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-1205276
3.788672
3.497501
-3.905033
other
Ru4N24Cl12O8
48
33
1,200.17
mp-1219788
10.418504
11.180761
3.253798
other
Pr4Ta4Ti4O24
36
33
456.38
mp-765243
13.568813
7.885759
-0.683197
other
Li16Ti8Si16O52
92
33
995.86
mp-1220116
10.387235
11.180164
3.26042
other
Nd4Ta4Ti4O24
36
33
452.03
mp-561159
13.64425
8.732033
-6.915753
other
K8V12P16O68
104
33
1,524.77
mp-1211814
14.455015
7.888934
-4.181046
other
K8Nb8P8O40
64
33
992.79
mp-765841
13.977031
12.488214
-0.718108
other
Li4V8O12F4
28
33
300.17
mp-541956
11.828272
7.422611
-4.188961
other
Cs8Ti8As8O40
64
33
1,034.32
mp-857349
14.446199
7.295355
-6.976104
other
Li4Mn4P4O16
28
33
385.72
mp-769242
10.993563
3.940662
-3.948636
other
Li8Cu4H16O16
44
33
343.63
mp-1196301
10.670192
7.686715
2.898759
other
La16Mn8Se16O16
56
33
1,197.52
mp-542426
-1.187515
1.657104
-4.655365
other
Cu4Hg4S4I4
16
33
434.8
mp-757682
12.152801
7.492124
-7.468303
other
Li8Ni8P8O32
56
33
645.66
mp-768869
15.233375
7.010283
-2.064164
other
Li8V4B4O16
32
33
307.61
mp-644325
11.933011
6.959845
-1.933431
other
Cs4Fe4Si4O16
28
33
510.3
mp-1213687
12.587637
6.52926
-6.676908
other
Cs4Co4P4O16
28
33
497.22
mp-1204665
6.886951
3.615743
-5.01758
other
Re8C12Cl12O24
56
33
1,121.52
mp-733468
12.53091
5.367526
-5.726294
other
K24P12H12O48
96
33
1,445.82
mp-22694
12.56152
6.300215
-5.576488
other
Li8P8Pb8O32
56
33
731.43
mp-1019891
13.523938
7.008037
-5.316305
other
K12P12S12O24
60
33
1,288.74
mp-1216957
11.245796
8.260506
-1.849237
other
Tl8Ge8Sb8O40
64
33
1,009.37
mp-1203786
8.858412
1.226492
-4.068678
other
Be4H48N16Cl8
76
33
762.84
mp-14401
13.449841
5.107769
-6.475513
other
Na12Ca12P12O48
84
33
1,042.03
mp-14383
13.038477
5.394799
-6.818455
other
K8Ge8P8O40
64
33
835.28
mp-26465
14.031654
8.815815
-6.88028
other
Li4V4P4O20
32
33
347.12
mp-24610
12.084216
5.068232
-5.428877
other
Li4P4H8O16
32
33
341.07
mp-510057
10.840295
8.370407
2.759163
other
Gd12Nb4S12O16
44
33
731.55
mp-765022
14.817556
8.580494
-3.802738
other
Li12V12P12O48
84
33
892.74
mp-1198841
9.88445
8.959731
-0.322469
other
Nb4Bi16Br4O32
56
33
940.71
mp-1213381
8.1122
1.945312
-4.594614
other
H40C8N48Cl8
104
33
1,139.75
mp-1229323
11.235311
8.292411
2.69657
other
Ce12Si4Cl20O16
52
33
982.92
mp-1209645
13.482663
4.633049
-1.370536
other
Sr12Ho8B16O48
84
33
1,048.5
mp-559900
3.175746
2.79629
-3.947396
other
C4S12Br16N8
40
33
1,097.58
mp-697592
11.936013
4.730746
-5.10694
other
Be4P4H12O20
40
33
402.61
mp-766449
13.506566
8.246115
-0.624913
other
Li12Ti4Si4O20
40
33
432.99
mp-765289
14.035101
7.12837
-5.278969
other
Li4Sn4P4O16
28
33
421.82
mp-568031
0.907169
2.131902
-5.15459
other
Ga8Hg16Sb8Cl32
64
33
2,026.1
mp-770553
7.90144
12.409922
-1.41722
other
Li8Al4Co4O16
32
33
343.92
mp-555206
7.975898
10.216668
-3.765164
other
K8Li8Cr8O32
56
33
885.5
mp-757038
12.053694
7.081522
-1.123268
other
Li4Si4Bi4O16
28
33
356.81
mp-1203002
7.956991
11.729952
-0.536274
other
Ba4Tm4Co16O28
52
33
721.01
mp-734141
4.438907
2.987282
-3.684496
other
Cu4C8S8N16
36
33
734.96
mp-859095
14.431721
7.367898
-6.956363
other
Li4Mn4P4O16
28
33
370.56
mp-757880
12.540078
7.66007
-7.373554
other
Li4Co4P4O16
28
33
362.73
mp-26919
12.774534
7.637754
-7.370887
other
Li4Co4P4O16
28
33
339.65
mp-762880
9.975018
7.824966
-3.039018
other
Li4Co4Si4O16
28
33
345.95
mp-6057
-2.560592
-0.6937
-5.447699
other
Tl4Sn4P4S16
28
33
744.73
mp-758459
14.651537
7.785935
-5.930313
other
Li4Fe4P4O16
28
33
326.98
mp-17709
12.305745
6.207865
-0.851824
other
Na8Zn4Si4O16
32
33
397.01
mp-559689
12.69453
6.512985
-0.333459
other
Li4Al4Si4O16
28
33
336.81
mp-758055
12.390147
7.461315
-7.454426
other
Li4Ni4P4O16
28
33
286.71
mp-26791
14.782836
7.817067
-5.536592
other
Li4Fe4P4O16
28
33
350.23
mp-758245
12.336884
7.22126
-0.94678
other
Li12Si4Bi4O20
40
33
484.25
mp-1209532
13.495051
4.625056
-1.431722
other
Sr12Tb8B16O48
84
33
1,061.49
mp-1194771
5.395152
-0.398164
-3.043762
other
Rb4Sr4B12H48
68
33
907.19
mp-6765
12.275954
7.357137
-0.390329
other
Li12Al4Ge4O20
40
33
432.17
mp-771078
11.06256
7.188289
-3.318778
other
Li12Fe4B4O20
40
33
376.38
mp-758708
11.687878
7.410542
-2.237126
other
Li8Cu4Si4O16
32
33
336.92
mp-776397
14.853241
7.710953
-6.003357
other
Li4Mn8P4O20
36
33
437
mp-1200814
9.268564
1.604396
-3.990863
other
B4H48N16F12
80
33
802.06
mp-583606
8.670284
2.050546
-4.538673
other
H36C8N12O12
68
33
641.93
mp-857363
14.422389
7.239582
-7.081408
other
Li4Mn4P4O16
28
33
372.19
mp-770586
10.43486
12.426811
-0.964341
other
Li12Al4Cr4O20
40
33
432.69
mp-562194
13.047118
6.930538
-6.838748
other
Na16Co8P16O56
96
33
1,273.63
mp-667389
5.63798
3.293521
-4.718584
other
Os24C68S4O68
164
33
2,747.86
mp-1209324
13.043634
5.43518
-6.239676
other
Rb4Be4P4O16
28
33
382.69
mp-557947
10.877725
9.097709
-5.890903
other
K8V16P8O64
96
33
1,388.06
mp-1222878
10.315034
11.133719
3.251773
other
La4Ta4Ti4O24
36
33
453
mp-555396
13.463751
5.576433
-6.197156
other
Mg8P4Cl4O16
32
33
431.34
mp-720615
8.08451
4.949272
-3.9816
other
H32N8Cl8O40
88
33
891.73
mp-572951
12.589515
6.415675
-0.625338
other
Cs8Na8Si16O40
72
33
1,176.92
mp-1204433
9.62476
7.443179
-2.44565
other
Li4Al4Ge4O20
32
33
466.46
mp-755784
14.408977
7.496162
-6.786049
other
Li4Mn4P4O16
28
33
336.35
mp-1196350
12.539102
6.579378
-7.081333
other
In4Sb4P16O56
80
33
1,076.78
mp-1227214
10.024086
8.456191
2.702243
other
Ca4Gd8Be4O20
36
33
425.06
mp-850217
13.673445
7.95314
-0.954784
other
Li16V8Si16O52
92
33
983.43
mp-22655
12.367617
6.886576
-6.838273
other
K4Ni4P4O16
28
33
406.24
mp-1227637
7.423649
8.896616
-0.095752
other
Ca4Eu8Be4O20
36
33
442.73
mp-6434
12.819649
6.304583
-0.326084
other
Rb4Al4Si4O16
28
33
447.79
mp-1220991
12.512351
10.839271
0.330325
other
Nd12Si4Mo16O56
88
33
1,190.71
mp-696210
7.986098
0.893705
-4.074286
other
B4H20C4N8
36
33
368.65
mp-1226719
-4.571028
-2.954209
-3.737298
other
Cs8Sn16Se36O4
64
33
2,318.85
mp-757270
14.80358
7.822627
-5.513366
other
Li4Cr4P4O16
28
33
360.83
mp-510760
9.96573
7.825642
-3.02738
other
Li4Co4Si4O16
28
33
351.42
mp-1182492
7.756027
7.795977
-4.332912
other
Fe8Te8S4O52
72
33
1,132.29
mp-23894
11.574195
5.748003
-4.503527
other
Li4As4H8O16
32
33
380.72
mp-1227516
12.856106
5.602484
-6.080781
other
Be4Tl4P4O16
28
33
365.32
mp-558105
13.703955
4.264719
-2.381638
other
Li4B24O36F4
68
33
747.3
mp-849257
11.59147
7.352228
-2.121862
other
Li4Fe4Si4O16
28
33
360.12
mp-764760
11.096441
2.412058
0.852619
other
Li4V4O4F12
24
33
270.13
mp-570828
0.993547
2.093196
-5.151245
other
Al8Hg16Sb8Cl32
64
33
2,020.83
mp-757681
11.958793
7.48461
-7.443628
other
Li4Ni4P4O16
28
33
342.96
mp-1201143
8.243945
2.493854
-1.129228
other
As4Cl4O4F32
44
33
670.61
mp-1199892
13.884358
4.378246
-2.28343
other
Rb4Ge4B12O28
48
33
620.53
mp-1197861
8.239145
6.60532
-5.155312
other
K8U4S8O48
68
33
1,203.85
mp-562177
7.548416
12.150153
-0.984414
other
Ba4Ca4Co16O28
52
33
732.02
mp-720593
13.074788
4.309248
-2.789065
other
Na8B20H20O44
92
33
897.76
mp-558335
6.341125
4.985638
-4.469646
other
Na8Pd4N16O32
60
33
838.66
mp-651161
8.037601
2.1466
-1.289786
other
Te16As16Se32F96
160
33
3,266.3
mp-1203978
2.405239
2.859581
-4.349608
other
Sb12Se24N12Cl96
144
33
4,457.66