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-1214519
9.859046
8.533466
2.807706
other
Ba12Y4Al8O30
54
13
880.93
mp-1210161
10.935017
11.380458
-2.276565
other
Na2Sc2W4O16
24
13
308.6
mp-1198396
7.512203
6.905884
-4.329608
other
Sr2U4As4O40
50
13
841.66
mp-1041919
12.068285
11.0823
-1.665804
other
Mg6Cu6W12O42
66
13
926.96
mp-1213354
11.434299
11.124273
-3.931877
other
Cs2Er2Mo4O16
24
13
405.98
mp-1042879
12.225789
11.224224
-1.206069
other
Y2Cr2W4O16
24
13
296.58
mp-561035
9.313976
6.990149
-3.553195
other
Ba2Fe4Se8O24
38
13
590.33
mp-1042146
12.063258
11.109273
-1.463786
other
Al2Bi2W4O16
24
13
314.23
mp-768389
12.259575
7.954931
-8.229876
other
Li6Mn12P12O48
78
13
900.22
mp-758812
13.862273
7.209841
-6.060134
other
Li12Sb8P12O48
80
13
1,009.62
mp-1204390
9.363471
5.944527
-3.735762
other
Ca2Mg2B12O34
50
13
589.79
mp-733652
10.16218
7.33317
-6.026484
other
Na4Zr4P8O32
48
13
726.94
mp-1101524
8.852889
7.970117
-4.936758
other
Li4Fe8P12O48
72
13
923.21
mp-699437
12.130854
4.999109
-5.162483
other
K4P4H8O16
32
13
418.79
mp-1652492
7.424696
10.754079
0.828576
other
Ca12Co4Rh4O24
44
13
541.82
mp-6011
1.091099
2.279752
1.533011
other
Ba16Li4Mo8N28
56
13
1,044.74
mp-1194217
10.450004
7.510941
-6.593969
other
Al2P6N2O20
30
13
430.95
mp-769383
13.083852
5.625769
-3.002138
other
Rb2B6Te4O18
30
13
467.56
mp-1192153
10.714841
11.3563
-2.194716
other
Li2Dy2W4O16
24
13
304.86
mp-1208038
10.461662
10.660609
-3.753437
other
U2Hg2Mo8O32
44
13
661.57
mp-560403
11.010822
11.229411
-2.407486
other
In2Ag2W4O16
24
13
302.95
mp-684470
13.932061
6.91546
-5.791709
other
Li6Sn4P10O32
52
13
736.85
mp-1203509
8.273832
1.967792
-4.544338
other
H24C4N28O2
58
13
553.84
mp-1301970
11.585379
13.627216
-1.459938
other
Li4V6Co2O16
28
13
289.86
mp-1195507
9.974329
3.191191
-3.899957
other
Yb2H24Cl6O12
44
13
541.35
mp-23958
10.150135
3.070112
-3.889781
other
Y2H24Cl6O12
44
13
478.54
mp-1215063
7.926543
10.523983
1.655924
other
Ba12Gd4Fe8O30
54
13
920.3
mp-31885
14.238601
7.445519
-6.405694
other
Li6Fe4P10O32
52
13
646.77
mp-758948
9.831842
3.690594
-5.246078
other
Cs4H12C2O12
30
13
406.12
mp-1215003
10.859239
9.797004
-2.253215
other
Ba2Bi24Mo10O68
104
13
1,765.12
mp-1227582
10.132813
7.343879
-1.717351
other
Ca4Al4Si6O24
38
13
485.14
mp-1201218
14.880166
6.116675
-0.634568
other
Si18C16N2O38
74
13
1,160.47
mp-1208141
10.637936
10.652904
-3.713363
other
U2Mo8Pb2O32
44
13
663.3
mp-1047766
6.519613
9.352181
-1.796165
other
Zn6Cu6Bi12O42
66
13
1,007.97
mp-753308
9.013507
14.00627
-0.036877
other
Li12Mn4O8F8
32
13
295.24
mp-1181049
7.377142
5.153149
-5.144823
other
K2Cr2C8O26
38
13
577.66
mp-1201366
10.080967
7.044234
-2.28111
other
Na16Sr4Si32O92
144
13
2,163.02
mp-26203
12.849707
7.403251
-7.195064
other
Li6Co4P10O32
52
13
637.6
mp-20678
10.807169
11.253325
-2.398264
other
Na2In2W4O16
24
13
313.77
mp-1219976
7.776913
7.201255
-4.306911
other
Rb4U4As4O36
48
13
880.7
mp-1214917
8.039904
7.929616
-3.197341
other
Ca4Be4Si12O48
68
13
990.64
mp-560136
13.382447
5.00346
-2.676496
other
Cu6B8Pb4O22
40
13
486.87
mp-1307356
7.095275
13.179288
-1.195077
other
Li8Ni6Bi2O16
32
13
315.34
mp-1214645
12.372606
6.676145
-0.896919
other
Ba8Ti12Si8O50
78
13
1,061.34
mp-1019584
12.564243
6.83813
-0.107776
other
Ca4Al8Si4O24
40
13
436.48
mp-1041857
12.03275
11.061266
-2.717515
other
Mg6Cu6Mo12O42
66
13
909.33
mp-1173282
9.850599
11.370485
0.648756
other
Sr20Fe10Mo10O60
100
13
1,281.75
mp-1047773
6.45741
9.304882
-1.723755
other
Mg6Cu6Bi12O42
66
13
987.22
mp-1173910
7.635658
16.450716
-0.656857
other
Li4Mn2Co2O8
16
13
145.99
mp-757676
10.45676
8.049649
-6.640922
other
Li40Fe10P20O90
160
13
1,767.37
mp-1020658
10.248703
4.586958
-6.430603
other
Na2B2S4O16
24
13
318.93
mp-1211145
10.87851
10.961974
-3.619957
other
Li2Sm2Mo4O16
24
13
310.36
mp-17630
11.472451
11.417926
-2.038878
other
Lu2Cu2W4O16
24
13
298.38
mp-571275
-4.660224
-3.147023
-3.582589
other
Cs4U2Hg4Se10
20
13
703.9
mp-1376266
11.183779
11.299034
-2.192044
other
Y2Ag2W4O16
24
13
325.17
mp-1302186
12.603621
13.436371
-0.713437
other
Li4Ti2V6O16
28
13
304.58
mp-758376
13.964128
6.942904
-6.161036
other
Li12Sn8P12O48
80
13
1,046.35
mp-32530
14.67712
8.592874
-6.436937
other
Li12V8P12O48
80
13
938.92
mp-1211005
10.774312
11.407714
-2.219495
other
Li2Tb2W4O16
24
13
304.96
mp-22076
10.387474
11.563887
-2.475471
other
Na2Fe2W4O16
24
13
296.75
mp-1282869
6.815148
13.096787
-1.308999
other
Li4Fe6Sn2O16
28
13
318.62
mp-759885
12.754214
12.892511
-1.623516
other
Li8V4O8F8
28
13
289.51
mp-1214605
9.634489
8.468002
2.20664
other
Ba12Dy4Ga8O30
54
13
905.24
mp-757328
11.916056
7.597345
-7.802873
other
Li14Mn4P14O48
80
13
927.03
mp-1210920
10.78132
11.331494
-2.145476
other
Li2Gd2W4O16
24
13
309.09
mp-1042152
12.282193
11.034181
-1.063379
other
Y2Sn2W4O16
24
13
316.23
mp-1041817
8.113316
10.57366
-3.529428
other
Zn6Cr12Cu6O42
66
13
874.21
mp-1330191
10.451632
11.339931
-2.556689
other
Y4Cu6W12O48
70
13
904.12
mp-504751
11.520863
7.115195
-3.948251
other
As2H2Pb2O8
14
13
199.64
mp-26187
13.725373
7.252434
-7.09615
other
Li6Mn4P10O32
52
13
658.95
mp-554774
10.76716
4.209482
-7.127516
other
Rb2Lu2S4O16
24
13
350.04
mp-1047613
12.419543
11.621856
-1.251835
other
Ti2Al2W4O16
24
13
262.14
mp-1214574
9.552141
8.576125
2.309744
other
Ba12Lu4Ga8O30
54
13
883.19
mp-555490
8.522999
2.187725
-0.848545
other
K2Re4O8F14
28
13
460.34
mp-1019723
13.693666
4.74157
-2.272197
other
Cs2Zn8B6O18
34
13
467.29
mp-1214608
9.576655
8.487271
2.145676
other
Ba12Gd4Ga8O30
54
13
924.44
mp-755329
8.708767
13.442963
-0.218468
other
Li12Fe4O8F8
32
13
293.72
mp-757727
13.250879
4.373118
-2.473036
other
Ba6B12H12O30
60
13
612.56
mp-25811
14.889387
8.106936
-5.351298
other
Li6V4P10O32
52
13
648.66
mp-1196807
2.731282
2.650135
-3.670431
other
In4C16Br28N16
64
13
2,001.78
mp-559103
13.652201
5.126988
-6.824673
other
Na14Y4P14O48
80
13
1,105.49
mp-1195970
8.286942
6.49087
-5.47367
other
Cd4Hg4S4O22
34
13
520.18
mp-1042176
12.539584
11.250348
-0.999439
other
Y2V2W4O16
24
13
299.91
mp-743935
8.205557
3.928744
-4.689568
other
Zn4H20N24O10
58
13
888.76
mp-759424
12.860702
6.515531
-6.750274
other
Li14Bi4P14O48
80
13
1,027.94
mp-1191022
11.436594
11.066183
-3.877901
other
Cs2Y2Mo4O16
24
13
417.64
mp-857353
12.565644
6.571435
-1.35575
other
Li2Fe2Si8O20
32
13
460.22
mp-758404
14.244946
8.027384
-7.059258
other
Li14V4P14O48
80
13
921.09
mp-1194323
7.182404
4.911901
-5.234632
other
Y2C8N2O18
30
13
497.94
mp-1214551
9.607094
8.496979
2.169638
other
Ba12Tb4Ga8O30
54
13
910.93
mp-557660
10.427466
12.814194
-3.653224
other
Rb2V4Cr2O14
22
13
294.39
mp-1101602
10.05094
8.105864
-6.43617
other
Li4Cr8P12O48
72
13
882.65
mp-6652
13.700421
4.740843
-2.247277
other
K2Zn8B6O18
34
13
454.13
mp-1274949
9.354058
13.108
-0.874004
other
Li4Fe6Te2O16
28
13
324.27
mp-1311690
9.765154
13.769134
-0.442245
other
Li6Mn6Te2O16
30
13
338.27
mp-557215
10.432681
12.81383
-3.703208
other
K2V4Cr2O14
22
13
282.18
mp-754312
7.732707
13.810977
-1.047925
other
Li6Co2O4F4
16
13
141.78
mp-1200027
6.56305
4.929245
-4.544894
other
Nb4C16N12O52
84
13
1,894.72
mp-556730
10.450608
10.699221
-3.730409
other
Ca2U2Mo8O32
44
13
628.96
mp-1041622
9.408941
10.419807
-1.654168
other
Ca6Cu6Sb12O42
66
13
1,048.45