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-1049288
10.850046
9.393491
0.756656
other
Ca2Ho2Sb4O12
20
31
282.34
mp-1211361
-4.865329
-2.623469
-3.935268
other
Mn2Ag4Ge2Se8
16
31
420.73
mp-628643
-3.883319
-1.344148
-5.605038
other
Cu4As4Pb4S12
24
31
560.6
mp-1049228
10.956844
9.436455
0.64232
other
Ho2Mg2Sb4O12
20
31
271.86
mp-1214243
6.868421
6.245506
-4.145166
other
Co2P2N2O20
26
31
351.99
mp-6257
13.563835
4.634246
-2.496295
other
Cs2Nb2B4O12
20
31
309.95
mp-1523241
11.748379
10.568306
2.702605
other
K2Eu2Nb4O12
20
31
267.75
mp-6356
-4.263601
-1.392067
-5.813083
other
Cd4Ga2Ag2S8
16
31
387.62
mp-39739
7.270474
12.227378
1.738285
other
Ca2Ho2Mn4O12
20
31
223.44
mp-1048836
10.613016
9.268538
1.109741
other
Ca2Ho2Sn4O12
20
31
269.7
mp-557940
8.661206
3.546717
-7.070858
other
K4Nd4C8O24
40
31
537.91
mp-1210409
7.655609
7.062714
-4.742805
other
Ni2P2N2O10
16
31
223.95
mp-1284148
10.603649
8.808587
2.566427
other
Ba2Fe4S4O2
12
31
274.26
mp-554659
8.323676
1.09736
-4.433357
other
H24C10N4O2
40
31
351
mp-1239236
-4.815129
-0.484188
-5.347204
other
Zr4Cr4Cu4S16
28
31
563.86
mp-1041207
5.854783
11.599108
0.089027
other
Ca2Ho2Co4O12
20
31
217.52
mp-1044507
8.656358
8.733015
-0.036393
other
Pr2Zn2Bi4O12
20
31
320.6
mp-1239268
-5.558208
-0.12797
-5.697869
other
Nb2Cr6Cu4S16
28
31
467.15
mp-1210599
3.038679
3.281636
-4.414612
other
Mo2H2Cl4O4
12
31
267.75
mp-1227258
7.323058
12.222438
1.664776
other
Ca2Lu2Mn4O12
20
31
221.21
mp-1218253
8.704637
10.718791
1.234365
other
Sr2La2Ru4O12
20
31
254.02
mp-1239274
-5.069832
-0.498036
-5.552316
other
Zr4Cr4Cu4S16
28
31
515.45
mp-1210357
13.624336
7.536698
-0.849968
other
Na10Mn8Si12O36
66
31
818.09
mp-1213860
-4.360568
-1.343812
-5.833093
other
Cd2Ga2Ag4S8
16
31
376.06
mp-1044723
8.778333
11.626569
1.621328
other
Ca2Pr2Cr4O12
20
31
230.54
mp-1517967
12.397058
10.773082
-0.043816
other
K2Eu2W4O12
20
31
266.18
mp-1210240
13.044655
8.534233
-7.210326
other
Rb12V12P12O62
98
31
1,445.21
mp-699251
10.401366
4.233921
-4.515459
other
V2H20S2O20
44
31
433.51
mp-1044765
7.372494
12.410894
1.249983
other
Pr2Mn4Zn2O12
20
31
222.77
mp-1227166
7.177186
12.141446
1.765433
other
Ca2Nd2Mn4O12
20
31
231.99
mp-1044464
6.58495
10.516007
0.056845
other
Ca2Pr2Cu4O12
20
31
226.94
mp-1044480
10.681567
9.325176
0.919692
other
Pr2Mg2Sn4O12
20
31
266.89
mp-1289332
8.001102
10.789001
2.115477
other
Sr6Nb2Co2O14
24
31
338.09
mp-754121
7.872756
12.407526
-1.413193
other
Li4Al2Co2O8
16
31
171.83
mp-752858
11.6717
7.432692
-2.267621
other
Li4Cu2Si2O8
16
31
166.15
mp-1044462
6.840343
9.508039
-1.320318
other
Ca2Pr2Ag4O12
20
31
267.71
mp-977414
-4.530963
-1.33555
-5.990581
other
Zn2Cu4Si2S8
16
31
284.26
mp-1218059
7.069773
11.989118
1.862732
other
Sr2Pr2Mn4O12
20
31
239.37
mp-555868
11.386294
11.052378
-3.630337
other
K20Mg2Mo14O54
90
31
1,630.56
mp-1217668
12.681035
8.862627
-6.617768
other
Tl12V14P10O62
98
31
1,455.66
mp-1044528
8.938026
11.753895
1.401424
other
Pr2Mg2Cr4O12
20
31
221.73
mp-1105527
-4.615138
-1.299568
-5.903707
other
Zn2Cu4Ge2S8
16
31
294.66
mp-1194090
4.874266
2.859402
-3.655967
other
Cs2Sb2C12Cl10
26
31
728.29
mp-1041080
7.609365
12.509962
1.324591
other
Ho2Mg2Mn4O12
20
31
211.72
mp-1041092
5.920085
11.032705
-0.463408
other
Ho2Mg2Fe4O12
20
31
214.12
mp-1189879
-5.106143
-2.908031
-4.217928
other
Cd2Cu4Si2Se8
16
31
368.2
mp-1044092
11.775754
10.369473
2.478133
other
Pr2Mg2Ti4O12
20
31
228.43
mp-1246999
-4.838072
-0.46448
-5.657079
other
Hf4Cr4Ag4S16
28
31
534.61
mp-560105
12.694016
6.23217
-0.332711
other
K12Ho4Si12O36
64
31
1,075.93
mp-1209097
13.626079
4.461627
-2.616233
other
Rb2Ta2B4O12
20
31
294.55
mp-1049290
11.577907
10.323603
2.633417
other
Ca2Ho2Ti4O12
20
31
230.4
mp-1041234
5.935367
11.363425
-0.451913
other
Ca2Ho2Ni4O12
20
31
215.06
mp-1212937
-5.041775
-2.855792
-4.32796
other
Cu4Si2Hg2Se8
16
31
370.68
mp-1210923
13.335318
8.204392
-1.019377
other
Li8Fe4Ge4O16
32
31
366.97
mp-1211369
13.704571
4.416711
-2.594802
other
K2Nb2B4O12
20
31
298.4
mp-39689
7.194444
12.101337
1.818822
other
Ca2La2Mn4O12
20
31
233.28
mp-731671
9.56889
5.127248
-4.043505
other
Mo2H4Cl4O6
16
31
287.25
mp-1189383
-3.848637
-1.453372
-5.780464
other
Li4Cd2Ge2S8
16
31
350.56
mp-683949
3.21279
2.789399
-4.390299
other
Al4P12N12Cl36
64
31
1,635.13
mp-1212168
11.376479
10.993505
-3.65537
other
K20Co2Mo14O54
90
31
1,609.72
mp-1044749
6.086415
11.295311
-0.916788
other
Pr2Mg2Ni4O12
20
31
212.66
mp-557574
-4.486742
-1.348241
-5.970146
other
Cu4Hg2Ge2S8
16
31
315.87
mp-1202095
8.50302
1.59287
0.882171
other
K20Nb12O12F56
100
31
1,905.82
mp-1204322
10.749808
3.955584
-4.342647
other
Ni2P2H30O22
56
31
493.7
mp-1209317
13.100508
4.914594
-2.938323
other
Rb2B4Sb2O12
20
31
284.19
mp-1199963
8.250459
7.895433
-4.171918
other
U2Cu8Se4O28
42
31
631.7
mp-1222478
10.686985
4.506651
-6.631215
other
Li6S2N2O6
16
31
163.27
mp-1044754
5.940234
10.938552
0.058939
other
Ca2Pr2Fe4O12
20
31
235.61
mp-1226809
10.856981
2.693557
-2.53718
other
Cd2H2O2F2
8
31
96.37
mp-1043839
5.975907
11.00321
-0.315913
other
La2Mg2Fe4O12
20
31
226.94
mp-1221012
9.939149
11.170717
3.181408
other
Na2Gd2Ti4O12
20
31
228.3
mp-1220984
9.886961
11.109847
3.28794
other
Na2Nd2Ti4O12
20
31
233.18
mp-653861
12.694847
6.242301
-0.387919
other
K12Lu4Si12O36
64
31
1,077.7
mp-1239211
-5.207852
-0.120604
-5.624535
other
Ti4Cr4Cu4S16
28
31
471.4
mp-1210801
-4.394388
-1.288989
-5.845869
other
Mn2Ag4Sn2S8
16
31
390.93
mp-1239155
-5.506457
-0.1471
-5.650666
other
Nb2Cr6Cu4S16
28
31
472.99
mp-1044484
6.803316
9.679295
-1.480939
other
Pr2Zn2Ag4O12
20
31
255.3
mp-1239140
-5.547828
-0.137901
-5.708549
other
Ta2Cr6Cu4S16
28
31
478.98
mp-1019809
13.792596
4.245785
-2.219794
other
K4Be8B12O28
52
31
603.58
mp-19105
11.473315
11.017006
-2.525211
other
Na6Mo2N2O6
16
31
264.24
mp-1220924
9.91913
11.104892
3.284904
other
Na2Pr2Ti4O12
20
31
234.43
mp-1044416
10.607791
9.399689
0.695728
other
Pr2Mg2Sb4O12
20
31
286.11
mp-758182
13.686341
7.689251
-0.807318
other
Li12Cr6Si12O36
66
31
732.17
mp-1522629
5.605313
10.74011
-1.047957
other
K2Gd2Fe4O12
20
31
258.05
mp-1220744
9.927848
11.182363
3.19073
other
Na2Y2Ti4O12
20
31
226.21
mp-1211911
13.896254
6.303223
-0.569655
other
K4Si10B2O24
40
31
589.04
mp-1210796
13.06733
7.95224
-0.928725
other
Li8Mn4Ge4O16
32
31
373.89
mp-1041116
6.181855
11.44943
-1.125918
other
Ho2Mg2Ni4O12
20
31
203.15
mp-780725
15.111222
8.490393
-5.147973
other
Li8V4P4O20
36
31
364.79
mp-1044495
10.750632
9.460923
0.538528
other
Pr2Zn2Sb4O12
20
31
296.79
mp-1223018
6.314188
10.999306
0.104019
other
La2Fe4Pb2O12
20
31
248.75
mp-1194344
11.343508
7.596421
1.006574
other
Nd8P2Cl2O16
28
31
449.43
mp-1239171
-5.408698
-0.100438
-5.742362
other
Ta2Cr6Ag4S16
28
31
504.79
mp-1192446
6.509136
5.346179
-4.400687
other
Pb4Se2N4O18
28
31
412.9
mp-1239121
-5.139102
-0.228643
-5.619936
other
Nb2Cr6Cu4S16
28
31
547.9
mp-1209145
10.211823
10.734314
-3.191015
other
Re2Pb2Br2O8
14
31
271.26
mp-1221004
9.968687
11.230225
3.137822
other
Na2Lu2Ti4O12
20
31
220.61
mp-755737
12.944196
10.077697
-0.225477
other
Li4Al2V2O8
16
31
176.91
mp-1229209
-4.6383
-2.569927
-4.074145
other
Ag12Hg2Ge2Se12
28
31
714.28
mp-1220905
9.97324
11.18587
3.174425
other
Na2Tm2Ti4O12
20
31
222.84