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-1188948
-8.218327
-4.832595
3.244935
other
Ce4Ge4Pd8
16
62
311.45
mp-4355
12.037178
9.876159
2.294163
other
Y4Ti4O12
20
62
235.5
mp-8983
-5.256479
-4.217671
4.799464
other
Ca4Si4Pt4
12
62
227.74
mp-1102763
-8.604104
-5.652107
3.923733
other
La4Zn4Pd4
12
62
265.29
mp-1101421
5.83181
11.330988
-0.537784
other
Sr4Ni4O12
20
62
236.19
mp-1349418
12.788303
10.575929
-0.633363
other
Mg4Mo12O28
44
62
632.91
mp-1200507
-5.728967
-1.241794
1.303396
other
Hf8Ni12P12
32
62
434.96
mp-505669
8.342684
10.42871
1.946124
other
La8Co8O20
36
62
503.98
mp-1095522
-8.840594
-5.618638
4.04654
other
Y4Zn4Pd4
12
62
233.37
mp-1188183
-6.739859
-4.814503
5.321502
other
Li4Sm4Ge8
16
62
321.95
mp-765512
9.650348
0.495259
-0.313139
other
Li8Cu4F20
32
62
364.85
mp-9228
9.636675
7.46673
-3.33701
other
Hg4Se4O12
20
62
305.01
mp-756190
11.314066
8.264099
-0.582853
other
Cd4Ga8O16
28
62
299.71
mp-1102228
-8.245358
-5.112628
3.313971
other
Yb4Ga4Pd4
12
62
239.64
mp-3797
-3.29069
-1.263516
-5.30387
other
K12As4S16
32
62
909.65
mp-29237
-4.552494
-3.06966
-3.947594
other
Tl16Sn8Se24
48
62
1,465.68
mp-1207689
7.485848
8.552954
-2.620779
other
Y4Cl4O8
16
62
268.58
mp-505434
10.783699
11.316382
3.268864
other
Eu4Ta8O24
36
62
468.51
mp-1232264
-2.623061
-2.638771
-5.691793
other
Pm8Mg4S16
28
62
708.35
mp-1200971
-6.255124
-3.162468
3.929889
other
Sc8Nb12Ge16
36
62
638.41
mp-21371
-6.548679
-1.068105
3.688029
other
V4Co4Si4
12
62
141.2
mp-768208
-3.575307
-1.254343
-5.509787
other
Li12Sb4S16
32
62
670.61
mp-15641
-5.833112
-6.282243
3.662496
other
Ca4Mg4Ge4
12
62
277.72
mp-504712
12.892374
12.126021
-0.303968
other
Ca4V8O16
28
62
294.68
mp-10469
-5.915112
-3.218529
4.164474
other
Nb4Si4Pt4
12
62
183.26
mp-21710
-8.047574
-6.311827
3.02242
other
Ca12Ge12Au12
36
62
758.15
mp-680181
-3.631016
-2.0549
-5.398902
other
Bi16Pb16S40
72
62
1,967.36
mp-1105271
8.72185
10.888949
0.059613
other
Mn4Bi4O12
20
62
249.34
mp-540593
11.353963
12.607878
0.104581
other
Ca4Cr8O16
28
62
288.13
mp-1195333
-4.123014
-4.052119
-3.686209
other
Nd8Zr4Se20
32
62
788.79
mp-1189519
-8.500337
-5.31413
3.27067
other
U4Al4Au8
16
62
329.33
mp-850864
10.204019
9.623761
3.366223
other
Ho8Ti4O20
32
62
417.45
mp-1211415
8.429942
1.170672
1.833445
other
K4Gd4F16
24
62
343.78
mp-653454
1.332309
2.433895
-5.804343
other
K8Zn4Cl16
28
62
801.36
mp-1106224
11.968701
13.197913
-1.39838
other
Mn4V4O12
20
62
209.75
mp-1006368
-4.074225
-4.029291
-3.401973
other
Ce8Sn4Se16
28
62
808.36
mp-1102879
-5.462544
-3.871714
4.96955
other
Er4Si4Pt4
12
62
217.53
mp-17071
7.89144
10.15707
-3.604956
other
Rb8Cr4O16
28
62
517.39
mp-555735
7.871565
10.811557
0.151756
other
Ca4Ir4O12
20
62
228.69
mp-30194
8.731245
9.616716
-0.250617
other
Rb12Co4O8
24
62
584.21
mp-1232061
-4.275675
-4.216105
-3.832333
other
Sm8Mg4Se16
28
62
792.92
mp-1212778
9.699533
8.500187
2.170456
other
Gd4In4O12
20
62
273.14
mp-1187172
6.965345
1.289317
-3.839915
other
Sr4H4N4
12
62
166.94
mp-1349550
5.843739
11.395012
-1.293042
other
Y8Ni12O36
56
62
618.78
mp-867973
7.234854
8.353506
-3.012155
other
Zn12P8O48
68
62
876.7
mp-1105686
-6.603206
-4.170902
4.217589
other
Ho4Si4Pd8
16
62
277.14
mp-1208028
-7.050559
-4.622418
5.646237
other
Tm16Mg4Ge16
36
62
789.58
mp-28433
6.611884
5.782406
-3.337257
other
Rb4Cl4O16
24
62
394.76
mp-1189264
-3.106315
-2.247022
-4.346924
other
U4Ni4S12
20
62
349.68
mp-1212983
-6.975402
-4.333328
5.459734
other
Er16Mg4Ge16
36
62
800.34
mp-510763
10.088504
9.221613
-5.457494
other
V4As4O20
28
62
359.98
mp-29454
9.265031
8.80458
-0.014717
other
Na12Tl4O8
24
62
406.02
mp-1102464
-8.211819
-4.662357
4.022224
other
Sm4Ga4Pt4
12
62
242.51
mp-4500
-5.270455
-2.578754
2.609938
other
Zr4Nb4P4
12
62
206.27
mp-1179404
-5.259753
-4.392738
0.421799
other
Sm4Ag4As8
16
62
333.73
mp-1211602
-6.927329
-4.520034
5.604836
other
Li4Lu16Ge16
36
62
748.17
mp-29344
1.497683
2.336659
-5.338885
other
Li8Ga8Cl24
40
62
894.68
mp-29372
-4.87671
-6.026148
0.511389
other
Cs16Ga8Sb16
40
62
1,741.5
mp-1345720
10.790891
9.527167
0.149902
other
Ca4Sb8O16
28
62
438.3
mp-1379601
7.003372
13.729135
-1.720359
other
Mg4Co8O16
28
62
246.33
mp-1211842
1.413676
2.464922
-5.686149
other
K8Pb4Cl20
32
62
934.63
mp-752715
8.022676
8.876205
0.572233
other
Ba12Cl8O8
28
62
910.87
mp-1232031
-2.721824
-2.603124
-5.80122
other
Y8Mg4S16
28
62
656.34
mp-1193382
-8.208953
-3.556743
3.178801
other
Zn12Sn8Ru8
28
62
486.31
mp-23526
6.63666
5.85092
-3.406312
other
K4Cl4O16
24
62
353.53
mp-998427
-4.621163
-2.988345
-3.557175
other
Ba4Zr4Se12
20
62
561.81
mp-558159
10.25787
11.39126
2.997054
other
Ba4Ti8O20
32
62
443.42
mp-1209051
-3.902384
-3.869692
-2.938916
other
Sm4U8Se20
32
62
801.67
mp-1232065
-4.348301
-4.203295
-3.84882
other
Dy8Mg4Se16
28
62
782.53
mp-608106
-2.485703
-0.892826
-4.477654
other
P16S12I8
36
62
1,070.52
mp-573119
8.941353
10.334291
-0.342438
other
Bi4Rh4O12
20
62
251.65
mp-1214000
1.275256
2.404894
-6.036646
other
Cs8Er4Cl20
32
62
1,084.35
mp-998609
8.275054
1.151585
-0.129979
other
Cs4Na4F12
20
62
395.25
mp-770684
9.987014
13.851624
-0.9458
other
Li4Cr8O16
28
62
273.91
mp-559385
9.835636
8.284369
3.279864
other
Sr4Ho8O16
28
62
402.97
mp-1245783
1.579619
1.970783
1.342612
other
Ca16Pt4N16
36
62
668.04
mp-559851
10.442599
10.539407
0.355173
other
Cr4Bi4O12
20
62
231.94
mp-1191090
-8.416336
-4.666585
2.171607
other
Sr4B4Pd16
24
62
412.45
mp-760235
7.749375
11.081871
-0.533362
other
Na12Co8O16
36
62
489.7
mp-1202575
-5.918655
-3.025932
4.089834
other
Ho8Nb12Ge16
36
62
675.25
mp-616327
-6.049289
-3.290142
-2.278305
other
In12Te12I4
28
62
1,075.27
mp-1211143
-3.425937
-4.422221
0.85322
other
Li4Eu4P4
12
62
244.45
mp-504536
-4.79123
-1.378167
-5.92168
other
Cu16Sn4S16
36
62
670.87
mp-16252
-5.42884
-6.753762
3.699519
other
Ba4Ca4Ge4
12
62
403.45
mp-29002
-3.986987
-5.304968
5.391403
other
Sr8Mg8Si16
32
62
729.16
mp-1102212
-8.550331
-5.129265
4.128936
other
Sm4Al4Pd4
12
62
246.9
mp-1246666
1.538176
1.779799
1.463719
other
Sr16Cr4N16
36
62
727.12
mp-1238809
-5.655807
-0.317594
-5.699383
other
Cr8Cu4S16
28
62
454.9
mp-20562
-8.410689
-5.786749
3.489057
other
Ce4Ge4Au4
12
62
258.8
mp-672186
-2.41711
-0.360983
-4.502323
other
Te4S28Cl8
40
62
1,136.36
mp-1095261
-7.991161
-2.47278
4.911179
other
Sc4Co4Ge4
12
62
182.21
mp-1101855
-8.270391
-4.634884
5.494972
other
Tm4Ga4Ni4
12
62
204.42
mp-1208915
-4.988786
-4.239326
5.980679
other
Sm8Sc12Si16
36
62
757.32
mp-4535
10.514023
8.421657
1.633008
other
Pr4Ga4O12
20
62
242.18
mp-1019530
13.119063
5.700757
-5.937659
other
Ba8P8O28
44
62
752.89
mp-1214984
8.305463
4.43703
-4.666403
other
Ba4S16O32
52
62
1,059.94
mp-1232286
-4.281475
-4.216968
-3.800518
other
Tb8Mg4Se16
28
62
758.78
mp-645340
13.816638
4.243129
-2.118138
other
Nd16B48O96
160
62
1,550.61
mp-1219055
-2.768368
-2.735173
-5.384501
other
Sm4Gd4S12
20
62
451.62
mp-3446
9.94942
8.338751
3.172127
other
Sr4Tm8O16
28
62
391.95