mp_ID
stringlengths
4
10
x
float64
-10.28
17.7
y
float64
-12.01
23.9
z
float64
-8.99
7.96
type
stringclasses
2 values
formula
stringlengths
2
26
n_atoms
int64
1
444
spacegroup
int64
1
230
volume
float64
5.61
20.1k
mp-1232125
-2.6927
-2.619511
-5.784584
other
Dy8Mg4S16
28
62
653.99
mp-1103293
-6.238603
-2.217672
5.348009
other
Zr4Si4Os4
12
62
194.44
mp-1202803
-3.670402
-2.156741
-3.688447
other
Pu8U4S20
32
62
708.92
mp-1200171
-3.559048
-1.083482
-5.204292
other
Cs12V4S16
32
62
1,117.38
mp-17361
-3.942921
-0.941339
-5.172538
other
Cs8W4S16
28
62
971.75
mp-754955
-5.779723
-2.811457
6.007723
other
Lu4Si4Ru4
12
62
203.88
mp-28642
8.639164
1.2108
1.678102
other
Ba24Al8F72
104
62
1,757.16
mp-1192424
3.379925
-0.659552
-2.503935
other
Sr4Ga4H20
28
62
364.69
mp-863384
10.134749
2.255412
1.706984
other
Li8V4F20
32
62
355.74
mp-22322
-7.85127
-5.903549
3.276074
other
Eu4In4Pd4
12
62
285.77
mp-22227
-5.666082
-2.167492
5.345957
other
Zr4Mn4Si4
12
62
196.01
mp-16264
-5.336303
-5.947805
0.702271
other
Li4Ca4Sb4
12
62
295.66
mp-29087
-5.540254
-5.775419
0.663491
other
Ba8Sn12Sb24
44
62
1,529.52
mp-1097023
5.996369
10.160076
-1.971588
other
K4Fe4O12
20
62
380.69
mp-1212634
-5.725569
-3.781264
-1.26421
other
Er4Te4As4
12
62
297.1
mp-616641
-1.262211
2.307342
-1.997009
other
K8U4I20
32
62
1,353.23
mp-1103150
-5.919152
-0.954613
2.357453
other
Mo4P4Rh4
12
62
162.87
mp-1105280
10.87194
11.829648
2.737533
other
Li4Ta4O12
20
62
214.73
mp-1188940
2.561797
3.00047
-3.982018
other
Ge4N4Cl12
20
62
706.4
mp-558046
9.45547
0.995899
1.539272
other
K4Mn4F12
20
62
290.88
mp-1211905
-4.803607
-6.240407
2.463222
other
K12Li4Ge16
32
62
941.6
mp-1194376
-2.642898
-2.735862
-5.557539
other
Ba4Sm8S16
28
62
758.48
mp-557794
0.402712
-0.045666
2.22778
other
Yb12Si4O4
20
62
403.12
mp-867175
-5.258873
-4.40654
0.415375
other
Sm4Ag4As8
16
62
342.35
mp-1246953
1.863743
2.214936
0.939945
other
Na4Cd4N4
12
62
188.33
mp-1209631
-6.337933
-5.377135
3.031317
other
Pr20Co4Sb8
32
62
961.43
mp-769734
8.955507
11.50725
1.157521
other
Sc4Fe4O12
20
62
212.22
mp-22982
-4.396335
-1.637522
-5.387209
other
Cu4Bi4S8
16
62
351.08
mp-12441
12.283501
7.690247
0.74182
other
Ca4Al8O16
28
62
271.68
mp-756205
10.299635
8.550441
1.466089
other
Sc4Bi4O12
20
62
268.23
mp-1245581
1.333204
2.172721
1.248949
other
Cs4Ni4N4
12
62
264.58
mp-1102352
-8.050213
-3.989474
4.712778
other
Ce4Al4Ir4
12
62
238.4
mp-555118
13.219387
5.878135
-6.703701
other
Na12P12O36
60
62
788.62
mp-1043868
6.584146
9.102247
-1.203611
other
Mg4Bi12O28
44
62
655.89
mp-14504
-5.827563
-2.121694
4.905283
other
Hf24Cr20Si28
72
62
1,097.18
mp-1232087
-2.704128
-2.669026
-5.759423
other
Pr8Mg4S16
28
62
782.59
mp-1190590
6.623116
6.556973
-3.899632
other
N4Cl4O16
24
62
387.66
mp-1214465
12.661211
6.767411
-6.653696
other
Bi4P20O56
80
62
1,025.73
mp-1223584
-3.990155
-1.929098
-5.207708
other
K4Bi12S20
36
62
1,212.18
mp-1245600
1.497103
1.777146
1.180228
other
Sr16Ir4N16
36
62
748.98
mp-754816
10.439413
1.869681
2.24219
other
Li4Fe4F12
20
62
225.32
mp-1191492
-2.792334
-2.944713
-3.708847
other
La8P8S8
24
62
559.56
mp-652036
-6.144363
-0.441382
1.941049
other
Gd4Fe20P12
36
62
461.11
mp-11623
9.584392
8.633614
2.306416
other
La4In4O12
20
62
281.89
mp-22106
6.627882
11.403061
0.824791
other
Nd4Ni4O12
20
62
220.61
mp-1193446
-5.175224
-2.411792
-3.860406
other
Mn8Sn4Se16
28
62
706.58
mp-1208505
-0.185884
0.655489
-2.700344
other
Tb16C8Br12
36
62
814.54
mp-1191162
2.345798
2.85601
-3.972947
other
Al4N4Cl16
24
62
801.01
mp-22774
12.115305
7.07091
-2.918164
other
Fe12B4O24
40
62
387.74
mp-28297
-1.859071
-1.229301
-4.706239
other
Nd12S8Br20
40
62
1,145.47
mp-1180187
8.710457
1.884689
-0.851123
other
Mn4N4F12
20
62
255.39
mp-1212997
-9.545449
-4.622712
3.822105
other
Dy4Cu20Sn4
28
62
432.32
mp-3952
9.601204
8.488408
3.176143
other
Ba4Y8O16
28
62
438.52
mp-1232098
-2.648332
-2.659455
-5.770361
other
Tb8Mg4S16
28
62
659.8
mp-1214471
6.213398
9.602026
-2.065958
other
Ba4Fe4O16
24
62
383.39
mp-20203
-5.333702
-2.19241
1.007929
other
Mn4Cu4P4
12
62
150.66
mp-16848
-3.076353
-1.164137
-5.503192
other
Tl12P4S16
32
62
887.92
mp-778245
9.71368
0.540993
-0.191925
other
Li16Fe4F32
52
62
537.37
mp-9138
12.963493
5.9274
-6.188376
other
Rb4P4O12
20
62
351.47
mp-1213788
10.969806
8.586287
2.615473
other
Ce4Tm4O12
20
62
293.94
mp-1203257
10.328095
10.084679
1.95913
other
La12Mo4O28
44
62
661.19
mp-1247157
2.171633
2.290216
0.986363
other
In16C4N16
36
62
725.91
mp-650598
10.536359
8.977915
0.734755
other
U8Pb24O48
80
62
1,454.08
mp-1212207
9.001922
11.316837
-0.809804
other
In4Rh4O12
20
62
243.51
mp-555631
9.421508
0.505256
0.646704
other
K8Fe8F32
48
62
714.47
mp-22487
7.958342
8.432017
0.101194
other
Eu4Sc4O12
20
62
261.33
mp-22051
-7.832728
-2.576624
5.318357
other
Lu4Ge4Ru4
12
62
213.32
mp-10569
-5.604193
-3.169377
5.738355
other
Yb4Si4Ir4
12
62
213.65
mp-1201545
1.201503
1.995655
-5.548156
other
K8La4Cl20
32
62
908.81
mp-669418
1.591541
1.828275
1.351181
other
Sr8Ni4N8
20
62
372.18
mp-1207913
1.007636
1.423012
2.750398
other
U4Nb4N8
16
62
205.17
mp-1187025
10.67937
8.503462
2.497806
other
Sm4Al4O12
20
62
214.39
mp-1193099
-4.173307
-4.281503
-3.77061
other
Ba4Y8Se16
28
62
818.82
mp-21404
9.697517
0.416508
0.448203
other
Na4Co4F12
20
62
230.6
mp-1103033
-7.323289
-5.482764
3.174673
other
Sr4Mg4Pt4
12
62
288.73
mp-1232291
-4.410283
-4.122327
-3.749263
other
Pm8Mg4Se16
28
62
785.79
mp-1209527
-8.142805
-5.304479
2.885196
other
Pr12Sn24Pd16
52
62
1,247.07
mp-21086
-5.364505
-0.804073
-4.279225
other
Fe8Ge4S16
28
62
443.54
mp-1213066
-7.457664
-5.923544
4.325366
other
Er4Ni4Pb4
12
62
245.81
mp-20460
9.546693
7.861106
-2.593863
other
Ni4Se4O12
20
62
217.56
mp-985442
-4.378253
-2.361855
-3.863431
other
Ag4As4Se4
12
62
318.45
mp-1190465
6.451093
12.140433
-1.507364
other
Ni8Cl4O12
24
62
301
mp-1198345
13.46095
8.08861
-1.342173
other
Fe20Si12O48
80
62
908.64
mp-23375
3.499681
2.806558
-4.286213
other
P12N12Cl24
48
62
1,328.34
mp-1219113
-3.470423
-2.064324
-5.396835
other
Sm4Bi4S12
20
62
485.93
mp-616439
1.373022
2.702699
-6.083413
other
Cs8Cu4Cl16
28
62
925.4
mp-1181041
-3.103487
0.559231
2.67441
other
Ho4W4C8
16
62
205.88
mp-1232400
-4.691085
-2.888456
-3.978411
other
Mg4In8Se16
28
62
770.67
mp-769310
11.405081
7.687327
-1.56172
other
Si4Bi8O20
32
62
471.3
mp-636950
11.074576
9.095427
-5.418957
other
Mo8P8O44
60
62
872.09
mp-22938
2.494591
2.978328
-4.368662
other
V4Cl12O4
20
62
536.82
mp-766925
10.003592
2.241747
0.6081
other
Li4V4F20
28
62
347.5
mp-1190048
-7.973118
-4.301287
3.327557
other
U4Ga4Pd8
16
62
301.43
mp-752555
9.487696
8.378489
2.921644
other
Sr4La8O16
28
62
485.26
mp-1201607
-4.448329
-5.536867
5.104142
other
Li28Cu4Si8
40
62
595.45
mp-1210192
-0.476628
1.249351
-4.34046
other
Na4Fe4Br16
24
62
775.74
mp-1209623
-1.299491
2.493035
-2.11633
other
Rb8U4I20
32
62
1,439.23
mp-1343472
6.324306
12.850928
-1.387441
other
Mg4Ni8O16
28
62
255.56
mp-28727
-2.896175
-2.511332
-5.508854
other
La16Bi8S36
60
62
1,502.94
mp-504877
-5.168705
0.786447
3.209636
other
Ho4B28Mo12
44
62
436.82