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-769476
10.931052
7.887566
-7.450816
other
Li6Fe3Cu1P6O24
40
1
461.55
mp-1173760
12.158084
5.609738
-2.183279
other
Na4Al4Si6H8O24
46
1
623.02
mp-1236687
9.061357
4.909427
-5.438575
other
K2Li1S2O4F2
11
1
214.76
mp-1233333
13.477155
8.239886
-7.416574
other
Ca1V1Fe1P4O14
21
1
275.49
mp-1176445
9.249179
4.745807
-8.327063
other
Na8Fe4P4C4O28
48
1
617.94
mp-1661623
12.453553
12.56301
0.056299
other
Li8Ti6V6Te4O32
56
1
649.76
mp-850888
11.054792
8.576991
-7.348752
other
Li3V6P12H6O48
75
1
822.84
mp-1076516
7.241137
11.3896
0.899472
other
Sr20Ca12Fe28Co4O80
144
1
1,945.06
mp-1233993
8.341609
10.977592
0.50437
other
Mg1Zn2Bi6Ru8O27
44
1
557.36
mp-775170
10.701509
12.914359
-0.096872
other
Li12Al6Cr12Sb6O48
84
1
864.72
mp-1340471
12.705369
10.787787
-0.80945
other
Al2Mo6Se4Cl2O16
30
1
450.56
mp-686607
14.156721
4.858953
-7.14049
other
K15Nd7Zr9P24O96
151
1
2,386.96
mp-2714119
13.2416
5.131339
-7.263424
other
Na42Zn15Ge9P36O144
246
1
2,984.15
mp-2714606
12.081548
3.941597
-7.848341
other
Na21Zn12P9S9O72
123
1
1,555.57
mp-768581
13.141752
7.62225
-7.910334
other
Li8Mn3Cr1P6O24
42
1
490.57
mp-1227598
12.540565
6.561796
-0.011656
other
Ca4Mg1Al2Si3O14
24
1
312.89
mp-1227644
13.01872
6.754861
-0.629712
other
Ca4Mg3Fe1Si8O24
40
1
459.22
mp-1228018
10.977054
8.039396
-4.363426
other
Ba3V2Ni6As4O24
39
1
520.79
mp-1099861
10.691726
10.17352
1.692831
other
La28Sm4Mn20Fe12O80
144
1
2,105.09
mp-1218657
11.348293
10.968359
0.707596
other
Sr3La1Mn2W2O12
20
1
271.46
mp-1076683
6.489488
10.627769
0.073772
other
Ba12Sr20Co16Cu16O80
144
1
2,035.9
mp-2712949
11.92944
4.150894
-8.317854
other
Ti6Al6Si3S15O72
102
1
1,363.22
mp-774319
9.683292
13.217662
-0.144356
other
Li10Ti2Fe3Ni3O16
34
1
303.8
mp-1565867
8.194735
11.559031
2.13297
other
Sr1La3Mn2Cr2O12
20
1
242.1
mp-1233530
7.83874
6.904745
-3.264021
other
Sm2Mg1Mo2I8O30
43
1
673.67
mp-1226046
12.797195
6.826425
-6.833657
other
Cs1In1Cu1P6O18
27
1
414.04
mp-770943
12.359189
7.505577
-7.459939
other
Li4Ti1Ni5P6O24
40
1
450.03
mp-2230365
2.268729
2.602991
-4.412893
other
Mg1Ti2S2Cl12O2
19
1
563.89
mp-2230418
11.666293
10.449972
-2.42054
other
Mg1Co2Te2Mo2O12
19
1
276.43
mp-1247639
7.46764
11.94443
1.840194
other
Sr4Ca28Ti12Mn20O92
156
1
1,835.76
mp-532695
14.954166
3.961017
-7.63323
other
Na12Zr8Si8P4O48
80
1
1,129.71
mp-2713119
12.471196
3.844834
-8.500881
other
Sc6Ti6Si3S15O72
102
1
1,512.68
mp-752491
14.649202
7.917283
-6.436753
other
Li3V1Cr1P4O14
23
1
278.63
mp-2231237
11.662641
12.571264
-3.234119
other
Mg1V4Fe1Co1O12
19
1
252.62
mp-2713138
13.527958
4.819811
-8.080477
other
Zr6Ti6P12S6O72
102
1
1,518.75
mp-1211173
8.441621
7.561463
-3.880581
other
Na3Ce4Ti2Si2O24
35
1
473.88
mp-2220672
9.900126
9.176586
1.480255
other
Sr4Mg1In2Sb2O12
21
1
318.18
mp-1236033
10.571529
10.674823
1.207252
other
Ba2Li1Y2Fe4O10
19
1
264.03
mp-760209
12.796978
8.584184
-7.782834
other
Li2V2Cr2P8O28
42
1
521.77
mp-759715
13.857802
6.904346
-6.012492
other
K6Li12Sb6P12O48
84
1
1,140.26
mp-1176977
14.220491
8.490411
-7.43779
other
Li12Mn2V6P12O48
80
1
932.27
mp-1236013
8.481286
7.09016
-3.455457
other
Li1Au4Se4Cl4O12
25
1
516.4
mp-2712881
12.858238
4.033937
-8.488947
other
Hf9Mg3P6S12O72
102
1
1,543.77
mp-775876
13.998053
7.158219
-6.784049
other
Na2Li2Mn2P4O14
24
1
286.3
mp-2227369
11.585402
9.419845
2.247226
other
Ba2Pr1Mg1Nb1O6
11
1
185.86
mp-850362
15.582275
6.203752
-2.080602
other
Li4Mn1Fe3B4O12
24
1
250.84
mp-777491
13.410825
8.09427
-7.310618
other
Li9V6P12H6O48
81
1
863.37
mp-686618
3.010799
2.356023
1.694385
other
Y1Al6Si30N45O3
85
1
924.04
mp-2218018
12.64198
10.546585
0.726999
other
Mg1Ti1Zn2W1O6
11
1
125.29
mp-769501
8.525545
5.714033
-6.970069
other
Na8Ni4P4C4O28
48
1
604.65
mp-2713408
15.161159
3.738833
-7.747398
other
Na15Ta9Ti3Si18O72
117
1
1,571.01
mp-1666747
9.573736
3.804446
-8.515771
other
Na10Fe4P4C4O28
50
1
631.36
mp-1351504
11.28853
7.677198
-3.774445
other
Al3Tl4Fe1As8O28
44
1
649.55
mp-1229146
11.341139
7.39869
-4.655944
other
Ba4Cu8As10H6O40
68
1
876.5
mp-1227779
9.645791
2.207148
-4.320831
other
Co2H31S2N9O11
55
1
487.7
mp-755680
10.530589
11.994301
-1.617712
other
Li8Nb2Cr2W4O24
40
1
426.95
mp-2715123
10.845761
4.154108
-7.587671
other
Na18Zn21Ge3S36O144
222
1
2,950.73
mp-1099990
6.454588
10.724152
0.098583
other
Ba4Sr28Co16Cu16O80
144
1
1,973.2
mp-1211664
8.333988
3.885674
-6.508961
other
Na2Sr3Zr1C6O21
33
1
453.1
mp-1046503
10.03874
10.784768
1.333398
other
Ba2Ca2Tl2Cr3O10
19
1
292.87
mp-1233412
11.963004
11.453737
2.099339
other
Mg1Ta4Mn4Nb4O24
37
1
467.4
mp-695227
9.908297
10.839258
3.219019
other
Ca14La6Mg3Ti17O60
100
1
1,183.77
mp-690987
13.029513
6.021861
-0.69888
other
Na7Al10Si14Ag3O48
82
1
1,898.44
mp-2714137
13.220314
3.661365
-8.402387
other
Na30Si27Ge24S9O144
234
1
2,812.03
mp-2230229
12.083042
10.461462
-1.88639
other
Mg1Mn2Te2Mo2O12
19
1
284.88
mp-2713427
13.739994
3.301833
-8.843673
other
Na6Zr12Si9S9O72
108
1
1,668.17
mp-2220589
12.022977
8.214643
-8.19292
other
Mg1Mn5Cr1P6O24
37
1
465.77
mp-2715390
15.099552
3.749038
-7.646537
other
Na36Mg4Ta20Si36O144
240
1
3,174.75
mp-755688
9.71198
12.252192
-1.812588
other
Li8Mn2Sb2W4O24
40
1
423.16
mp-755204
15.587767
6.195716
-2.076476
other
Li4Mn1Fe3B4O12
24
1
252.57
mp-2713661
14.350564
4.846961
-7.462236
other
Na12Ca3Zr9P18O72
114
1
1,663.02
mp-1173234
7.706027
11.719505
2.091809
other
Sr6La14Mn17Sn3O60
100
1
1,254.83
mp-1236344
9.172736
10.644466
1.955883
other
Sr4Li1Mn2Ga2O10
19
1
268.4
mp-2714642
11.51558
4.08242
-7.97857
other
Na6Mg15Sn9S36O144
210
1
2,962.83
mp-1233805
10.433997
9.543935
-2.160954
other
Mg1Ag4Te8Mo2O24
39
1
623.21
mp-1233943
14.623965
8.56424
-5.349067
other
Mg1V4Sb2P6O24
37
1
533.17
mp-1076614
6.901484
11.555889
0.754588
other
Sr12Ca20Fe20Co12O80
144
1
1,883.05
mp-686239
10.295672
10.260407
2.993867
other
Sr5Li25La7Nb8O48
93
1
1,167.54
mp-2230033
11.345606
12.485935
-3.437112
other
Mg1Mn1V4Cu1O12
19
1
257.81
mp-1178881
8.880108
7.968954
-5.246905
other
V2Co4P4N2O24
36
1
441.27
mp-774408
9.775478
13.802611
-0.25855
other
Li10Mn3Cr3Ni2O16
34
1
303.45
mp-2713209
13.777927
5.202417
-7.327781
other
Na30Ta3Al21P36O144
234
1
2,754.7
mp-686598
12.611136
6.434634
-0.121757
other
Ca16Mg2Si8Cl4O32
62
1
968.68
mp-774640
8.505513
5.722796
-6.935808
other
Na4Ni2P2C2O14
24
1
305.47
mp-677709
9.970871
11.22507
3.31479
other
Na6Sr14Ti14Nb6O60
100
1
1,249.11
mp-690271
11.833518
4.968166
-3.416637
other
Ca4Al8Si8H36O50
106
1
1,217.45
mp-1177562
13.454528
8.41027
-7.96533
other
Li12Mn4V4P12O48
80
1
924.82
mp-771757
10.70154
13.056435
-1.579385
other
Li4V3Co3Te2O16
28
1
320.23
mp-1099653
6.39807
11.497429
0.284501
other
Sr8Ca24Fe4Co28O80
144
1
1,838.28
mp-2715293
13.807902
4.711059
-7.166129
other
Na12La4In4P12O48
80
1
1,170.89
mp-2713053
12.141743
3.930991
-8.346099
other
Mg6Nb6Si3S15O72
102
1
1,515.21
mp-677336
14.947212
3.863727
-7.536649
other
Na20Zr12Si14P4O72
122
1
1,707.33
mp-774173
15.541385
6.348831
-2.082758
other
Li8Mn1Fe7B8O24
48
1
502.95
mp-2713039
12.591061
3.955806
-8.407069
other
Zr9Zn3P6S12O72
102
1
1,590.76
mp-1226025
9.679084
7.006851
-2.889632
other
K3Zr4Si12H1O44
64
1
1,051.02
mp-2713426
12.968864
3.703429
-8.838824
other
Hf6Ti6Si6S12O72
102
1
1,541.53
mp-2715490
14.003022
4.846055
-7.294569
other
Na12Sc4Ga4P12O48
80
1
999.67
mp-1178099
9.842491
13.459593
-0.302557
other
Li10Cr3Fe3Ni2O16
34
1
306.09
mp-765617
9.503395
12.305816
-1.223349
other
Li4Fe2Cu3Te3O16
28
1
325.88
mp-752805
12.255314
8.149575
-8.215309
other
Li6Mn3V1P6O24
40
1
465.89