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-28007
-3.180393
-1.809053
-5.677401
other
Ba4Hg4S8
16
26
460.13
mp-765192
6.188319
10.172315
-1.855731
other
K24Fe12O42
78
26
1,517.89
mp-625393
8.467772
14.654581
-1.329769
other
Mn4H2O8
14
26
139.34
mp-1221673
-5.877825
-1.209024
1.77613
other
Mn2Cr2P4
8
26
95.17
mp-1194634
8.843985
2.360788
1.969329
other
Rb2U6F26
34
26
494.59
mp-1226273
-5.83465
0.223748
3.461717
other
Cr2B4Ru2
8
26
73.51
mp-1225187
-7.12571
0.462833
3.563081
other
Fe12Si2B2
16
26
175.53
mp-1215981
-8.133252
-5.172176
5.833605
other
Y2Er2Ni4
8
26
156.54
mp-1226245
-5.974123
-0.930791
1.982577
other
Cr2Fe2P4
8
26
95.41
mp-555463
8.442878
1.173952
1.72056
other
Rb2Th6F26
34
26
526.36
mp-1221923
-5.965303
-1.261075
1.373271
other
Mn4As2P2
8
26
106.08
mp-1216762
10.770043
12.173429
-3.58583
other
V4Cd6O16
26
26
384.85
mp-1217344
-5.952718
-4.939682
5.801475
other
Th4Si2Ge2
8
26
200.82
mp-1223412
-9.638817
-4.708083
4.127325
other
La2Ce2Cu24
28
26
415.1
mp-1225026
-7.267295
0.828593
3.57056
other
Fe12B2C2
16
26
154.44
mp-1221559
-6.02373
-1.759417
1.549101
other
Mn2V2As4
8
26
121.7
mp-1222164
-7.508726
-9.061643
3.841452
other
Mg8Hg2Au2
12
26
238.31
mp-763104
10.068121
0.699137
1.372105
other
Li4Mn2F8
14
26
252.22
mp-1226899
-5.371844
-4.394157
5.752237
other
Ce4Si2Ge2
8
26
200.19
mp-759764
11.374689
11.035308
-2.729809
other
W2O4F4
10
26
193.94
mp-1104707
-3.589962
-3.976801
0.519626
other
Na2Ge6P6
14
26
317.92
mp-1179263
10.934929
11.802696
2.168251
other
Ti4Cd4O12
20
26
256.35
mp-559677
9.135898
0.736981
0.359106
other
Rb4Cr4F20
28
26
424.92
mp-1346849
12.842368
10.596327
-0.152475
other
Zn4Mo4O10
18
26
261.18
mp-1224250
-0.369496
1.36931
-5.086484
other
Hg6S4Cl4
14
26
411.16
mp-604315
5.341492
-0.487044
-2.980398
other
Zn2B4H16
22
26
189
mp-1347236
12.841144
10.56519
-0.282643
other
Mg4Mo4O10
18
26
239.36
mp-1173327
-1.177538
2.174924
-3.320089
other
Sb2S2I4
8
26
367.1
mp-1198377
8.428707
1.135054
1.761393
other
Cs2Th6F26
34
26
534.96
mp-753938
11.811481
-0.517456
1.020684
other
Mn4O2F6
12
26
169.67
mp-755140
2.390806
2.134071
-3.897764
other
W2Br4O4
10
26
261.11
mp-777664
9.746367
1.387609
1.765648
other
Li4Fe2F8
14
26
242.06
mp-559283
11.862397
3.94815
-8.337396
other
Ti16S16O80
112
26
1,503.54
mp-1203481
11.150797
11.763803
2.570576
other
Nb8Ag8O24
40
26
514.85
mp-1215647
6.417037
8.719736
-2.542573
other
Zn4O6F2
12
26
148.09
mp-1216397
-5.989264
-1.718321
1.730051
original
V2Cr2As4
8
26
123.54
mp-1220148
-6.745078
-2.029335
1.548727
other
Ni2As4Rh6
12
26
171.91
mp-1226984
-7.660215
-5.573226
6.032638
other
La20Ga6Co14
40
26
964.15
mp-1225062
-5.474738
-4.43091
6.288002
other
Er4Al2Si2
8
26
181.7
mp-1221626
-6.025412
-0.772094
2.0204
other
Mn2Fe2P4
8
26
89.82
mp-1224999
-6.513724
0.79737
3.550662
other
Fe2Co2B4
8
26
62.92
mp-642653
8.088879
7.897577
-3.241443
other
Ba2H4O6
12
26
167.54
mp-1079106
2.89966
-0.219585
-1.633588
other
Ti2Fe2H4
8
26
61.4
mp-1216014
-3.150956
-2.810304
-3.809354
other
Zr2U6S12
20
26
403.85
mp-626791
13.962625
8.84929
-2.384868
other
V4H4O8
16
26
147.66
mp-685443
2.525128
2.697693
-4.46266
other
Sn4P16Cl96
116
26
3,331.53
mp-1337210
7.45998
8.933665
-2.248433
other
Zn4Ag4O10
18
26
254.61
mp-32539
2.796502
2.556795
-4.016773
other
W2Cl4O4
10
26
249.07
mp-1371279
10.943056
9.354714
0.173591
other
Zn4Sn4O10
18
26
253.37
mp-1217442
-8.0812
-5.319685
5.816986
other
Tb2Y2Ni4
8
26
160.07
mp-773090
10.979596
11.884462
2.705332
other
Nb24Cd4O64
92
26
1,245.33
mp-1173335
-1.24708
2.102183
-3.466568
other
Sb2S2I4
8
26
435.96
mp-1216354
-5.706069
-1.174933
2.138228
other
V2Cr2P4
8
26
103.64
mp-1194541
12.438315
7.264788
0.899674
other
Ba4Al16O28
48
26
670.63
mp-1216338
-6.210488
-1.742961
1.547514
other
V2Fe2As4
8
26
116.13
mp-731725
8.256448
8.125962
-1.921271
other
Pb12Cl4O12
28
26
669.36
mp-1224842
-4.608672
-2.754025
-4.081632
other
Ga2Sn2Se4
8
26
202.13
mp-1281528
7.890503
11.786191
2.23946
other
La4Mn4O12
20
26
250.3
mp-1220080
-7.849466
-2.917672
2.655785
original
Ni2Ge4Pd2
8
26
120.96
mp-1228880
-7.94658
-1.697177
2.51118
other
Al2Ni8Ge2
12
26
135.86
mp-1226189
-5.701735
-1.142559
2.18777
other
Cr2P4W2
8
26
106.3
mp-757224
13.984646
5.167166
-7.043931
other
Th8P12O46
66
26
954.43
mp-685813
2.477921
2.665142
-4.450774
other
Ti4P16Cl96
116
26
3,314
mp-580554
-0.340594
1.591532
-4.586843
other
Cs2Li6Br8
16
26
492.14
mp-1226254
-5.765448
-1.536505
1.937976
other
Cr2Mo2As4
8
26
128.01
mp-1221804
-5.954856
-0.883249
1.715613
other
Mn6Ni2P4
12
26
151.98
mp-1223099
-5.080167
-4.422972
6.105186
other
La2Ce2Si4
8
26
185.4
mp-1221680
-6.303227
0.567033
3.404418
other
Mn2Co2B4
8
26
63.47
mp-1100808
7.188837
8.702009
-1.212523
other
Zr8Pb4O24
36
26
573.95
mp-28339
-5.583046
-3.656194
1.110446
other
Ca4P4Pt4
12
26
237.51
mp-1079196
-3.439605
-1.567565
-5.104322
other
Sn2Pb2S4
8
26
612.87
mp-1218835
-4.414975
-2.927716
-3.829892
other
Sn2Ge2Se4
8
26
210.58
mp-757442
9.472602
8.756479
1.50631
other
Ca12In8O24
44
26
604.1
mp-1225002
-5.905507
-1.548475
1.862838
other
Fe2Mo2As4
8
26
122.7
mp-625184
10.792757
4.240711
-3.699082
other
Sr4H8O8
20
26
244.68
mp-1218951
-3.340955
-1.901334
-5.774429
other
Sn2Pb2S4
8
26
212.31
mp-1219513
-3.561651
-1.215048
-5.186363
other
Sb6As2S12
20
26
510.08
mp-1216407
-5.327549
0.478848
3.17033
other
V2B4Ru2
8
26
75.96
mp-1202871
8.8581
2.216613
1.672902
other
U6N2F26
34
26
493.5
mp-1224915
-7.797978
-1.7696
2.711756
other
Ga2Ni8Ge6
16
26
217.99
mp-1103795
-6.795452
-6.609386
3.891
other
Eu4Zn6Ge2
12
26
264.4
mp-1106390
5.424798
2.90413
-3.591568
other
C4S4N8
16
26
291.96
mp-1224707
-6.418098
-0.837147
2.138644
other
Fe4As2P2
8
26
98.99
mp-1221679
-6.029014
-1.047521
1.596919
other
Mn2Co2P4
8
26
93.65
mp-1080550
7.110897
7.780676
-3.461086
other
K2O4F2
8
26
134.41
mp-642654
7.947712
7.968623
-3.190218
other
Sr2H4O6
12
26
145.92
mp-27937
2.843843
2.549889
-4.05703
other
W2Cl4O4
10
26
251.08
mp-1218336
-5.974505
-7.270616
3.647753
other
Sr2Ca2Zn4
8
26
232.84
mp-1221600
-5.154091
0.560538
3.111986
other
Mn2Re2B4
8
26
74.68
mp-989407
0.92797
2.600694
1.873561
other
Y2W2N6
10
26
132.66
mp-1217034
-5.132393
-3.876041
0.12739
other
U8Te6Se6
20
26
581.08
mp-674395
8.52235
1.263283
0.951857
other
Tl10Sn2F18
30
26
591.67
mp-1238933
-3.39249
-1.631775
-5.720039
other
Ca4Sn4S12
20
26
475.4
mp-1225328
-8.631689
-5.526823
5.286674
other
Dy4Pd2Pt2
8
26
174.8
mp-28420
10.815969
3.897329
-3.912402
other
Sr2H8O6
16
26
148.55
mp-1222573
10.988772
11.77339
3.023369
other
Li2Ta12O30
44
26
599.75
mp-1225611
-8.827487
-5.623031
4.700105
other
Er4Pt2Au2
8
26
176.26
mp-1226361
-6.290541
-2.571892
0.882888
other
Cr4Sb2As2
8
26
145.36
mp-1227915
-9.512449
-4.678266
4.017335
other
Ce4Cu22Au2
28
26
421.93
mp-760378
12.384221
11.97229
1.8681
other
Li2Ti4O8
14
26
147.55