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-1204434
7.551532
8.183384
-3.510062
other
Fe2P6O24
32
167
494.96
mp-1178399
-0.199392
1.993422
-4.750046
other
Cs12Br8O2
22
167
957.12
mp-8568
8.144612
10.204492
1.178178
other
Ca8Pt2O12
22
167
283.19
mp-1192011
6.193114
11.271326
0.684813
other
Sr6Co4O12
22
167
284.91
mp-30904
-3.551739
-1.496528
-5.530842
other
Ba6Cr4S12
22
167
532.03
mp-1204618
-6.975959
1.470413
-4.151756
other
K4Mo30Se38
72
167
1,660.37
mp-13620
-5.569491
-2.851233
5.717236
other
Sc2Si14Ir6
22
167
325.98
mp-1246375
5.510699
2.384902
-2.867539
other
Ta4C6N12
22
167
251.46
mp-769391
9.202987
8.882889
2.68511
other
Ba8Zr2O12
22
167
420.06
mp-2920
10.538737
8.720437
2.375397
other
La2Al2O6
10
167
108.7
mp-1192769
1.482346
2.617178
-5.786775
other
Cs6Tl4Cl18
28
167
895.17
mp-29468
0.803085
2.281632
-5.274692
other
Rb12Cl8O2
22
167
732.97
mp-568627
-1.144851
2.701943
-2.435974
other
Rb8Tm2I12
22
167
1,013.21
mp-1199774
-6.912604
1.427591
-4.080549
other
In4Mo30Se38
72
167
1,626.61
mp-1182068
5.973326
10.416296
-0.992319
other
Ca12Co4O24
40
167
516.99
mp-768482
9.976703
4.730786
-6.890413
other
Bi4S6O24
34
167
581.48
mp-16627
-8.186688
-5.064546
4.323691
other
Tm2Al14Au6
22
167
388.03
mp-13241
-5.670527
-2.880707
5.591999
other
Mg2Si14Ir6
22
167
326.25
mp-1200403
11.036204
11.876178
2.670278
other
Nb8Ag4O22
34
167
430.7
mp-752938
10.462128
0.94121
1.694694
other
Li2Mn2F6
10
167
124.31
mp-669304
-0.373074
0.951263
-4.451543
other
Cs6Tb4Br18
28
167
1,067.64
mp-14406
-3.050735
0.755062
-3.75022
other
Ba4Re12S22
38
167
799.06
mp-1200386
-6.992798
1.46789
-4.155366
other
Mo30Pb4Se38
72
167
1,611.77
mp-3285
10.935263
11.871384
3.079362
other
Na4Ta8O22
34
167
409.67
mp-646102
1.339088
2.204206
-5.268315
other
Al6Bi10Cl24
40
167
1,227.8
mp-4531
6.291656
4.959501
-4.469537
other
Na2N2O6
10
167
120.01
mp-1182026
2.534704
2.690668
-3.814059
other
Cd2Br12N8
22
167
817.39
mp-643001
3.455327
-0.754392
-2.429363
other
Na8H12Ru2
22
167
267.36
mp-19339
6.718054
11.342037
1.001495
other
La2Ni2O6
10
167
112.44
mp-21434
8.487293
4.17215
-6.6238
other
Co2C2O6
10
167
92.16
mp-3889
13.576169
4.396994
-2.40109
other
Na6B6O12
24
167
255.33
mp-1199740
-6.882827
1.413371
-4.077078
other
Na4Mo30Se38
72
167
1,616.4
mp-26582
8.217287
7.831214
-4.11059
other
Fe4P6O24
34
167
490.1
mp-1199886
-6.905039
1.422241
-4.102737
other
Sn4Mo30Se38
72
167
1,605.34
mp-9039
7.930096
10.098122
1.219028
other
Sr8Ir2O12
22
167
327.22
mp-1191379
-7.872781
-2.713489
4.364699
other
Eu2Ge14Ir6
22
167
386.04
mp-3575
13.384938
4.762333
-1.684045
other
Ca6B4O12
22
167
253.63
mp-1203858
-6.077006
1.510719
-4.776133
other
Rb16Mo66S74
156
167
3,538.64
mp-8697
13.580641
4.585861
-1.484853
other
Sc2B2O6
10
167
100.67
mp-27172
1.433352
2.659477
-5.916615
other
Cs6In4Cl18
28
167
878.23
mp-754435
11.090816
8.275848
2.229998
other
Lu2Al2O6
10
167
100.5
mp-8727
8.221237
9.550354
1.34937
other
Ba8Pt2O12
22
167
392.12
mp-3953
8.642021
3.64936
-7.027295
other
Ca2C2O6
10
167
122.95
mp-674478
8.560438
3.661643
-6.999109
other
Ba2C2O6
10
167
177.22
mp-753176
8.028114
4.839981
-6.161044
other
Ag2C2O6
10
167
113.35
mp-780275
9.154773
7.309304
-4.154663
other
Ag2B2O6
10
167
109.94
mp-1191197
-8.548571
-6.399491
2.565025
other
Sr4Ga6Au12
22
167
473.29
mp-780683
9.600793
10.030105
-0.965713
other
Na4Sb8O22
34
167
416.06
mp-8110
13.633616
4.671731
-2.327331
other
Al2B2O6
10
167
81.47
mp-19097
12.452261
5.767595
-3.384093
other
Fe2B2O6
10
167
90.19
mp-768501
8.288453
6.405325
-5.794459
other
Co4S6O24
34
167
447.7
mp-1196108
-3.238328
-4.344818
0.778527
other
Ba18Ga18P30
66
167
1,821.67
mp-19357
10.056813
11.044158
1.965273
other
La2Cr2O6
10
167
117.86
mp-998624
8.556836
10.944363
0.231191
other
Na2Os2O6
10
167
109.94
mp-768978
12.061007
3.716556
-7.933278
other
Ho4S6O24
34
167
567.32
mp-15013
-3.073519
-0.897779
-5.470691
other
Rb6B6S12
24
167
662.54
mp-23347
-1.212527
2.826905
-2.570061
other
Rb8Yb2I12
22
167
1,063.14
mp-620609
-4.554474
-3.032786
-3.54465
other
Ba30Zr28Se84
142
167
4,240.45
mp-1191938
3.322987
3.155127
-3.867294
other
Cd2N8Cl12
22
167
625.82
mp-554262
7.571782
10.260568
0.822001
other
Ba18Rh16O48
82
167
1,287.91
mp-28315
-0.394426
1.499749
-4.661166
other
Rb8Cd2Br12
22
167
811.31
mp-29347
7.539116
5.857628
-3.547768
other
K12W6O48
66
167
1,077.32
mp-7560
13.512984
4.58825
-1.360386
other
Lu2B2O6
10
167
109.98
mp-579861
-5.99669
1.485277
-4.745805
other
Rb8Mo42S50
100
167
2,189.91
mp-1181997
3.250024
3.111028
-3.880403
other
Cd2N8Cl12
22
167
739.76
mp-605088
7.894918
0.324101
-4.426464
other
Ga6H114C48
168
167
1,607.32
mp-705042
5.714976
3.390793
-4.681773
other
Co12C40O36
88
167
1,401.92
mp-989455
0.805976
2.620322
1.86143
other
La2W2N6
10
167
128.94
mp-782050
7.947276
9.600729
1.089592
other
Ba8Pd2O12
22
167
390.55
mp-637194
1.265057
2.335651
-5.910961
other
Cs6Sc4Cl18
28
167
860.63
mp-3919
13.644327
4.461411
-2.09417
other
K6B6O12
24
167
338.75
mp-1195519
-6.977447
1.460382
-4.150357
other
Rb4Mo30Se38
72
167
1,675.3
mp-1105647
-4.104156
-0.831269
-2.544698
other
Te12Ir2Cl6
20
167
608.84
mp-5709
11.728681
7.265347
-3.716862
other
Tl6P2O8
16
173
316.85
mp-1226956
12.019294
6.413437
-6.067449
other
Cd10P6O26
42
173
530.25
mp-1246918
0.780106
2.67738
1.825913
other
B2W8N18
28
173
308.72
mp-541587
-4.126554
-3.563005
-3.049135
other
U6Cu4Se14
24
173
542.13
mp-625733
11.132279
4.255825
-3.312573
other
La2H6O6
14
173
140.93
mp-1196427
7.779528
8.309906
-2.274632
other
Mg14Si4O28
46
173
528.08
mp-23069
7.541528
6.599409
-3.170666
other
Fe2I6O18
26
173
385.18
mp-619067
-3.077173
-2.325428
-4.494054
other
U6Cu4S14
24
173
473.62
mp-1210042
11.940582
7.704718
0.672582
other
Nd10Si6O26
42
173
577.12
mp-1228877
11.117164
7.656785
0.6989
other
Ba8Ga16O32
56
173
919.51
mp-561104
7.585232
6.591778
-3.130607
other
Ga2I6O18
26
173
378.61
mp-13335
13.60729
4.265253
-2.447221
other
Cd8B16O32
56
173
507.06
mp-1211125
-2.749046
-2.690453
-5.667159
other
Nd8Co2S14
24
173
567.29
mp-5492
12.355666
7.250028
0.968815
other
Sr6Al12O24
42
173
573.84
mp-1191612
-2.629234
-2.678123
-5.576279
other
La8Cr2S14
24
173
611.22
mp-1204451
12.97242
5.581711
-5.760086
other
Ba10P6O26
42
173
723.04
mp-1209414
-2.778546
-2.710299
-5.585827
other
Sm8Mn2S14
24
173
571.9
mp-1211918
-2.98586
-2.434685
-5.787889
other
La6Cu4S14
24
173
533.79
mp-22955
7.793742
6.662841
-2.962014
other
Li2I2O6
10
173
131.05
mp-1663141
11.945426
13.240791
-1.659205
other
Ca4V6O16
26
173
336.54
mp-1196065
7.514864
6.519759
-2.870265
other
Cs4I8O22
34
173
634.02
mp-1198361
1.212474
2.219812
-4.955242
other
Al12Bi48Cl48
108
173
3,947.48
mp-567718
-0.403397
0.806061
-3.91103
other
K6Ti6Br18
30
173
921.94
mp-1227239
12.648412
5.555698
-6.388916
other
Ca10P6O26
42
173
544.73
mp-23400
7.578917
6.580838
-3.071549
other
In2I6O18
26
173
417.91
mp-1212414
7.692051
8.058731
-3.705336
other
In2P6O24
32
173
493.34
mp-4202
12.230183
7.23536
0.937883
other
Ba8Al16O32
56
173
837.67