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-1191056
7.31837
6.742626
-3.260337
other
Cd4I4O16
24
62
380.33
mp-1201483
10.781275
7.031258
-1.908089
other
Rb4Si8O20
32
62
495.15
mp-1232158
-2.668221
-2.646128
-5.814572
other
Er8Mg4S16
28
62
650.82
mp-1190282
-7.182586
-4.441292
5.742525
other
Ho12Ni4Ge8
24
62
527.99
mp-21401
-8.283564
-5.187115
2.946481
other
Tb4Sn4Pd4
12
62
265.94
mp-15408
8.795929
1.030397
1.078651
other
K8Ga8F32
48
62
696.17
mp-21918
-6.69985
-1.533158
1.712341
other
Ba4Co40As24
68
62
996.09
mp-1193192
-4.644951
-3.564429
-3.66117
other
Ba4Yb8Se16
28
62
834.87
mp-1188832
-8.642378
-5.108722
3.424439
other
Nd4Ga4Pd8
16
62
306.8
mp-725444
4.151651
4.02422
-4.039617
other
Ce4Cl12O12
28
62
730.69
mp-1207493
-5.677644
-4.278972
4.564698
other
Yb4Si4Pd4
12
62
225.98
mp-1103314
-5.97013
-7.211056
2.98471
other
Sr4Mg4Pb4
12
62
365.86
mp-1232035
-3.254423
-1.977816
-5.404042
other
Eu8Mg4S16
28
62
703.78
mp-31120
10.320758
8.442077
3.243512
other
Dy4Sc4O12
20
62
250.41
mp-983608
-7.300817
-3.656756
3.209749
other
U4Ge4Pt4
12
62
240.78
mp-1193958
-4.225002
-0.402313
-4.017488
other
Nb8Fe4S16
28
62
477.08
mp-571440
-0.290423
1.489149
-4.531343
other
K8Cu4Br12
24
62
719.34
mp-1209802
-6.898739
-4.626116
5.642457
other
Pr12Ni4Ge8
24
62
606.28
mp-29371
-4.99951
-6.004587
0.459824
other
Rb16Ga8Sb16
40
62
1,581.46
mp-568831
-5.005871
-4.256625
5.935891
other
Pr8Sc12Si16
36
62
782.62
mp-17043
-2.694995
-2.75185
-5.836602
other
Tm8Zn4S16
28
62
644.52
mp-1232284
-4.352651
-4.206876
-3.808894
other
Tb8Mg4Se16
28
62
791.26
mp-555098
9.469641
6.95395
-3.394118
other
Sr4Se4O12
20
62
306.49
mp-1208300
-5.058673
-3.420828
0.955107
other
Tb4P4Pd4
12
62
216.67
mp-1345518
12.737956
10.605209
1.880422
other
Ca4Ti8O16
28
62
308.47
mp-16646
-8.51187
-5.154696
5.591756
other
Pr4Mg4Rh4
12
62
264.87
mp-567194
-5.862037
-2.257275
3.724731
other
Mn8Nb36Ge32
76
62
1,259.02
mp-680724
13.865826
4.266687
-2.157543
other
Lu16B48O96
160
62
1,424.88
mp-1102795
-8.305532
-4.676811
4.170313
other
Er4Zn4Pt4
12
62
226.67
mp-1178346
7.677346
8.632217
0.565433
other
Eu4Tm4O12
20
62
287.91
mp-21044
-8.029126
-3.50799
4.76975
other
Nd4Ge4Rh4
12
62
238.18
mp-1101822
-5.981361
-5.059457
0.58981
other
Eu4Sb4Pd4
12
62
286.61
mp-1193462
-7.736633
-4.424281
3.155868
other
Ce4Sn16Rh8
28
62
610.85
mp-554443
8.949999
6.842731
-3.604002
other
Na48Se16O72
136
62
1,903.85
mp-11080
-8.284025
-6.148328
3.083161
other
Yb4Mg4Au4
12
62
281.41
mp-772170
-1.220073
1.88222
-1.827429
other
Ca4La4I20
28
62
1,322.24
mp-1214346
1.329139
2.541456
-6.037443
other
Cs8Eu4Cl20
32
62
1,132.07
mp-1212862
1.131811
2.084457
-5.402539
other
Gd4In8Cl20
32
62
898.35
mp-1095501
-5.370649
-3.995945
5.079782
other
Tm4Si4Pt4
12
62
215.69
mp-772609
9.402643
8.854015
2.391024
other
La8Zn8O20
36
62
510.92
mp-1103105
-7.971022
-4.175023
3.562149
other
Ho4Ge4Pt4
12
62
228.79
mp-1044344
9.003359
11.698971
-2.639339
other
Zn4Cr12O28
44
62
554.71
mp-1004037
11.147414
10.674165
0.692443
other
Ca4Mn4O8
16
62
209.77
mp-1102504
-5.834613
-0.540484
2.804512
other
Co4P4W4
12
62
143.6
mp-1343733
7.56828
9.021485
-2.34289
other
Al4Ag4O12
20
62
237.68
mp-1192510
-4.745794
-4.854443
0.230937
other
Rb4Ge12As12
28
62
778.93
mp-3372
10.243382
4.420272
-6.717379
other
Rb8S4O16
28
62
483.83
mp-1213349
1.129556
1.993255
-5.474088
other
Cs4Gd8Cl28
40
62
1,226.81
mp-1103039
-3.701523
-5.631757
4.999012
other
Ba4Mg4Si4
12
62
340.53
mp-1185210
-5.708893
-3.910721
-1.090939
other
La4Sb4Te4
12
62
382.4
mp-556084
6.661671
5.791287
-3.414249
other
K4Cl4O12
20
62
370.21
mp-504835
-5.970159
-2.390048
1.609433
other
Nb4Ni4As8
16
62
248.33
mp-28496
1.380805
2.060271
-5.145058
other
K8U4Cl20
32
62
899.49
mp-1188282
-7.31074
0.707766
3.581139
other
Fe4Co8B4
16
62
148.81
mp-642642
-3.308884
-4.383979
0.68214
other
Ba8In20P20
48
62
1,311.59
mp-756979
-0.276001
2.393515
-4.221554
other
Rb12Cl4O4
20
62
654.55
mp-1191756
8.447618
8.203609
-3.257869
other
Fe4Si4O16
24
62
381.3
mp-756102
6.025074
12.795375
-1.942414
other
Mg4Co4O12
20
62
182.34
mp-7609
10.599944
9.146507
-0.995906
other
Sb4O4F4
12
62
198.17
mp-998746
-0.213476
1.129007
-4.504038
other
Tl4Ge4Br12
20
62
617.8
mp-1198185
-8.419724
-6.147766
2.329136
other
Ba4Ge8Au20
32
62
701.06
mp-4054
-7.51073
-3.741906
5.854931
other
Y4Al12Ni4
20
62
346.45
mp-617312
-5.134411
-4.417639
6.256925
other
Sm12Si8Ni4
24
62
557.4
mp-1211364
-7.473569
-4.688533
5.84228
other
La8Al8Ni8
24
62
477.12
mp-1197516
-4.056214
-4.02038
-3.632939
other
La8Hf4Se20
32
62
798.2
mp-1196661
-7.710787
-4.680078
3.212921
other
Er12Ni12Sn24
48
62
1,035.74
mp-669448
4.60757
2.353098
-3.062657
other
Ba4C16N24
44
62
807.87
mp-1189614
9.476363
8.60471
3.030829
other
Ba4Th4O12
20
62
367.76
mp-567224
-3.368248
1.774419
2.737633
other
Mg4Si8B48
60
62
563.36
mp-1210729
4.11856
4.038749
-4.083908
other
Nd4Cl12O12
28
62
717.95
mp-1246587
0.438489
2.571663
1.853293
other
Cd4Co8N8
20
62
243.46
mp-22709
-5.184311
0.302567
3.321844
other
Ta4Ni4B8
16
62
151.68
mp-1185576
-1.389198
2.760829
-2.374731
other
Cs4Yb4I12
20
62
933.6
mp-13025
-8.346257
-5.305669
3.275959
other
Yb4Zn4Pd4
12
62
237.7
mp-22705
7.121787
8.376078
-0.449736
other
Ba4Pr4O12
20
62
379.29
mp-1232044
-4.802172
-2.969616
-3.93201
other
Mg4In8Se16
28
62
763.19
mp-5013
8.514212
0.572374
1.507143
other
Cs8Be4F16
28
62
532.41
mp-541695
5.846965
3.513932
-4.540306
other
W4C24O24
52
62
927.29
mp-768309
11.454396
9.309821
2.496531
other
Ce8Ti4O20
32
62
479.92
mp-1201577
-3.893795
-4.090944
-3.420327
other
Nd8U4Se20
32
62
831.69
mp-1190170
-6.335351
-4.175077
4.320403
other
Sm4Si4Pd8
16
62
290.25
mp-759848
9.593951
8.210546
-0.738348
other
Bi16O20F8
44
62
712.64
mp-28425
14.305806
8.939701
-6.384676
other
V12P16O60
88
62
1,175.55
mp-567579
-6.15188
-3.789239
3.985104
other
Ce8Si16Pt28
52
62
907.99
mp-760803
9.823384
2.19764
0.492886
other
Li8V8F40
56
62
742.69
mp-1193100
-4.135965
-4.272028
-3.814072
other
Sr4Y8Se16
28
62
782.2
mp-1232227
-2.717082
-2.630849
-5.650638
other
La8Mg4S16
28
62
801.11
mp-10478
-6.085925
-2.915893
1.334123
other
Ce4As4Rh4
12
62
241.88
mp-765457
10.387087
0.918119
1.625796
other
Li4Mn4F12
20
62
258.94
mp-1096925
-1.306847
2.362951
-2.082048
other
Cs4Ba4I12
20
62
1,033.61
mp-540805
-3.092084
-1.627092
-5.484429
other
Ba8Ge4S16
28
62
777.93
mp-1378752
7.648626
13.589034
-1.713849
other
Al4Co4O12
20
62
171.35
mp-1103272
-5.576665
-2.678333
4.774471
other
Zr4Si4Ni4
12
62
178.14
mp-1102757
-8.27505
-4.550204
4.077849
other
Ho4Ga4Pt4
12
62
229.61
mp-616026
-3.318162
-4.625378
0.756218
other
Sr12In4P12
28
62
778.62
mp-1106185
-3.936855
-3.640415
-3.153372
other
U4Cr4Se12
20
62
454.95
mp-1102690
-6.156429
-0.856678
1.683586
other
Mn4Ni4P4
12
62
146.5
mp-772823
10.394357
9.285673
3.511201
other
Y8Hf4O20
32
62
436.06
mp-647218
12.239443
8.48924
-5.549708
other
Re8P8O44
60
62
769.22
mp-752762
10.33395
1.085547
1.550905
other
Li8Mn4F16
28
62
286.19