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-1213237
14.311503
5.189483
-7.580903
other
Ho2Zr12P18O72
104
165
1,585.26
mp-556407
9.555369
8.984868
0.296978
other
Ba6Bi4Te2O18
30
165
511.68
mp-554400
11.705729
12.240542
1.357373
other
Mn4Nb4Zn4O18
30
165
357.95
mp-1194641
8.952507
2.255818
1.918563
other
Na6U12Ti2F60
80
165
1,093.1
mp-559369
7.10777
4.806047
-4.776209
other
Zr4H24N20O70
118
165
1,445.24
mp-1211656
9.829204
4.833765
-7.064861
other
K4Cr4S8O32
48
165
671.98
mp-680158
11.830722
7.308785
-0.962409
other
K12Ti6Ge18O54
90
165
1,332.85
mp-776589
13.942945
7.123674
-6.231153
other
Li18Sb6P16O58
98
165
1,275.38
mp-1210629
11.622246
11.85201
1.792216
other
Mg4Ta4Mn4O18
30
165
351.4
mp-1215058
11.668314
7.389527
-0.923876
other
Ba6Na12Ge48O108
174
165
2,323.78
mp-1208165
14.312884
5.193467
-7.588865
other
Y2Zr12P18O72
104
165
1,593.03
mp-1218484
12.982168
6.247629
-0.208078
other
Sr2Al4Si4O16
26
165
366.9
mp-1212494
14.295216
5.201451
-7.566637
other
Lu2Zr12P18O72
104
165
1,575.85
mp-578953
13.498863
5.56198
-7.313704
other
Yb2Zr12P18O72
104
165
1,597.1
mp-555252
11.773502
7.354522
-0.832148
other
Rb12Ti6Ge18O54
90
165
1,383.11
mp-560209
13.124592
6.370486
-7.100998
other
Li18Al6P16O58
98
165
1,105.2
mp-935267
8.557401
3.713948
-7.192387
other
Li16U4C12O44
76
165
863.28
mp-624486
11.618067
7.360363
-0.984036
other
K12Sn6Ge18O54
90
165
1,371.82
mp-662803
11.655215
7.386879
-0.890206
other
K12Ba6Ge48O108
174
165
2,405.31
mp-585305
12.884042
6.60929
-6.711492
other
Li18Bi6P16O58
98
165
1,308.19
mp-779010
13.875292
6.868563
-6.428825
other
Li18Sn6P16O58
98
165
1,253.64
mp-1212069
11.6584
7.40865
-0.940698
other
Na12Sr6Ge48O108
174
165
2,283.34
mp-1208780
14.312714
5.182771
-7.579412
other
Tb2Zr12P18O72
104
165
1,590.75
mp-1209516
-3.782803
-1.039127
-5.375018
other
Rb4Mn2Te4S12
22
165
659.96
mp-1210825
10.811542
11.786584
-1.761281
other
Li4Zn4W4O18
30
165
340.85
mp-554148
11.263529
11.053936
-3.997212
other
K2Fe2Mo4O16
24
165
425.46
mp-680061
11.588267
7.358546
-0.967633
other
Rb12Sn6Ge18O54
90
165
1,434.79
mp-26975
13.141829
7.455232
-7.604938
other
Li18Cr6P16O58
98
165
1,150.43
mp-1192359
-3.684442
-1.025698
-5.380296
other
Cs4Mn2Te4S12
22
165
696.39
mp-1194946
9.021643
2.256365
1.903045
other
Na6U12Fe2F60
80
165
1,107.84
mp-1213641
14.306511
5.177567
-7.584415
other
Gd2Zr12P18O72
104
165
1,598.2
mp-690460
7.2811
11.857989
2.084841
other
Ba2La4Mn6O18
30
165
375.17
mp-1179240
11.841283
7.500046
-1.2076
other
Tl12Sn6Ge18O54
90
165
1,425.18
mp-1195887
8.992208
2.260066
1.919332
other
Na6U12Cr2F60
80
165
1,110.57
mp-6046
8.668202
3.737445
-7.066515
other
Na16U4C12O44
76
165
944.23
mp-583985
11.170524
7.925845
-7.537796
other
Li18Co6P16O58
98
165
1,107.17
mp-1194950
8.979437
2.230026
1.936649
other
Na6U12Al2F60
80
165
1,101.4
mp-582856
14.248569
5.234065
-7.586445
other
Eu2Zr12P18O72
104
165
1,612.25
mp-778150
14.823348
7.739962
-4.674948
other
Li18Nb6P16O58
98
165
1,228.89
mp-776035
10.852619
7.763733
-7.062648
other
Li18Cu6P16O58
98
165
1,145.88
mp-1210885
14.360017
5.164829
-7.576528
other
Nd2Zr12P18O72
104
165
1,607.88
mp-1228002
9.79243
10.452373
3.404622
other
Ba2La8Ti8O30
48
165
610.06
mp-27013
14.398888
8.19473
-7.085362
other
Li18V6P16O58
98
165
1,168.17
mp-1195908
8.978002
2.381016
1.893624
other
Na6U12V2F60
80
165
1,110.99
mp-1227323
12.919062
6.343137
-0.221491
other
Ca2Al4Si4O16
26
165
344.59
mp-1208527
14.301089
5.189563
-7.585199
other
Tm2Zr12P18O72
104
165
1,584.68
mp-1222197
10.781069
12.05235
1.599216
other
Mg4Ta4Ni4O18
30
165
330.12
mp-761065
12.024052
6.984554
-7.246026
other
Na18Fe6P16O58
98
165
1,321.19
mp-1179723
10.195219
5.115151
-4.376283
other
V8Co4H32O40
84
15
877.28
mp-1209486
8.698405
3.774227
-7.167544
other
Rb8U2C6O22
38
15
683.76
mp-1213935
12.652739
7.18954
-6.868362
other
Cd2Ni2P8O24
36
15
441.42
mp-1192835
9.959671
2.367509
-2.473074
other
Zr2H12O4F12
30
15
296.01
mp-560263
9.647213
6.893655
-3.468774
other
Pr8Se6O20F12
46
15
679.16
mp-555451
10.346003
9.368905
-1.83469
other
Sr6U2Te8O28
44
15
796.87
mp-733610
8.469001
2.698071
-4.90204
other
H14C6N6O10
36
15
344.68
mp-1203872
13.702367
4.310822
-2.450658
other
Na4Cu4B24O42
74
15
795.72
mp-554505
13.277267
6.032616
-6.716797
other
K2Ho2P8O24
36
15
485.74
mp-1315650
11.87654
13.753565
-1.232
other
Li4Mn2V6O16
28
15
300.62
mp-542686
12.864015
6.157073
-0.614713
other
K8Na4Si12O30
54
15
847.31
mp-558982
7.563464
3.062177
-3.313259
other
Hg4C8O8F12
32
15
517.96
mp-1222033
8.51927
14.45161
-1.02392
other
Mn8Zn6Ni4O24
42
15
454.81
mp-1263350
13.810031
8.343292
-0.823577
other
Mg6Si8W4O28
46
15
561.91
mp-1102794
2.456546
2.443694
1.299143
other
Mg4B2Br2N4
12
15
190.58
mp-1163919
13.647538
8.884748
-0.770928
other
Zn2Si4W2O12
20
15
247.08
mp-1189021
6.533775
4.91543
-4.165013
other
Pd2N8O2F4
16
15
254.01
mp-1211904
11.772231
11.089362
-3.144845
other
K4U2Mo6O24
36
15
570.1
mp-1211443
11.027554
10.994841
-3.715718
other
K2La2Mo4O16
24
15
357.26
mp-1209389
11.133288
11.345263
-2.084345
other
Pr2Tl2W4O16
24
15
352.34
mp-1211953
6.798269
6.045098
-3.183172
other
Mg2Hg4I12O12
30
15
844.38
mp-17870
9.537736
11.038307
-2.783412
other
K2Yb2W4O16
24
15
343.65
mp-1043833
10.565176
11.50082
2.966382
other
Ca4Nb4Cu2O16
26
15
351.48
mp-25848
8.393866
7.895144
-4.559479
other
Li2Ni4P6O24
36
15
453.85
mp-1190594
8.960088
2.254664
-1.097091
other
Cs2Mn2O4F8
16
15
310.12
mp-568381
4.064883
2.273507
-3.150397
other
Rb8Au8C16N16
48
15
1,149.26
mp-1214005
13.226315
6.823988
-0.631452
other
Ca2Al4Si8O24
38
15
420.43
mp-6698
13.958829
5.424149
-6.727395
other
Th4Cu2P6O24
36
15
510.73
mp-24510
7.914381
6.477731
-3.311068
other
Ba2H4I4O14
24
15
379.77
mp-561311
13.090148
7.988461
-6.107572
other
K8P8W4O36
56
15
905.8
mp-540948
12.58183
7.270758
-7.037932
other
Zn2Ni2P8O24
36
15
437.28
mp-556787
9.609554
4.966418
-6.645753
other
K8Cu12S12O52
84
15
1,264.05
mp-1211845
-2.440429
-0.5344
-5.366071
other
K6Sn4P10S36
56
15
1,497.75
mp-1046101
11.337851
11.54832
2.284276
other
Mg8Ta8Mn4O32
52
15
614.97
mp-1211095
8.262258
2.919042
-5.099806
other
Mn6H24C24O36
90
15
1,174.52
mp-1191332
8.519444
5.701345
-5.574408
other
Cs2S4O12F4
22
15
422.55
mp-1212734
8.236368
3.48902
-6.170688
other
Fe2H4C4O8
18
15
225.86
mp-1211937
-0.861359
0.800505
-3.686518
other
K6Nb12S2Br34
54
15
1,624.24
mp-1358549
8.604908
1.311541
0.626021
other
Ba4Cu2Sn4F28
38
15
625.02
mp-1213777
4.323158
2.525413
-3.25979
other
Cs4Cu6C6N14
30
15
623.37
mp-757586
10.569743
4.163289
-3.869074
other
Ba4Tl2H14O14
34
15
420.13
mp-558393
1.875387
2.735552
-4.839232
other
Rb4Nb6Cl14O10
34
15
824.69
mp-1209136
10.958688
11.361223
-2.025059
other
Rb2Sm2W4O16
24
15
342.55
mp-1203404
7.678427
6.827415
-3.183116
other
Ag4Mo2I8O28
42
15
652.76
mp-23968
9.424152
5.959174
-4.273433
other
Ni4H8Se4O20
36
15
368.5
mp-26359
12.74669
7.318434
-7.210738
other
Li4Co2P8O24
38
15
497.44
mp-696298
6.866961
1.458176
-4.003216
other
B4H8C4O4
20
15
289.86
mp-779020
11.633993
7.198465
-1.956297
other
Li4Mn2Si8O22
36
15
413.52
mp-10927
4.718806
2.730086
-3.541118
other
Sr2C4S4N4
14
15
280.67
mp-669378
-3.077952
-2.164266
-5.570564
other
Ce6Si4S16Br2
28
15
671.21
mp-849281
14.126333
7.85378
-7.055687
other
Li2Mn8P6O24
40
15
489.92
mp-1046674
8.98976
8.198958
-3.171899
other
Mg2Co2Si2O10
16
15
166.65