[
8.760632156700493e-16,
5.579691889001633,
6.969868765471787e-16
],
[
6.950644462425485e-16,
2.7898459445008164,
2.220446049250313e-16
],
[
1.0281313536300955e-15,
8.36953783350245,
6.661338147750939e-16
]
] | [
[
1.315145990548211,
3.7197945926677565,
2.2778996750000005
],
[
1.315145990548211,
3.7197945926677565,
-2.2778996749999996
],
[
-2.6302919810964216,
3.7197945926677565,
0
]
] | [
40,
30,
29,
79
] | [
1,
1,
1
] | alex<agm001341670> | F-43m | Au-Cu-Zn-Zr | 0.045123 | null | null | -0.000005 | 1,567.186895 | 129.499176 |
[
[
8.53911476918289,
8.521637326564793,
3.1523607638975584
],
[
4.158068834314119,
5.315674288435208,
9.468995621613118
],
[
0.22297710055464995,
0.703237083435207,
9.512580760671323
],
[
4.6040230354234195,
3.909200121564793,
3.195945902955764
],
[
... | [
[
8.762091869737539,
0,
0.015835904568880853
],
[
-5.648606459371415e-16,
9.22487441,
5.648606459371415e-16
],
[
0,
0,
12.64910562
]
] | [
55,
55,
55,
55,
19,
19,
81,
81,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53,
53
] | [
1,
1,
1
] | alex<agm004940211> | P2_1/c | Cs-I-K-Tl | 0.063234 | null | null | 0.000011 | 5,398.291535 | 7.726734 |
[
[
0,
0,
0
],
[
5.129812912347185e-16,
5.558972365619456,
4.440892098500626e-16
],
[
4.440892098500626e-16,
8.338458548429186,
6.661338147750939e-16
],
[
2.220446049250313e-16,
2.7794861828097286,
-2.9913956312022024e-17
]
] | [
[
1.3102623520527141,
3.705981577079638,
2.2694409650000003
],
[
1.3102623520527141,
3.705981577079638,
-2.2694409649999994
],
[
-2.620524704105428,
3.705981577079638,
0
]
] | [
21,
73,
75,
76
] | [
1,
1,
1
] | alex<agm001388023> | F-43m | Os-Re-Sc-Ta | 0.090482 | null | null | -0.000002 | 5,671.917913 | 218.481461 |
[
[
3.2899241175,
1.9102703626061426,
1.4153371639563797
],
[
1.0966413724999995,
6.809302237080721,
7.247461928047695
],
[
3.2899241174999996,
5.868040506153833,
-0.4772760179388276
],
[
1.0966413724999997,
2.85153209353303,
9.140075109942902
],
[
3... | [
[
4.38656549,
0,
2.6859966932893706e-16
],
[
-5.339198337069741e-16,
8.719572599686863,
-2.681968477995926
],
[
0,
0,
11.34476757
]
] | [
11,
11,
20,
20,
31,
31,
52,
52,
52,
52,
52,
52
] | [
1,
1,
1
] | alex<agm005035783> | P2_1/m | Ca-Ga-Na-Te | 0.086415 | null | null | -0.000021 | 4,033.830139 | 20.813097 |
[
[
-1.0384419237038414e-16,
1.6959043610400077,
6.545023796040009
],
[
-4.900016671052131e-16,
8.002334508959994,
3.1532150739599936
],
[
-1.930787373674145e-16,
3.153215073959993,
1.695904361040008
],
[
-4.0076712210818277e-16,
6.545023796040009,
8.0023345... | [
[
3.20765306,
0,
1.9641210263521065e-16
],
[
-5.9384585947559725e-16,
9.69823887,
5.9384585947559725e-16
],
[
0,
0,
9.69823887
]
] | [
66,
66,
66,
66,
21,
21,
5,
5,
5,
5,
45,
45,
45,
45,
45,
45,
45,
45,
45,
45
] | [
1,
1,
1
] | alex<agm005138256> | P4/mbm | B-Dy-Rh-Sc | 0.003327 | null | null | -0.000014 | 5,925.652284 | 154.722839 |
[
[
1.0164420825,
1.2054912860374474,
3.579360145894097
],
[
3.0493262474999994,
5.24948495907571,
-0.6086551685699806
],
[
1.0164420825,
1.294220065383145,
6.944915936806304
],
[
3.0493262474999994,
5.338213738421407,
2.756900622342226
],
[
1.016442... | [
[
4.06576833,
0,
2.48956508570459e-16
],
[
-4.0068637063839946e-16,
6.543705024458855,
-2.2495139917636764
],
[
0,
0,
8.58577476
]
] | [
20,
20,
20,
20,
31,
31,
50,
50,
7,
7
] | [
1,
1,
1
] | alex<agm002223899> | P2_1/m | Ca-Ga-N-Sn | 0.045026 | null | null | 0.000019 | 1,591.13196 | 47.873096 |
[
[
-0.014895039251609765,
-0.009122057424516904,
-7.060715166142056
],
[
-2.8450364074544305,
-1.7423643566993672,
-4.790971553093695
],
[
-1.4195070960031253,
-0.8693381081793017,
-2.4054654064213117
],
[
-4.300356655388474,
-2.633635245514444,
-7.07774278... | [
[
-1.7872819077657147,
-3.502973178545087,
-1.1865639341783518
],
[
-3.9325815576327114,
0,
-1.1865639341783518
],
[
0,
0,
-7.11008113
]
] | [
58,
67,
33,
15
] | [
1,
1,
1
] | alex<agm005201179> | R3m | As-Ce-Ho-P | 0.008467 | null | null | 0.007059 | 3,414.830473 | 72.575737 |
[
[
-0.24676575373023668,
5.975365882378774,
-0.3201761325014222
],
[
3.968244402171813,
1.088156620181196,
5.143948066810901
],
[
1.35356374500955,
2.3249636587242657,
0.4054949978817668
],
[
-0.7858673951993888,
5.830773104518495,
3.692497768680437
],
... | [
[
5.696713621658291,
0,
-1.275869770969393
],
[
-1.9752349732167147,
7.0635225025599695,
-1.359856464721129
],
[
0,
0,
7.45949817
]
] | [
56,
56,
13,
13,
13,
13,
32,
32,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm004974261> | C2/c | Al-Ba-Ge-O | 0.063849 | null | null | 0.000049 | 1,544.285882 | 50.422039 |
[
[
0.18146304064887778,
-2.2443233047321143,
-7.763816896621938
],
[
-3.7188182722057763,
0.703441305681881,
-4.965818531789892
],
[
-0.6236578983288108,
-0.7034413056818815,
-2.2443145114336867
],
[
-2.1712380852672934,
-2.0100263383362577e-34,
0.603351168... | [
[
-4.342476170534587,
0,
1.2067023367764202
],
[
-0.36292608129775555,
4.488646609464228,
-1.3060369667561242
],
[
0.36292608129775555,
-4.488646609464228,
-7.1107984132438755
]
] | [
69,
69,
69,
21,
51,
51,
6
] | [
1,
1,
1
] | alex<agm004760333> | Immm | C-Sb-Sc-Tm | 0.026979 | null | null | 0.005188 | 3,229.775614 | 75.848518 |
[
[
0,
0,
2.382918575
],
[
-1.391279400699883e-16,
2.27213169,
1.391279400699883e-16
],
[
2.27213169,
0,
1.391279400699883e-16
],
[
2.27213169,
2.27213169,
2.3829185750000006
],
[
0,
0,
0
]
] | [
[
4.54426338,
0,
2.782558801399766e-16
],
[
-2.782558801399766e-16,
4.54426338,
2.782558801399766e-16
],
[
0,
0,
4.76583715
]
] | [
69,
21,
21,
51,
6
] | [
1,
1,
1
] | alex<agm005012955> | P4/mmm | C-Sb-Sc-Tm | 0.037072 | null | null | 0.000012 | 3,434.108871 | 98.803879 |
[
[
2.123227555,
0,
2.4858713201104443
],
[
-1.3001019145461056e-16,
2.123227555,
7.751862819889556
],
[
2.123227555,
2.123227555,
5.11886707
],
[
0,
0,
5.11886707
],
[
2.123227555,
0,
8.87095475997737
],
[
-1.3001019145461056e-16,
... | [
[
4.24645511,
0,
2.600203829092211e-16
],
[
-2.600203829092211e-16,
4.24645511,
2.600203829092211e-16
],
[
0,
0,
10.23773414
]
] | [
57,
57,
31,
15,
15,
15,
46,
46,
46,
46
] | [
1,
1,
1
] | alex<agm004533868> | P-4m2 | Ga-La-P-Pd | 0.053759 | null | null | 0.000164 | 5,626.17248 | 111.120331 |
[
[
0,
0,
-3.66890999
],
[
-2.506859434999999,
1.447335969617803,
-0.9645650949985763
],
[
-2.506859435,
-1.4473359696178039,
-6.3732548850014235
],
[
-3.816983458218346,
0.6909355121408955,
-6.320902621328515
],
[
-2.506859435,
2.960136884571619... | [
[
-2.5068594350000004,
-4.34200790885341,
-6.140034765970184e-16
],
[
-2.5068594349999995,
4.34200790885341,
3.070017382985092e-16
],
[
0,
0,
-7.33781998
]
] | [
56,
20,
20,
1,
1,
1,
1,
1,
1,
1,
1,
44
] | [
1,
1,
1
] | alex<agm004891761> | P-3m1 | Ba-Ca-H-Ru | 0.060772 | null | null | 0.000044 | 3,907.186873 | 53.308346 |
[
[
-4.922081485531234,
-2.988182405001877,
-5.619499552554549
],
[
-0.18901780341928526,
-0.11475219905845387,
-7.096675785426869
],
[
-3.5580817144017987,
-2.160101819888268,
-2.750715740766737
],
[
-2.5215066172708145,
-1.5307998719592983,
-6.480583442428... | [
[
-1.8513539955159204,
-3.5600048352611546,
-1.115156289168941
],
[
-4.01262333689515,
0,
-1.115156289168941
],
[
0,
0,
-7.77681109
]
] | [
59,
66,
52,
15
] | [
1,
1,
1
] | alex<agm005190928> | R3m | Dy-P-Pr-Te | 0.092806 | null | null | 0.001688 | 3,731.253805 | 59.739071 |
[
[
4.0995110258260095,
3.211605327013004,
10.182358276366921
],
[
1.6735726091561234,
5.342304556574548,
1.756715160462833
],
[
2.6596493497527858,
1.0735655596848592,
7.179410742409855
],
[
3.1134342852293475,
7.480344323902693,
4.759662694419898
],
[
... | [
[
3.8699311261307,
0,
0.7257435120386736
],
[
1.9031525088514334,
8.553909883587552,
0.5325106547910795
],
[
0,
0,
10.68081927
]
] | [
48,
48,
48,
48,
35,
35,
17,
17,
17,
17,
17,
17
] | [
1,
1,
1
] | alex<agm003428337> | C2/m | Br-Cd-Cl | 0.090823 | null | null | -0.000034 | 2,440.236691 | 8.757633 |
[
[
-2.899584609875564,
-2.2701961278608747,
-4.578569835952381
],
[
-1.7129702822914206,
-2.0596299263465108,
-8.469922352793992
],
[
-0.8925268228407173,
2.2701961278608755,
-4.413172235309855
],
[
-2.0791411504248614,
2.0596299263465125,
-0.52181971846824... | [
[
-3.7921114327162817,
0,
0.7669225187377622
],
[
-0.6348956641142379,
7.142294615533373,
-3.139293797803898
],
[
0.6348956641142379,
-7.142294615533373,
-6.6193707921961025
]
] | [
58,
58,
58,
58,
5,
5,
17,
17,
17,
17,
17
] | [
1,
1,
1
] | alex<agm003362672> | Immm | B-Ce-Cl | 0.076305 | null | null | 0.010675 | 2,695.169823 | 44.843773 |
[
[
-1.462487532847702e-16,
2.388423395,
1.462487532847702e-16
],
[
0,
0,
2.388423395
],
[
2.33197907,
0,
1.4279253518770609e-16
],
[
2.33197907,
2.388423395,
2.3884233950000002
],
[
0,
0,
0
]
] | [
[
4.66395814,
0,
2.8558507037541217e-16
],
[
-2.924975065695404e-16,
4.77684679,
2.924975065695404e-16
],
[
0,
0,
4.77684679
]
] | [
67,
67,
69,
49,
8
] | [
1,
1,
1
] | alex<agm005011393> | P4/mmm | Ho-In-O-Tm | 0.028092 | null | null | -0.000008 | 2,833.330729 | 40.003731 |
[
[
3.238869245188868,
2.042406685,
3.032023731862903
],
[
0.5284670380556806,
0,
1.4516720210071978
],
[
2.1515794017458365,
2.042406685,
0.04529376470618452
],
[
1.6220786824092537,
0,
4.455767653785649
]
] | [
[
3.7704952795997033,
0,
-1.3726119661353706
],
[
-2.5012268093424064e-16,
4.08481337,
2.5012268093424064e-16
],
[
0,
0,
5.86498538
]
] | [
57,
62,
28,
44
] | [
1,
1,
1
] | alex<agm005206454> | Amm2 | La-Ni-Ru-Sm | 0.042148 | null | null | -0.000053 | 3,993.781195 | 91.897507 |
[
[
3.10408024802859,
1.625652727792761,
2.8157131200000003
],
[
0.7509963191126184,
-1.625652727792761,
2.8157131199999994
],
[
0.6235501339313513,
0,
5.63142624
],
[
3.975462466573741,
0,
5.63142624
]
] | [
[
4.80108649,
0,
2.9398176012040505e-16
],
[
-2.9862756144248524e-16,
4.876958183378283,
2.8157131200000007
],
[
2.9862756144248524e-16,
-4.876958183378283,
2.815713119999999
]
] | [
55,
19,
15,
1
] | [
1,
1,
1
] | alex<agm005180914> | P3m1 | Cs-H-K-P | 0.022192 | null | null | 0 | 6,093.81125 | 11.304094 |
[
[
0,
0,
0.6356763729856679
],
[
1.81232015,
1.81232015,
3.2740391390630093
],
[
1.81232015,
1.81232015,
6.7600020186109
],
[
0,
0,
5.018518112217421
]
] | [
[
3.6246403,
0,
2.2194520707277508e-16
],
[
-2.2194520707277508e-16,
3.6246403,
2.2194520707277508e-16
],
[
0,
0,
8.79040491
]
] | [
57,
65,
39,
30
] | [
1,
1,
1
] | alex<agm005193790> | P4mm | La-Tb-Y-Zn | 0.023815 | null | null | 0.000507 | 2,828.08824 | 49.439129 |
[
[
2.5604599503391263,
1.6480387556360478,
3.305395240201648
],
[
4.9159862991366285,
5.19952207849925,
3.5891045449074164
],
[
2.2502274485510556,
3.471558220087778,
0.326970694087942
],
[
3.76502541900683,
2.543823626793028,
-0.5636959417704746
],
[
... | [
[
5.067567035420637,
0,
-0.04673015588135819
],
[
-0.0334828556175859,
5.244959318423533,
-2.417200687230882
],
[
0,
0,
6.16679657
]
] | [
24,
49,
51,
9,
9,
9,
9,
9,
9
] | [
1,
1,
1
] | alex<agm005097469> | P1 | Cr-F-In-Sb | 0.091047 | null | null | 0.024404 | 2,553.105378 | 19.014782 |
[
[
2.322084525294211,
0.8038043100707406,
5.550639447804798
],
[
2.8022016929306486,
4.57171179703548,
4.016165241447848
],
[
1.0557206837194908,
2.055320036481453,
3.111931820672542
],
[
4.068565534505368,
3.320196070624767,
6.454872868580104
],
[
... | [
[
3.696888711367047,
0,
1.1567087456316987
],
[
1.4273975068578122,
5.37551610710622,
1.9240374136209477
],
[
0,
0,
6.48605853
]
] | [
65,
65,
32,
32,
74,
74,
6
] | [
1,
1,
1
] | alex<agm002258631> | C2/m | C-Ge-Tb-W | 0.084386 | null | null | 0.000026 | 3,379.599189 | 119.734329 |
[
[
1.99845228,
0,
2.5042929289577214
],
[
-1.223699093975365e-16,
1.99845228,
8.697049791042279
],
[
1.9984522799999997,
1.99845228,
5.60067136
],
[
0,
0,
5.60067136
],
[
1.99845228,
0,
9.797685997783
],
[
-1.223699093975365e-16,
... | [
[
3.99690456,
0,
2.44739818795073e-16
],
[
-2.44739818795073e-16,
3.99690456,
2.44739818795073e-16
],
[
0,
0,
11.20134272
]
] | [
62,
62,
69,
15,
15,
15,
45,
45,
45,
45
] | [
1,
1,
1
] | alex<agm004539476> | P-4m2 | P-Rh-Sm-Tm | 0.091355 | null | null | 0.000211 | 5,361.133272 | 142.735321 |
[
[
1.040941814398927e-15,
5.702077618879963,
1.8564445092295053e-16
],
[
0,
0,
0
],
[
8.535378145870105e-16,
8.553116428319944,
7.771561172376096e-16
],
[
1.1102230246251565e-16,
2.8510388094399817,
2.220446049250313e-16
]
] | [
[
1.3439925837206883,
3.801385079253309,
2.3278634400000002
],
[
1.3439925837206883,
3.801385079253309,
-2.3278634399999993
],
[
-2.687985167441376,
3.801385079253309,
0
]
] | [
40,
73,
41,
77
] | [
1,
1,
1
] | alex<agm001383976> | F-43m | Ir-Nb-Ta-Zr | 0.079438 | null | null | -0.000007 | 6,589.833669 | 191.797989 |
[
[
-3.1840454812689043e-16,
3.0419025296810767,
4.977910322834233e-16
],
[
1.1102230246251565e-16,
9.12570758904323,
1.1639248470585173e-15
],
[
5.404491530519217e-16,
6.083805059362152,
1.4396712744169093e-15
],
[
0,
0,
0
]
] | [
[
1.4339666042973351,
4.055870039574769,
2.4837030150000006
],
[
1.4339666042973351,
4.055870039574769,
-2.4837030149999997
],
[
-2.86793320859467,
4.055870039574769,
0
]
] | [
12,
21,
82,
79
] | [
1,
1,
1
] | alex<agm001374313> | F-43m | Au-Mg-Pb-Sc | 0.097727 | null | null | 0.00004 | 1,656.812721 | 64.692154 |
[
[
-4.115216279769463,
1.2787366924059038,
-5.756493398911148
],
[
-2.987481823361721,
-1.2787366924059038,
-1.9539339543760565
],
[
-6.8051547895549085,
2.3208350206925177,
-2.16355087983584
],
[
-0.29754331357627456,
-2.3208350206925177,
-5.54687647345136... | [
[
-7.102698103131184,
0,
2.772845526712795
],
[
-1.1518028077617237,
7.199143426196843,
-2.9503654419468597
],
[
1.1518028077617237,
-7.199143426196843,
-7.53290743805314
]
] | [
37,
37,
37,
37,
38,
38,
49,
49,
83,
83,
83,
83
] | [
1,
1,
1
] | alex<agm004739689> | Ibam | Bi-In-Rb-Sr | 0.024184 | null | null | -0.000035 | 5,087.450261 | 15.91293 |
[
[
0,
0,
0
],
[
-3.6418126258501577,
-2.196912398121061,
-6.398619974953062
],
[
-5.562693687635065,
-3.355678060581819,
-9.21240818156074
],
[
-1.720931564065249,
-1.038146735660303,
-3.5848317683453828
],
[
-2.868207061230412,
-1.7302371924542... | [
[
-2.3165318986761907,
-4.393824796242122,
-1.288082289953063
],
[
-4.967093353024125,
0,
-1.288082289953063
],
[
0,
0,
-10.22107537
]
] | [
56,
20,
12,
12,
80,
80,
80,
80
] | [
1,
1,
1
] | alex<agm004808476> | R-3m | Ba-Ca-Hg-Mg | 0.041079 | null | null | 0.000082 | 2,807.915498 | 34.494045 |
[
[
0,
0,
0
],
[
-5.721734117722789,
-3.4572616718285887,
-9.325567245622201
],
[
-1.7517365293899245,
-1.0584573553397043,
-3.6971005599478337
],
[
-3.7367353235563567,
-2.2578595135841466,
-6.511333902785017
],
[
-2.954296652156274,
-1.78508409... | [
[
-2.3724616617465086,
-4.515719027168293,
-1.3477374227850176
],
[
-5.101008985366205,
0,
-1.3477374227850176
],
[
0,
0,
-10.32719296
]
] | [
56,
20,
20,
12,
80,
80,
80,
80
] | [
1,
1,
1
] | alex<agm004808475> | R-3m | Ba-Ca-Hg-Mg | 0.056978 | null | null | 0.000254 | 2,811.435352 | 31.966938 |
[
[
1.5875827866469852,
1.9050208675,
0.01940226122597897
],
[
5.218711837903877,
5.7150626025,
7.7853251952436
],
[
1.569894520113756,
1.9050208675,
5.040131413631118
],
[
5.236400104437107,
5.7150626025,
2.764596042838461
],
[
5.328324558377366,
... | [
[
6.806294624550863,
0,
-2.3012547035304216
],
[
-4.665955415385578e-16,
7.62008347,
4.665955415385578e-16
],
[
0,
0,
10.10598216
]
] | [
37,
37,
39,
39,
14,
14,
52,
52,
52,
52,
52,
52,
52,
52
] | [
1,
1,
1
] | alex<agm005051757> | P2_1/m | Rb-Si-Te-Y | 0.016975 | null | null | -0.00016 | 4,591.380373 | 19.533457 |
[
[
2.5995548249999993,
4.239863770474318,
-1.498870574899223
],
[
-2.596167797666101e-16,
4.239863770474318,
3.0085272601007764
],
[
0,
0,
0
],
[
2.599554825,
0,
4.507397835
],
[
-3.98231775821775e-16,
6.503618448993447,
0.10645897151087735
... | [
[
5.19910965,
0,
3.1835364956443077e-16
],
[
-5.192335595332202e-16,
8.479727540948636,
-2.9977411497984465
],
[
0,
0,
9.01479567
]
] | [
55,
19,
81,
81,
53,
53,
53,
53
] | [
1,
1,
1
] | alex<agm004782438> | P2/m | Cs-I-K-Tl | 0.014775 | null | null | -0.000006 | 5,671.22008 | 12.20856 |
[
[
-3.2145563300000006,
-1.8559249624507166,
-6.769240814622912
],
[
-3.2145563299999997,
1.8559249624507168,
-2.8284567253770896
],
[
0,
0,
0
],
[
-3.2145563300000006,
-1.8559249624507166,
-1.4517827614964223
],
[
-3.2145563299999997,
1.8559249... | [
[
-3.214556330000001,
-5.567774887352147,
-7.873392240426727e-16
],
[
-3.2145563299999993,
5.567774887352147,
3.9366961202133633e-16
],
[
0,
0,
-9.59769754
]
] | [
81,
81,
81,
75,
75,
80,
8,
8,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm004668829> | P-3m1 | Hg-O-Re-Tl | 0.093317 | null | null | 0.00291 | 4,489.800396 | 16.844248 |
[
[
1.81113825,
1.81113825,
2.2180046606758387e-16
],
[
-1.1090023303379193e-16,
1.81113825,
1.759735660025395
],
[
-1.1090023303379193e-16,
1.81113825,
4.796922299974605
],
[
1.81113825,
0,
1.759735660025395
],
[
1.81113825,
0,
4.79692229997... | [
[
3.6222765,
0,
2.2180046606758387e-16
],
[
-2.2180046606758387e-16,
3.6222765,
2.2180046606758387e-16
],
[
0,
0,
6.55665796
]
] | [
30,
28,
28,
28,
28,
28,
34
] | [
1,
1,
1
] | alex<agm002167838> | P4/mmm | Ni-Se-Zn | 0.084056 | null | null | -0.000221 | 1,631.89322 | 163.193466 |
[
[
-6.5269500991964104,
-4.652271608229996,
-11.070988629764926
],
[
-2.1191348412119257,
-1.5104743725549574,
-3.5944686837554345
],
[
-4.323042470204168,
-3.081372990392477,
-7.33272865676018
],
[
0,
0,
0
],
[
-2.7913430817047424,
-4.752805099... | [
[
-2.1267051519006874,
-6.162745980784954,
-3.6073094167601805
],
[
-6.519379788507648,
0,
-3.6073094167601805
],
[
0,
0,
-7.45083848
]
] | [
37,
37,
38,
30,
17,
17,
17,
17,
17,
17
] | [
1,
1,
1
] | alex<agm004939628> | R-3 | Cl-Rb-Sr-Zn | 0.073651 | null | null | -0.000002 | 3,226.912331 | 13.297266 |
[
[
3.4449698875975705e-16,
2.7062495136101368,
7.126840173565795e-16
],
[
7.885861986098197e-16,
5.412499027220276,
4.440892098500626e-16
],
[
6.163377042299411e-16,
8.118748540830415,
7.771561172376096e-16
],
[
0,
0,
0
]
] | [
[
1.2757382551043501,
3.608332684813518,
2.2096434750000005
],
[
1.2757382551043501,
3.608332684813518,
-2.2096434749999996
],
[
-2.5514765102087,
3.608332684813518,
0
]
] | [
25,
41,
42,
74
] | [
1,
1,
1
] | alex<agm001391103> | F-43m | Mn-Mo-Nb-W | 0.085248 | null | null | -0 | 5,180.851456 | 227.536652 |
[
[
2.7142319227830067,
3.291659502517081,
3.88741072941469
],
[
5.428463923159711,
1.6755808635778533,
4.808470445035213
],
[
2.7142319473543273,
0,
3.887410737668886
],
[
2.714231948645613,
1.6532377693595253,
0.9210596981492386
],
[
5.428463897297... | [
[
5.4284638947086545,
0,
1.8421193953377712
],
[
2.714231951234063,
4.967240366094934,
0.9210596991121317
],
[
0,
0,
5.93270208
]
] | [
58,
58,
58,
21,
21,
73,
7,
7,
7,
7,
7,
7
] | [
1,
1,
1
] | alex<agm004648895> | C2/m | Ce-N-Sc-Ta | 0.044664 | null | null | -0.000241 | 3,377.309269 | 174.746414 |
[
[
1.723680644900097,
4.775416482440566,
8.183723292815099
],
[
-1.726844255982423e-8,
1.5122219190574382,
7.204531914456574
],
[
-4.110079515735483e-11,
1.9646417929355315,
2.9721348878150993
],
[
1.7236806621274385,
5.227836356318659,
1.992943509456575
... | [
[
3.44736129,
0,
2.1108999846514952e-16
],
[
-1.7236806451410038,
6.740058275376097,
4.259916794764752e-16
],
[
0,
0,
10.42317681
]
] | [
58,
58,
58,
58,
21,
21,
73,
73,
7,
7,
7,
7,
7,
7,
7,
7,
7,
7
] | [
1,
1,
1
] | alex<agm005161780> | Cmc2_1 | Ce-N-Sc-Ta | 0.016542 | null | null | 0.007924 | 3,427.09583 | 177.427734 |
[
[
1.930370765,
0,
2.09002849
],
[
1.9303707649999997,
2.0212496,
2.419669615721373e-16
],
[
0,
0,
0
],
[
-1.2376584264589339e-16,
2.0212496,
2.09002849
]
] | [
[
3.86074153,
0,
2.3640223785248775e-16
],
[
-2.4753168529178677e-16,
4.0424992,
2.4753168529178677e-16
],
[
0,
0,
4.18005698
]
] | [
67,
29,
78,
45
] | [
1,
1,
1
] | alex<agm005213918> | Pmmm | Cu-Ho-Pt-Rh | 0.00925 | null | null | -0.000018 | 6,087.976218 | 146.800827 |
[
[
-9.458524858654138e-17,
1.544694333948291,
5.869097888948291
],
[
-4.350014485986772e-16,
7.104112776051709,
2.7797092210517094
],
[
-1.7020810000606792e-16,
2.779709221051709,
1.5446943339482913
],
[
-3.5937859717915064e-16,
5.869097888948291,
7.1041127... | [
[
3.17533434,
0,
1.9443315178518366e-16
],
[
-5.295866971852186e-16,
8.64880711,
5.295866971852186e-16
],
[
0,
0,
8.64880711
]
] | [
72,
72,
72,
72,
4,
4,
4,
4,
27,
27,
27,
27,
27,
27,
27,
27,
27,
27,
29,
29
] | [
1,
1,
1
] | alex<agm005139359> | P4/mbm | Be-Co-Cu-Hf | 0.041541 | null | null | 0.011273 | 2,579.269566 | 183.58728 |
[
[
-1.2866564043629691,
-0.8985417969791517,
-3.361564577226581
],
[
-3.107298980510373,
-2.1699950353735904,
-5.766040200351024
],
[
-6.350761361803109,
-4.435080342250047,
-5.620328518719427
],
[
-4.5573834571484975,
-3.1826674994376054,
-8.83468493624634... | [
[
-1.660844189591097,
-4.528026231090394,
-2.69088997733111
],
[
-4.8230099493512535,
0,
-2.69088997733111
],
[
0,
0,
-5.66769992
]
] | [
69,
26,
26,
83,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm004954431> | R3 | Bi-Fe-O-Tm | 0.061348 | null | null | 0.080789 | 3,384.459072 | 143.804504 |
[
[
1.40146450090683,
-0.8149482135794575,
-3.457865742508123
],
[
-1.203341500751005,
-3.5789371994613783,
-5.245551594857398
],
[
-0.9831618715927646,
-7.7069324369507,
-4.285754386290799
],
[
0.3224865636448181,
-6.231702519157678,
-8.161297160820547
],... | [
[
4.169967330065557,
0,
-0.9566000351111228
],
[
0.418302629314066,
-8.521880650530157,
1.8234457812010776
],
[
-4.169967330065557,
0,
-8.610465874888877
]
] | [
59,
59,
59,
59,
59,
59,
50,
33,
33,
33,
15,
15
] | [
1,
1,
1
] | alex<agm004603164> | C2/m | As-P-Pr-Sn | 0.063027 | null | null | 0.000206 | 3,218.412448 | 66.155495 |
[
[
0,
0,
0
],
[
2.6507322049999997,
4.3300288383179995,
-1.5219176227833886
],
[
-2.651377978530935e-16,
4.3300288383179995,
3.086490097216611
],
[
2.650732205,
0,
4.60840772
],
[
-4.023855092597704e-16,
6.571454063978722,
0.2269561695082332... | [
[
5.30146441,
0,
3.2462107102500557e-16
],
[
-5.30275595706187e-16,
8.660057676635999,
-3.0438352455667776
],
[
0,
0,
9.21681544
]
] | [
55,
55,
19,
81,
53,
53,
53,
53
] | [
1,
1,
1
] | alex<agm004782440> | P2/m | Cs-I-K-Tl | 0.009084 | null | null | -0.000006 | 5,547.618105 | 9.97803 |
[
[
4.13895824,
-2.425486562529641,
1.4003553197923082
],
[
2.0380232851356103e-16,
-3.328344607693518,
4.7223312947923075
],
[
3.7656861770975105e-33,
-1.9500248758314866e-17,
3.8432413104153844
],
[
2.06947912,
3.6772241837955974e-17,
1.559750769661875
]... | [
[
4.13895824,
0,
2.534380980210281e-16
],
[
-3.523205462724031e-16,
5.753831170223159,
3.321975975000001
],
[
3.523205462724031e-16,
-5.753831170223159,
3.321975974999999
]
] | [
72,
72,
72,
13,
13,
13,
75,
32,
32
] | [
1,
1,
1
] | alex<agm002368195> | P-62m | Al-Ge-Hf-Re | 0.078547 | null | null | 0.00069 | 2,493.59393 | 138.053925 |
[
[
2.54075317,
0.272591511300405,
8.932716293747513
],
[
-2.1074853766811503e-16,
3.4417848119938967,
8.166937937544853
],
[
2.5407531699999995,
5.035296436300405,
0.8732192462524883
],
[
-5.023801047523443e-16,
8.204489736993898,
1.6389976024551471
],
... | [
[
5.08150634,
0,
3.111525237063991e-16
],
[
-5.832631341684585e-16,
9.52540985,
5.832631341684585e-16
],
[
0,
0,
9.80593554
]
] | [
19,
19,
19,
19,
56,
56,
13,
13,
83,
83,
83,
83
] | [
1,
1,
1
] | alex<agm004740860> | Pmc2_1 | Al-Ba-Bi-K | 0.045367 | null | null | -0.000044 | 5,168.493573 | 20.808578 |
[
[
-1.5809796476934859,
-0.9676996860113556,
-2.461417797666499
],
[
-4.614022347111789,
-2.824190673841685,
-7.8135615021102875
],
[
-3.086646370443195,
-1.8893011860485802,
-5.173636833607059
],
[
-0.00742853672568801,
-0.004546922958470497,
-7.7015335657... | [
[
-1.9363003207579808,
-3.7904923125733943,
-1.2781570019874535
],
[
-4.2564176138914585,
0,
-1.2781570019874535
],
[
0,
0,
-7.72627157
]
] | [
57,
60,
51,
33
] | [
1,
1,
1
] | alex<agm005201009> | R3m | As-La-Nd-Sb | 0.067783 | null | null | -0.000013 | 3,316.655152 | 62.194427 |
[
[
1.6120473686100345,
4.597297206657773,
8.057553357528647
],
[
-1.6200263954127803e-8,
1.3611497380988526,
7.036837232830812
],
[
1.601108484616286e-8,
1.8660808540874634,
2.9815824625286464
],
[
1.6120474008213832,
5.102228322646384,
1.9608663378308122
... | [
[
3.22409477,
0,
1.974188670114111e-16
],
[
-1.612047385378881,
6.463378060745236,
4.0789174329850447e-16
],
[
0,
0,
10.15194179
]
] | [
66,
66,
66,
66,
23,
23,
74,
74,
7,
7,
7,
7,
7,
7,
7,
7,
7,
7
] | [
1,
1,
1
] | alex<agm005162712> | Cmc2_1 | Dy-N-V-W | 0.089774 | null | null | 0.003312 | 3,185.427229 | 204.185532 |
[
[
4.21753774,
-3.5281737922328182,
2.0369920886934003
],
[
-5.65539906657002e-33,
2.772827216447485e-17,
2.9120645526132
],
[
4.21753774,
3.528173792232818,
2.036992088693401
],
[
2.10876887,
1.4858221838202423,
0.857839837796535
],
[
2.10876887,
... | [
[
4.21753774,
0,
2.582497046787081e-16
],
[
-3.7046151497817915e-16,
6.050095672256015,
3.4930243650000015
],
[
3.7046151497817915e-16,
-6.050095672256015,
3.493024364999999
]
] | [
67,
67,
67,
13,
13,
13,
14,
14,
47
] | [
1,
1,
1
] | alex<agm002368293> | P-62m | Ag-Al-Ho-Si | 0 | null | null | -0.000175 | 2,462.888884 | 77.28862 |
[
[
4.440892098500626e-16,
13.4447872060002,
1.1102230246251565e-15
],
[
-2.220446049250313e-16,
4.481595735333399,
1.2565965146205113e-15
],
[
0,
0,
0
],
[
0,
8.9631914706668,
1.2944320720853495e-15
],
[
1.1170006904750176,
7.383513945016918,
... | [
[
2.1126444899939734,
5.9754609804445336,
3.6592075950000007
],
[
2.1126444899939734,
5.9754609804445336,
-3.659207594999999
],
[
-4.225288979987946,
5.9754609804445336,
0
]
] | [
37,
37,
14,
50,
79,
79,
79,
79,
79,
79
] | [
1,
1,
1
] | alex<agm004926562> | Fm-3m | Au-Rb-Si-Sn | 0.093719 | null | null | -0.000066 | 1,617.462593 | 49.905224 |
[
[
-6.249088999722908,
-4.445216349628146,
-10.655206995371936
],
[
-2.060313422233159,
-1.4655798485627687,
-3.5130026136947126
],
[
0,
0,
0
],
[
-4.154701210978034,
-2.9553980990954574,
-7.084104804533324
],
[
-5.365452100617092,
-1.7196383409... | [
[
-2.0524133494446812,
-5.910796198190915,
-3.4995323445333244
],
[
-6.256989072511387,
0,
-3.4995323445333244
],
[
0,
0,
-7.16914492
]
] | [
81,
81,
26,
32,
17,
17,
17,
17,
17,
17
] | [
1,
1,
1
] | alex<agm004947437> | R-3 | Cl-Fe-Ge-Tl | 0.065875 | null | null | 0.015087 | 4,256.517731 | 18.425219 |
[
[
0,
0,
0
],
[
0,
0,
-4.51890461
],
[
-2.7157707950000005,
1.5679509995505738,
-3.1138459377611256
],
[
-2.7157707950000005,
-1.5679509995505745,
-5.923963282238875
],
[
-2.7157707950000005,
1.5679509995505738,
-6.384893179264533
],
[
... | [
[
-2.7157707950000005,
-4.703852998651723,
-6.651720022629226e-16
],
[
-2.7157707949999996,
4.703852998651723,
3.325860011314613e-16
],
[
0,
0,
-9.03780922
]
] | [
55,
20,
81,
81,
51,
51
] | [
1,
1,
1
] | alex<agm004754504> | P-3m1 | Ca-Cs-Sb-Tl | 0.078191 | null | null | -0.000007 | 5,261.914693 | 26.411974 |
[
[
0,
0,
-4.94333246
],
[
-3.8283588157625448,
0,
-6.7593330556290105
],
[
-9.140182688684243,
-3.529258087249299,
-10.391334246887034
],
[
-5.311823872921698,
-3.529258087249299,
-3.6320011912580217
],
[
-9.140182688684243,
-3.529258087249299,
... | [
[
-2.9669301143183087,
-7.058516174498598,
-3.632001191258022
],
[
-7.6567176315250896,
0,
-3.632001191258022
],
[
0,
0,
-9.88666492
]
] | [
55,
55,
55,
60,
60,
60,
41,
34,
34,
34,
34,
34,
34,
34,
34
] | [
1,
1,
1
] | alex<agm004690869> | R-3m | Cs-Nb-Nd-Se | 0.071518 | null | null | 0.001882 | 3,696.279346 | 19.615362 |
[
[
2.265162285940111,
0.6254941546068097,
5.563043029913751
],
[
3.6352494575962777,
7.596689525393191,
0.48114166814878195
],
[
0.6850435858280831,
4.73658599460681,
1.6824077991175155
],
[
5.215368157708306,
3.485597685393191,
4.361776898945017
],
[
... | [
[
5.900411743536389,
0,
-2.402532261937467
],
[
-5.034635462856803e-16,
8.22218368,
5.034635462856803e-16
],
[
0,
0,
8.44671696
]
] | [
58,
58,
58,
58,
51,
51,
51,
51,
51,
51,
51,
51,
46,
46,
46,
46,
46,
46
] | [
1,
1,
1
] | alex<agm003336142> | Cmce | Ce-Pd-Sb | 0.066327 | null | null | 0.007372 | 4,674.261964 | 85.088326 |
[
[
1.3294427574999996,
7.790964048978198,
7.405068456814653
],
[
3.9883282725000004,
1.9381171267590247,
2.2461596677969426
],
[
3.9883282725000004,
1.7366907054739023,
7.410099963372989
],
[
1.3294427574999996,
7.99239047026332,
2.2411281612386054
],
[... | [
[
5.31777103,
0,
3.256195635244012e-16
],
[
-5.957344060255679e-16,
9.729081175737223,
-2.994212005388406
],
[
0,
0,
12.64544013
]
] | [
55,
55,
19,
19,
81,
81,
53,
53,
53,
53,
53,
53
] | [
1,
1,
1
] | alex<agm005027258> | P2_1/m | Cs-I-K-Tl | 0.046202 | null | null | -0.000022 | 5,593.519622 | 10.761304 |
[
[
3.831760557168356,
0,
1.945437323551648
],
[
1.4206139199113366,
3.5613133978523797,
1.9482022091430464
],
[
0,
0,
0
],
[
5.252374477079693,
3.5613133978523797,
3.8936395326946944
],
[
5.252374477079693,
3.5613133978523797,
8.639902782694... | [
[
7.663521114336712,
0,
3.890874647103296
],
[
2.841227839822673,
7.122626795704759,
3.896404418286093
],
[
0,
0,
9.4925265
]
] | [
55,
55,
55,
55,
57,
57,
57,
81,
16,
16,
16,
16,
16,
16,
16,
16
] | [
1,
1,
1
] | alex<agm004728655> | R-3m | Cs-La-S-Tl | 0.068854 | null | null | -0.000067 | 4,304.842776 | 35.393791 |
[
[
0,
0,
-3.4830279
],
[
0,
0,
0
],
[
-3.5978015775,
2.0771917092604855,
-2.457350650586502
],
[
-3.5978015775,
2.0771917092604855,
-4.508705149413498
],
[
-3.5978015775000003,
-2.0771917092604855,
-2.4573506505865024
],
[
-2.3985343... | [
[
-2.3985343850000005,
-4.154383418520971,
-5.874714914470231e-16
],
[
-2.3985343849999996,
4.154383418520971,
2.9373574572351156e-16
],
[
0,
0,
-6.9660558
]
] | [
59,
48,
1,
1,
1,
1,
1,
1,
46,
46,
46,
46
] | [
1,
1,
1
] | alex<agm004917489> | P6/mmm | Cd-H-Pd-Pr | 0.070742 | null | null | -0.000109 | 5,873.926281 | 82.710129 |
[
[
1.6540576299855951,
5.0102119748648075,
8.094247183146134
],
[
-1.6544969294749986e-8,
1.527942084504634,
7.000047614313475
],
[
-5.051018858610937e-12,
1.7568088880783574,
2.988830368146135
],
[
1.654057646525513,
5.23907877843853,
1.8946307993134757
... | [
[
3.30811526,
0,
2.0256363821847572e-16
],
[
-1.654057630019456,
6.7670208629431645,
4.265590803821625e-16
],
[
0,
0,
10.21083363
]
] | [
58,
58,
58,
58,
41,
41,
30,
30,
7,
7,
7,
7,
7,
7,
7,
7,
7,
7
] | [
1,
1,
1
] | alex<agm005161356> | Cmc2_1 | Ce-N-Nb-Zn | 0.075199 | null | null | -0.000143 | 3,628.900076 | 175.525757 |
[
[
1.9265303393778588,
0.915004137594867,
11.857310317319843
],
[
-1.8295980773671865e-8,
7.879967522009425,
5.473294687319844
],
[
1.9265303013725177,
5.18507140828303,
6.756695948834074
],
[
1.9709360589027754e-8,
3.6099002513212617,
0.3726803188340733
... | [
[
3.85306064,
0,
2.359319189848326e-16
],
[
-1.9265303189181218,
8.794971659604292,
5.513054860859886e-16
],
[
0,
0,
12.76803126
]
] | [
13,
13,
50,
50,
82,
82,
82,
82,
16,
16,
16,
16,
16,
16,
16,
16,
16,
16
] | [
1,
1,
1
] | alex<agm005155410> | Cmc2_1 | Al-Pb-S-Sn | 0.046425 | null | null | 0.000162 | 1,559.046022 | 31.410542 |
[
[
0,
0,
-4.78390747
],
[
0,
0,
0
],
[
-5.545336902442058,
-3.791531202733804,
-2.3941749012360742
],
[
-3.154861375412523,
-2.1570836101785895,
-7.935216798139564
],
[
-3.4816766258635514,
-4.719941629230224,
-8.2391517794154
],
[
-... | [
[
-2.3164662800950935,
-5.9486148129123935,
-0.38078837968781903
],
[
-6.383731997759488,
0,
-0.38078837968781903
],
[
0,
0,
-9.56781494
]
] | [
37,
23,
48,
48,
17,
17,
17,
17,
17,
17,
17,
17
] | [
1,
1,
1
] | alex<agm004912126> | C2/m | Cd-Cl-Rb-V | 0.054216 | null | null | 0.005395 | 2,176.786792 | 8.755078 |
[
[
-1.528475387577732e-16,
2.49618974,
1.528475387577732e-16
],
[
0,
0,
2.49618974
],
[
1.9729959849999998,
2.49618974,
2.4961897400000006
],
[
1.972995985,
0,
1.2081116088804148e-16
],
[
0,
0,
0
]
] | [
[
3.94599197,
0,
2.4162232177608295e-16
],
[
-3.056950775155464e-16,
4.99237948,
3.056950775155464e-16
],
[
0,
0,
4.99237948
]
] | [
67,
67,
49,
76,
6
] | [
1,
1,
1
] | alex<agm005013252> | P4/mmm | C-Ho-In-Os | 0.004747 | null | null | -0.000004 | 4,620.82697 | 108.445923 |
[
[
2.198970565,
0,
2.54688104632303
],
[
-1.3464811319232486e-16,
2.198970565,
7.738338323676971
],
[
2.198970565,
2.198970565,
5.142609685
],
[
0,
0,
5.142609685
],
[
2.198970565,
0,
8.910576556603724
],
[
-1.3464811319232486e-16,
... | [
[
4.39794113,
0,
2.6929622638464973e-16
],
[
-2.6929622638464973e-16,
4.39794113,
2.6929622638464973e-16
],
[
0,
0,
10.28521937
]
] | [
57,
57,
32,
33,
33,
33,
46,
46,
46,
46
] | [
1,
1,
1
] | alex<agm004512683> | P-4m2 | As-Ge-La-Pd | 0.024216 | null | null | 0.000088 | 5,298.982603 | 96.794846 |
[
[
2.233158305,
0,
2.5457373176322
],
[
-1.3674150851037892e-16,
2.233158305,
7.4896436823678
],
[
0,
0,
5.0176905
],
[
2.233158305,
0,
8.763022841015369
],
[
-1.3674150851037892e-16,
2.233158305,
1.27235815898463
],
[
2.233158305,
... | [
[
4.46631661,
0,
2.7348301702075784e-16
],
[
-2.7348301702075784e-16,
4.46631661,
2.7348301702075784e-16
],
[
0,
0,
10.035381
]
] | [
57,
57,
32,
32,
32,
33,
46,
46,
46,
46
] | [
1,
1,
1
] | alex<agm004512682> | P-4m2 | As-Ge-La-Pd | 0.072121 | null | null | 0.00019 | 4,998.720923 | 95.242607 |
[
[
-0.6397263050153975,
1.0828383133915789,
-6.60939747164319
],
[
-5.769831867920936,
-1.082838313391579,
-0.4717157081832501
],
[
-2.949629885845011,
2.154329253823098,
-3.052248084876327
],
[
-3.459928287091323,
-2.1543292538230974,
-4.028865094950114
... | [
[
-6.409558172936333,
0,
2.4700438101735624
],
[
-1.0023968769771654,
6.474335134429352,
-2.601136493568261
],
[
1.0023968769771654,
-6.474335134429352,
-6.9500204964317405
]
] | [
19,
19,
19,
19,
3,
3,
31,
31,
83,
83,
83,
83
] | [
1,
1,
1
] | alex<agm004755699> | Ibam | Bi-Ga-K-Li | 0 | null | null | 0.000013 | 5,642.956461 | 19.250677 |
[
[
2.860275480768144,
-5.169516253358806,
0.6270542798894497
],
[
0.9506651385003594,
-1.7323557645404695,
-7.721680805659479
],
[
-0.39366735180197976,
-8.606676742177143,
-1.721097037627824
],
[
1.2334499902147897,
-6.909333697659372,
-6.4853575783834065
... | [
[
5.163553174837911,
0,
-1.1810620769337976
],
[
0.5569977866983782,
-10.339032506717611,
2.435170636712697
],
[
-5.163553174837911,
0,
-10.696886403066204
]
] | [
55,
55,
55,
19,
19,
81,
53,
53,
53,
53,
53,
53
] | [
1,
1,
1
] | alex<agm004620313> | C2/m | Cs-I-K-Tl | 0.008851 | null | null | -0 | 5,502.5486 | 9.017251 |
[
[
0,
2.9106211838630607,
4.858904661952933e-16
],
[
4.440892098500626e-16,
5.821242367726123,
-8.360251269046145e-17
],
[
0,
0,
0
],
[
5.551115123125783e-16,
8.731863551589184,
2.9126565104231624e-16
]
] | [
[
1.3720799843831917,
3.880828245150748,
2.3765122450000002
],
[
1.3720799843831917,
3.880828245150748,
-2.3765122449999994
],
[
-2.744159968766383,
3.880828245150748,
0
]
] | [
3,
66,
72,
76
] | [
1,
1,
1
] | alex<agm001381683> | F-43m | Dy-Hf-Li-Os | 0.087636 | null | null | 0.000128 | 5,069.243591 | 100.833237 |
[
[
-1.733950659688261e-16,
2.831756325,
3.96687788
],
[
2.8055381997272097,
0,
0.005833759147923357
],
[
-1.733950659688261e-16,
2.831756325,
1.733950659688261e-16
],
[
2.8055381997272097,
0,
3.9727116391479234
],
[
2.7628008752231255,
3.0462962... | [
[
5.6110763994544195,
0,
0.011667518295846713
],
[
-3.467901319376522e-16,
5.66351265,
3.467901319376522e-16
],
[
0,
0,
7.93375576
]
] | [
28,
28,
44,
44,
82,
82,
82,
82,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8,
8
] | [
1,
1,
1
] | alex<agm004967283> | P2_1/c | Ni-O-Pb-Ru | 0.048865 | null | null | 0.000553 | 2,522.559992 | 95.190773 |
[
[
0,
0,
0
],
[
1.953483660618028,
2.407723737897539,
4.303268063965225
],
[
3.437277386387212,
1.2038618689487695,
1.0346652689652245
],
[
1.4837937257691836,
-1.203861868948769,
3.2686027949999996
],
[
0.5339157225173715,
0.6580661947973948,
... | [
[
1.0141037909203396,
-4.815447475795078,
2.2339375260347754
],
[
4.921071112156396,
0,
-2.2339375260347754
],
[
-1.0141037909203396,
4.815447475795078,
4.303268063965225
]
] | [
12,
25,
29,
29,
16,
16,
16,
16
] | [
1,
1,
1
] | alex<agm004872870> | I-42m | Cu-Mg-Mn-S | 0.080064 | null | null | 0.019388 | 1,284.953222 | 63.494053 |
[
[
-2.216650812861853e-18,
0.036200654987302,
5.43567816680501
],
[
-2.3875881497165e-16,
3.899227354987302,
4.76364133319499
],
[
2.406226005,
0.105515715670742,
9.122482384720454
],
[
-1.577440935701381e-16,
2.576156548646772,
8.754942359041525
],
[
... | [
[
4.81245201,
0,
2.9467769750483735e-16
],
[
-4.730843283175762e-16,
7.7260534,
4.730843283175762e-16
],
[
0,
0,
10.1993195
]
] | [
20,
20,
81,
81,
81,
81,
30,
30,
83,
83,
83,
83
] | [
1,
1,
1
] | alex<agm004739754> | Pmc2_1 | Bi-Ca-Tl-Zn | 0.027487 | null | null | -0.00006 | 5,738.102522 | 35.127056 |
[
[
0,
0,
0
],
[
-2.7268301679226825,
-1.6268585345132267,
-5.16642900277312
],
[
-0.6418292868729032,
-0.3829228036761718,
-5.809317239000438
],
[
-4.811831048972462,
-2.870794265350282,
-4.523540766545802
]
] | [
[
-1.7562274796977775,
-3.2537170690264534,
-0.8270086777731204
],
[
-3.697432856147587,
0,
-0.8270086777731204
],
[
0,
0,
-8.67884065
]
] | [
80,
77,
34,
34
] | [
1,
1,
1
] | alex<agm002783974> | R-3m | Hg-Ir-Se | 0.082951 | null | null | -0.0001 | 4,850.046756 | 51.916718 |
[
[
2.823806133296453,
3.990886972180884,
7.033106774785269
],
[
3.797926182954783,
1.393741441683371,
4.730315724319854
],
[
5.228106453120028,
1.560657976342509,
8.203662410279575
],
[
1.393625863131208,
3.823970437521746,
3.5597600888255476
],
[
4... | [
[
4.918752085930911,
0,
2.080716366207158
],
[
1.702980230320325,
5.384628413864255,
2.828455562897965
],
[
0,
0,
6.85425057
]
] | [
60,
60,
60,
60,
76,
76,
6,
6,
6,
6
] | [
1,
1,
1
] | alex<agm003397830> | C2/m | C-Nd-Os | 0.051599 | null | null | 0.00016 | 5,246.107793 | 131.012558 |
[
[
-3.4422041054702216e-16,
5.621545914898595,
2.452331869898596
],
[
-2.379547648562907e-16,
3.886096220101405,
5.621545914898595
],
[
-4.389637305518637e-17,
0.7168821751014046,
3.886096220101405
],
[
-1.501620187459179e-16,
2.4523318698985954,
0.71688217... | [
[
3.63570822,
0,
2.2262292171283606e-16
],
[
-3.8811678360220856e-16,
6.33842809,
3.8811678360220856e-16
],
[
0,
0,
6.33842809
]
] | [
4,
4,
4,
4,
41,
41,
41,
41,
50,
50
] | [
1,
1,
1
] | alex<agm002961198> | P4/mbm | Be-Nb-Sn | 0.065071 | null | null | 0.000045 | 5,881.887026 | 165.748459 |
[
[
-3.5797033295917736e-16,
5.846099188899366,
1.1583961188993663
],
[
-2.1610772304369478e-16,
3.529306951100634,
8.217010021100636
],
[
-5.031467510451309e-16,
8.217010021100634,
5.846099188899367
],
[
-7.093130495774128e-17,
1.1583961188993661,
3.5293069... | [
[
3.10035538,
0,
1.898420146168138e-16
],
[
-5.740780560028722e-16,
9.37540614,
5.740780560028722e-16
],
[
0,
0,
9.37540614
]
] | [
4,
4,
4,
4,
41,
41,
41,
41,
23,
23,
76,
76,
76,
76,
76,
76,
76,
76,
76,
76
] | [
1,
1,
1
] | alex<agm005143734> | P4/mbm | Be-Nb-Os-V | 0 | null | null | -0.000033 | 8,736.765704 | 264.179779 |
[
[
7.896177381264212e-16,
3.2415070458626642,
2.220446049250313e-16
],
[
2.220446049250313e-16,
9.724521137587995,
7.771561172376096e-16
],
[
7.833869276820154e-16,
6.483014091725331,
1.5024876676150717e-16
],
[
0,
0,
0
]
] | [
[
1.5280610755956425,
4.322009394483554,
2.6466794200000003
],
[
1.5280610755956425,
4.322009394483554,
-2.6466794199999994
],
[
-3.0561221511912846,
4.322009394483554,
0
]
] | [
58,
66,
81,
30
] | [
1,
1,
1
] | alex<agm001369025> | F-43m | Ce-Dy-Tl-Zn | 0.0677 | null | null | 0.007833 | 4,176.875405 | 53.831184 |
[
[
1.4216845079206397,
4.140321327468763,
1.8426243732407868
],
[
4.460819492079359,
1.3801071091562545,
3.0796002610802624
],
[
2.9412519999999995,
4.140321327468763,
-1.855463831759213
],
[
2.941252,
1.3801071091562545,
-0.6184879439197375
],
[
0,... | [
[
5.882504,
0,
3.601994847285751e-16
],
[
-3.3802875074174276e-16,
5.520428436625018,
-2.473951775678951
],
[
0,
0,
7.39617641
]
] | [
37,
37,
30,
30,
29,
29,
16,
16,
16,
16
] | [
1,
1,
1
] | alex<agm004995364> | Cmme | Cu-Rb-S-Zn | 0.025529 | null | null | 0.000034 | 2,859.540094 | 25.366896 |
[
[
2.5060759653598454,
0,
-0.5723198245225174
],
[
-2.232558795258949,
-5.0316392932143446,
-9.775935934532905
],
[
0.9247309047319751,
-1.7094772100238964,
-7.496718759978065
],
[
-0.37769656453018124,
-8.353801376404792,
-1.6538590981327779
],
[
1... | [
[
5.012151930719691,
0,
-1.1446396490450348
],
[
0.547034340201793,
-10.063278586428689,
2.3953558018891563
],
[
-5.012151930719691,
0,
-10.401294010954965
]
] | [
55,
19,
19,
19,
81,
81,
53,
53,
53,
53,
53,
53
] | [
1,
1,
1
] | alex<agm004620316> | C2/m | Cs-I-K-Tl | 0.009873 | null | null | -0 | 5,599.706071 | 9.4699 |
[
[
1.870078725492672,
6.05764055099304,
9.38115540724822
],
[
1.4857101848507868e-10,
1.8267524469481071,
7.9231393038318485
],
[
1.6770436161111566e-10,
2.0620062207237666,
3.6514248972482197
],
[
1.8700787255118054,
6.2928943247687,
2.1934087938318494
]... | [
[
3.74015745,
0,
2.290185924724813e-16
],
[
-1.8700787243396235,
8.119646771716807,
5.102012100734853e-16
],
[
0,
0,
11.45946102
]
] | [
65,
65,
65,
65,
72,
72,
29,
29,
16,
16,
16,
16,
16,
16,
16,
16,
16,
16
] | [
1,
1,
1
] | alex<agm005157771> | Cmc2_1 | Cu-Hf-S-Tb | 0.094374 | null | null | 0.000156 | 2,367.436089 | 51.762398 |
[
[
2.098906625,
1.6808188722766917,
1.1509507156850092
],
[
2.0989066249999997,
5.312280604847258,
4.000045570259913
],
[
-1.0790624264770268e-16,
1.7622426763836105,
5.17840829056004
],
[
-3.2029760189124105e-16,
5.230856800740339,
-0.02741200461511894
]... | [
[
4.19781325,
0,
2.570419280015424e-16
],
[
-4.282038445389437e-16,
6.99309947712395,
-2.3198197740550786
],
[
0,
0,
7.47081606
]
] | [
59,
59,
59,
59,
15,
77,
34,
34
] | [
1,
1,
1
] | alex<agm004822568> | P2/m | Ir-P-Pr-Se | 0.063918 | null | null | 0.000336 | 4,185.742157 | 69.781815 |
[
[
-1.0720351809940735e-16,
1.7507663135860334,
6.791501853586034
],
[
-5.101085463415231e-16,
8.330704766413966,
3.2899692264139673
],
[
-2.0145251412105792e-16,
3.289969226413967,
1.7507663135860334
],
[
-4.1585955031987264e-16,
6.791501853586033,
8.33070... | [
[
3.24375659,
0,
1.9862280625783166e-16
],
[
-6.173120644409305e-16,
10.08147108,
6.173120644409305e-16
],
[
0,
0,
10.08147108
]
] | [
65,
65,
65,
65,
73,
73,
14,
14,
14,
14,
44,
44,
44,
44,
44,
44,
44,
44,
44,
44
] | [
1,
1,
1
] | alex<agm005132672> | P4/mbm | Ru-Si-Ta-Tb | 0 | null | null | 0.000211 | 5,614.211136 | 165.927994 |
[
[
0,
0,
0
],
[
2.5078259169440726,
0.8679352976036016,
1.3777932492387457
],
[
0.9976428943373589,
-0.8679352976036012,
2.6818302949999997
],
[
2.3722989027743226,
-1.3025151879643315,
1.0134740031990277
],
[
1.1331699085071087,
1.3025151879643... | [
[
0.4851027660680039,
-3.471741190414405,
1.3040370457612542
],
[
3.505468811281432,
0,
-1.3040370457612542
],
[
-0.4851027660680039,
3.471741190414405,
4.059623544238746
]
] | [
40,
25,
27,
15,
15
] | [
1,
1,
1
] | alex<agm005022953> | I-4m2 | Co-Mn-P-Zr | 0.043926 | null | null | 0.0002 | 3,037.426919 | 180.134201 |
[
[
2.1461042327131494,
3.8752259952488366,
8.795306602500002
],
[
2.066006636658794e-8,
3.7586991660521827,
2.9317688675000007
],
[
0,
0,
5.863537735
],
[
0,
0,
0
],
[
-2.2975863992406703e-8,
7.108523391983793,
8.795306602500002
],
[
... | [
[
4.29220851,
0,
2.628219706522265e-16
],
[
-2.146104256626784,
7.633925161301019,
4.855634865487686e-16
],
[
0,
0,
11.72707547
]
] | [
19,
19,
20,
20,
49,
49,
34,
34,
34,
34,
34,
34
] | [
1,
1,
1
] | alex<agm005025675> | Cmcm | Ca-In-K-Se | 0.04211 | null | null | 0.000013 | 2,370.372891 | 20.628614 |
[
[
-4.633252320231327,
-2.7452069239354895,
-3.683393555335658
],
[
-3.006491430090129,
-1.781349367613128,
-11.883452703565576
],
[
-6.142504631005206,
-3.639440522095158,
-9.594842156725617
],
[
-1.4972391193162489,
-0.8871157694534597,
-5.972004102175616... | [
[
-2.4788771683882502,
-4.5265562915486175,
-1.0238335794506157
],
[
-5.160866581933205,
0,
-1.0238335794506157
],
[
0,
0,
-13.5191791
]
] | [
56,
56,
20,
20,
51,
51,
35,
35
] | [
1,
1,
1
] | alex<agm005216743> | R-3m | Ba-Br-Ca-Sb | 0.025015 | null | null | -0.000014 | 3,538.381403 | 19.309996 |
[
[
-1.5774350582253583e-16,
2.57614695,
1.5774350582253583e-16
],
[
0,
0,
2.57614695
],
[
2.221932165,
0,
1.3605410568948993e-16
],
[
2.221932165,
2.57614695,
2.5761469500000005
],
[
0,
0,
0
]
] | [
[
4.44386433,
0,
2.7210821137897987e-16
],
[
-3.1548701164507167e-16,
5.1522939,
3.1548701164507167e-16
],
[
0,
0,
5.1522939
]
] | [
60,
60,
12,
50,
6
] | [
1,
1,
1
] | alex<agm005012260> | P4/mmm | C-Mg-Nd-Sn | 0.070758 | null | null | 0.000049 | 2,485.614745 | 64.719711 |
[
[
2.3026696269965115,
1.3224149264014526,
8.300233209095646
],
[
-0.767357061911368,
4.231744282554136,
3.9603264040956465
],
[
-0.767357061911368,
4.231744282554136,
0.37958040090435424
],
[
2.3026696269965115,
1.3224149264014526,
4.719487205904354
],
... | [
[
3.06883516,
0,
1.8791195779024278e-16
],
[
-1.5335225949148563,
5.554159208955588,
3.5281931918244843e-16
],
[
0,
0,
8.67981361
]
] | [
73,
73,
73,
73,
73,
73,
77,
77,
7,
7
] | [
1,
1,
1
] | alex<agm002347192> | Cmcm | Ir-N-Ta | 0.04208 | null | null | -0.000007 | 5,823.011216 | 243.88501 |
[
[
2.18192565,
0,
2.18192565
],
[
-1.336044131625004e-16,
2.18192565,
2.18192565
],
[
2.18192565,
2.18192565,
2.672088263250008e-16
],
[
0,
0,
0
],
[
2.18192565,
2.18192565,
2.1819256500000006
]
] | [
[
4.3638513,
0,
2.672088263250008e-16
],
[
-2.672088263250008e-16,
4.3638513,
2.672088263250008e-16
],
[
0,
0,
4.3638513
]
] | [
72,
72,
72,
13,
1
] | [
1,
1,
1
] | alex<agm002374052> | Pm-3m | Al-H-Hf | 0.042339 | null | null | -0.000027 | 2,523.2459 | 137.608704 |
[
[
5.376679272318432,
1.8650828872131164,
2.686869068587165
],
[
0,
0,
0
],
[
4.337253186453271,
-3.7301657744262315,
1.2656560858542922e-16
],
[
2.168626593226635,
-1.865082887213116,
5.60580093
],
[
3.9053873997937827,
-4.990751872452513,
... | [
[
1.1292005073614737,
-7.460331548852463,
2.918931861412835
],
[
7.5453058655450675,
0,
-2.918931861412835
],
[
-1.1292005073614737,
7.460331548852463,
8.292669998587165
]
] | [
55,
19,
81,
81,
53,
53,
53,
53,
53,
53,
53,
53
] | [
1,
1,
1
] | alex<agm004898155> | I-4 | Cs-I-K-Tl | 0.058526 | null | null | 0 | 5,394.124092 | 6.137661 |
[
[
0,
0,
0
],
[
-5.026828450786164,
-3.076193786801567,
-8.306155635770484
],
[
-1.6634333854604024,
-1.0179467024205513,
-2.8093445105446895
],
[
-3.345130918123283,
-2.047070244611059,
-5.557750073157587
],
[
-2.533603763049415,
-1.55045198586... | [
[
-2.0924156466017205,
-4.094140489222118,
-1.3780344581575865
],
[
-4.597846189644845,
0,
-1.3780344581575865
],
[
0,
0,
-8.35943123
]
] | [
69,
12,
12,
21,
79,
79,
79,
79
] | [
1,
1,
1
] | alex<agm004803792> | R-3m | Au-Mg-Sc-Tm | 0.023847 | null | null | -0.000229 | 1,464.411784 | 79.78376 |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.