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-1046481
12.10105
11.170991
1.024368
other
Ti10Zn8Te6O36
60
15
755.28
mp-1197529
8.763769
5.595714
-5.864722
other
Sr2Au4S8O32
46
15
769.41
mp-1202255
8.118089
1.970572
-0.721008
other
Ag6Sb6Se12F36
60
15
1,198.67
mp-1043166
11.613062
7.732435
-1.409095
other
Zn2Ni2Ge4O12
20
15
229.62
mp-26741
11.54802
7.574322
-6.835004
other
Li2Cu8P6O24
40
15
457
mp-699452
9.974376
2.944409
-3.894663
other
Mo12H40Cl28O18
98
15
1,671
mp-1190216
8.255159
2.476709
-4.839277
other
H6C6N6O6
24
15
294.76
mp-6580
8.188661
10.438103
1.509449
other
Ba6Nd2Ru4O18
30
15
466.73
mp-1196057
13.546989
7.408239
-0.888775
other
Ba4Mn8Si8O28
48
15
693.87
mp-1047029
12.296411
10.728341
1.823452
other
Ca4Nb4Mo2O16
26
15
339.96
mp-765564
12.209311
7.419062
-7.650089
other
Li8Ni4P8O28
48
15
556.88
mp-1202786
6.173263
5.173062
-4.526554
other
Cs4La2N10O34
50
15
863.93
mp-1209099
11.043715
11.002052
-3.571834
other
Rb2Tb2Mo4O16
24
15
321.64
mp-1209245
10.882997
11.015796
-3.619264
other
Rb2Dy2Mo4O16
24
15
332.62
mp-1181715
10.157676
4.70423
-4.317436
other
Ni2H20Se4O20
46
15
491.21
mp-1290913
7.695001
13.287197
-1.04787
other
Li12Ni4O8F8
32
15
283.89
mp-777909
11.279817
7.958738
-7.623612
other
Li4Cr4P6O24
38
15
457.28
mp-1200983
2.754483
3.192006
-4.119111
other
Re8S4Cl16O32
60
15
1,189.97
mp-861061
12.471809
7.338895
-1.511877
other
Li4Si6Ni6O20
36
15
381.44
mp-1196720
8.071115
4.271101
-6.211711
other
K8Ge4C24O52
88
15
1,342.77
mp-1204185
11.132936
10.283246
-2.357929
other
Ag12Te8W6O40
66
15
1,003.1
mp-1306460
8.080629
14.03545
-1.439038
other
Li2Cr2Co2O8
14
15
145.89
mp-26239
14.447161
8.491097
-4.999697
other
Li4Mo4P8O28
44
15
533.41
mp-1210573
13.679276
7.545719
-0.804852
other
Mg2Cr2Si4O12
20
15
227.44
mp-1047759
11.431886
11.146199
2.404887
other
Ca4Nb4Fe2O16
26
15
335.39
mp-585226
11.495934
7.767482
-7.799283
other
Li6Fe4P6O24
40
15
456.92
mp-1209939
10.285666
7.458018
-6.274884
other
Nd2P8N2O24
36
15
512.59
mp-10973
-4.845917
-2.921217
-4.005519
other
K8Ga12Cu4Se24
48
15
1,313.66
mp-1208120
11.342566
11.096918
-3.256206
other
Tm2Cu2Mo4O16
24
15
293.35
mp-1201903
10.388726
4.027249
-4.878104
other
Tm4H32S6O40
82
15
830.07
mp-1202926
2.817003
3.090574
-4.101039
other
Au6N6Cl24O4
40
15
1,220.66
mp-643547
10.184928
4.721056
-5.568807
other
Co4H8S4O20
36
15
367.91
mp-1210695
11.644921
7.262497
-4.298883
other
Mg6Cu4As6O24
40
15
494.3
mp-557888
8.654169
1.413995
1.684397
other
K10U4O8F18
40
15
717.58
mp-556179
-2.867476
-2.360427
-5.941027
other
Pr6Si4S16Cl2
28
15
670.46
mp-560907
1.962775
2.959163
-4.585073
other
Mo4Se4S8Cl20
36
15
1,104.83
mp-6240
12.722139
6.492044
-0.933038
other
Li2In2Si4O12
20
15
234.07
mp-1209110
9.755893
10.632144
-3.769502
other
Rb2Yb2Mo4O16
24
15
340.17
mp-1196433
13.583718
4.675461
-1.729517
other
Dy8B8O22F4
42
15
427.7
mp-1228244
8.897269
10.159907
2.345961
other
Ba6Er4Mo2O18
30
15
472.01
mp-1255815
13.497969
7.427752
-0.732711
other
Ca2Si4Sn2O12
20
15
274.34
mp-1195228
12.11116
4.498231
-3.198142
other
Na4B20H32O52
108
15
1,156.35
mp-758386
14.292924
7.513177
-6.252785
other
Li8V2P12O36
58
15
680.27
mp-1272506
10.900957
11.125576
0.555322
other
Ba4Fe2W2O12
20
15
284.64
mp-558434
7.482146
10.643219
0.891692
other
Ca6Cu2Rh2O12
22
15
275.69
mp-581237
11.720462
7.302523
-7.241817
other
K12Fe8P12O48
80
15
1,187.1
mp-863365
13.855693
6.902345
-6.035418
other
Li4Sn2P8O24
38
15
540.67
mp-1211517
8.694824
3.604722
-6.985106
other
K2Lu2C4O12
20
15
255.18
mp-1250217
11.118231
7.203277
-2.031085
other
Zn6Cu4Si8O28
46
15
550.96
mp-1211873
-2.475036
-0.434436
-5.273873
other
K6Ti4P10S36
56
15
1,452.84
mp-24550
11.050359
6.499548
-5.529434
other
Mn4As4H8O20
36
15
403.81
mp-1046557
11.374229
12.458002
-0.152028
other
Mg8Cr10Te6O36
60
15
712.43
mp-672184
5.496363
3.308523
-4.720162
other
Ru2C8I4O8
22
15
517.11
mp-556638
11.373393
11.047422
-3.77351
other
K4Th2Mo6O24
36
15
591.06
mp-758246
14.410339
8.425442
-6.637902
other
Li4V4P8O28
44
15
519.4
mp-1201983
11.075191
4.639049
-4.206368
other
Cs6Pu2H16O18
42
15
618.81
mp-1019549
12.466367
6.446167
-0.241281
other
Ba4Mg8Si8O28
48
15
633.78
mp-1203830
11.503776
6.917946
-1.082085
other
Ca4Al8Si8O34
54
15
835.92
mp-1191311
12.278445
6.442591
-0.182105
other
Ba4Mg2Si4O14
24
15
358.44
mp-770383
10.492758
4.372964
-7.057648
other
Li4Cr4S6O24
38
15
480.55
mp-1266531
13.71644
8.264955
-0.798591
other
Ca6Si8Mo4O28
46
15
587.68
mp-557176
13.270993
4.875849
-1.462212
other
Ba10B8O20F4
42
15
658.39
mp-1202971
12.380974
6.459311
-0.028413
other
Ba4Gd4Si8O26
42
15
592.24
mp-558135
-1.596404
0.617181
-4.640792
other
Ti8S16Cl12O2
38
15
1,055.86
mp-1197308
8.834296
3.382152
-5.707321
other
U2H8C8O20
38
15
435.89
mp-18640
13.539847
6.018426
-7.556365
other
Li2Ti4P6O24
36
167
452.48
mp-18982
7.970984
10.4908
0.820797
other
Sr6Ni2Ir2O12
22
167
305.55
mp-759483
10.297612
8.311779
-7.292675
other
Mn4Ni2P6O24
36
167
433.63
mp-770403
15.030198
8.39615
-5.399659
other
Li8V4P6O24
42
167
471.84
mp-554853
14.11341
3.893856
-7.512582
other
Na8Si6Sn4O24
42
167
517.31
mp-780430
12.091731
8.56251
-7.608668
other
V2Fe4P6O24
36
167
441.2
mp-1205395
8.642768
3.677837
-7.086995
other
Ba2Mg2C4O12
20
167
251.83
mp-16984
7.480718
10.378008
1.202651
other
Sr6Mg2Rh2O12
22
167
304.65
mp-1195145
11.289916
8.990895
1.338678
other
K4U6Mn2O22
34
167
514.29
mp-757397
12.842633
9.155365
-7.328611
other
V4Cu2P6O24
36
167
452.38
mp-759966
14.547912
7.807661
-5.62374
other
Ti4Mn2P6O24
36
167
461.48
mp-776759
10.585161
8.361935
-7.639181
other
Mn4Fe2P6O24
36
167
444.98
mp-542858
4.253289
2.281905
-3.278486
other
Zn6Co4C24N24
58
167
1,475.65
mp-758242
14.313596
8.704591
-4.6393
other
Li2P6W4O24
36
167
492.24
mp-770353
10.144997
4.619402
-7.074896
other
Li2Cr4S6O24
36
167
466.69
mp-1190744
-3.17237
-1.877521
-5.432551
other
Ba6Gd2In2S12
22
167
605.96
mp-16866
6.289437
5.05409
-4.571282
other
K2Np2N6O22
32
167
498.54
mp-1101225
14.062816
8.95736
-6.738911
other
V4Fe2P6O24
36
167
449.74
mp-768614
8.460223
6.186264
-5.975806
other
Li2Ni4S6O24
36
167
456.44
mp-1191678
1.351523
2.458795
-5.821492
other
K6Na2Mn2Cl12
22
167
603.23
mp-1182634
13.356254
4.894892
-2.189213
other
B18Pb16O42F2
78
167
1,108.97
mp-40161
14.659396
5.016108
-7.655847
other
Na2Hf4P6O24
36
167
518.26
mp-1191185
6.14529
10.945018
0.636943
other
Sr6Zn2Co2O12
22
167
293.07
mp-699587
12.084067
6.743636
-1.068143
other
Mn2Si12Pb16O42
72
167
1,165.89
mp-541661
14.104633
5.18083
-7.515515
other
Li2Zr4P6O24
36
167
490.66
mp-771692
13.59412
8.927424
-7.065079
other
V4Co2P6O24
36
167
445.28
mp-1197208
7.123238
11.842877
1.690243
other
Sr18Mn10Co4O42
74
167
993.54
mp-2716478
14.879337
3.929439
-7.103802
other
Na24Hf12Si18O72
126
167
1,688.22
mp-17829
8.289051
9.791238
1.734962
other
Sr6Sm2Rh2O12
22
167
328.18
mp-26712
12.161869
9.304432
-7.567297
other
Li2V4P6O24
36
167
443.1
mp-1201250
1.244433
1.894445
-4.476248
other
Cs6Zr14Mn2Cl40
62
167
1,799.72
mp-554060
8.248181
10.492145
1.810921
other
Na6Pr28Ru12O72
118
167
1,579.18
mp-772797
13.849446
6.509903
-7.014519
other
Ti4Cu2P6O24
36
167
458.67
mp-541272
12.928033
5.946492
-7.649595
other
Li2Ge4P6O24
36
167
421.26
mp-18705
8.290766
9.841995
1.776428
other
Sr6Tb2Rh2O12
22
167
314.77