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-2715647
13.53564
3.640042
-8.182854
other
Na42Al24Si21S15O144
246
1
2,861.87
mp-1233349
11.912662
11.164017
-1.628977
other
Ho2Mg1Ag2W4O16
25
1
335.94
mp-759177
10.379103
8.195117
-7.041344
other
Li6Mn1Co3P6O24
40
1
458.56
mp-2712925
11.717894
4.31889
-8.154687
other
Al6Si3Ge6S15O72
102
1
1,298.12
mp-1228731
11.349416
11.105525
-3.86799
other
Ba2Li3La3Mo8O32
48
1
697.96
mp-774396
15.488708
5.792635
-2.223738
other
Li8Mn5Fe3B8O24
48
1
507.9
mp-770138
9.402889
3.86586
-8.634114
other
Li10Fe4P4C4O28
50
1
554.94
mp-1048499
9.988236
6.873401
-3.085189
other
Al2Sn6Se4Cl2O16
30
1
649.69
mp-1238298
9.472597
6.565458
-3.629169
other
Na2Ti3Mn1Si4O22
32
1
475.77
mp-776013
8.510643
5.710318
-6.956303
other
Na8Ni4P4C4O28
48
1
607.15
mp-850939
13.133842
8.363237
-8.024709
other
Li2Mn1V1P4O14
22
1
271.6
mp-694972
2.623699
2.263782
2.007537
other
Ce20Si20Br2N34O18
94
1
1,397.51
mp-1233521
10.508387
9.502085
2.026022
other
La4Mg1Ga2Fe2O12
21
1
297.59
mp-758132
11.863764
7.715364
-7.704092
other
Li5Fe3Co2P6O24
40
1
458.16
mp-821676
7.868651
5.365909
-1.516695
other
Sr7Sm1Fe4Mo4O24
40
1
515.32
mp-861720
10.041437
4.20146
-7.495497
other
Li12V4P4C4O28
52
1
559.74
mp-1642087
10.835152
12.001046
-1.6578
other
Li8Cr2Te2W4O24
40
1
430.41
mp-677704
3.645478
2.87894
-4.304328
other
Sb4H20C6N2Cl18
50
1
1,379.42
mp-697834
7.100058
12.061258
1.76225
other
Ca4La4Mn7Ni1O24
40
1
462.66
mp-807421
6.700748
3.799881
-1.676363
other
Li4Mn2V2P8O28
44
1
538.16
mp-1233439
1.29546
2.355895
-4.570364
other
Ca1Nb2Te4Cl10O1
18
1
597.59
mp-768514
14.556124
7.410074
-6.504827
other
Li9Ti1Mn3P6O24
43
1
505.59
mp-2715265
14.932456
3.753867
-7.594222
other
Na36Mg4Nb20Si36O144
240
1
3,202.61
mp-1076203
11.435176
10.147484
1.394432
other
La20Sm12Cr24Fe8O80
144
1
2,029.74
mp-2713051
11.93379
4.038574
-8.184772
other
Ta6Zn6Si3S15O72
102
1
1,515.19
mp-1235838
8.413518
3.952041
-6.549657
other
Li1Tl6C2O6F2
17
1
352.97
mp-752661
9.206995
7.810597
-5.575612
other
Li1Co2P4H3O16
26
1
300.91
mp-778135
15.291325
5.575279
-2.304198
other
Li8Mn7Fe1B8O24
48
1
514.09
mp-2712888
12.865212
3.632025
-8.599927
other
Na18Si21Sn24S15O144
222
1
3,149.72
mp-2714716
11.903508
3.992929
-8.085087
other
Na6Hf9Mg15S36O144
210
1
3,013.22
mp-1235687
11.089128
9.581746
2.86742
other
Sr4Li1Sm2Ta2O12
21
1
303.48
mp-1177616
13.209443
8.376451
-8.068494
other
Li12Mn4V4P12O48
80
1
936.81
mp-774811
8.583855
5.350688
-7.763256
other
Na3Mn2P2C2O14
23
1
304.55
mp-1233616
9.580938
9.366712
1.18209
other
Ba6Mg1Co2Sb4O18
31
1
489.89
mp-1177221
12.217673
12.465831
-0.913427
other
Li4V3Fe3W2O16
28
1
308.89
mp-1228234
10.450852
10.585147
1.753971
other
Ba3Sr1Er2Mo2O12
20
1
301.71
mp-744410
8.991036
11.298586
2.569688
other
Ca5Gd3Ti5Mn3O24
40
1
467.22
mp-1227080
13.02833
6.733194
-0.744804
other
Ca4Zn3Fe1Si8O24
40
1
464.65
mp-1173198
8.231583
10.188965
1.87298
other
Sr6La4Zn3Ru2O20
35
1
502.81
mp-759753
14.067551
8.166134
-7.20544
other
Li6V3Cr3P12O42
66
1
799.38
mp-706251
8.472666
1.550078
-4.450019
other
Cr4H67C20N16O16
123
1
1,292.51
mp-768648
9.016287
4.7395
-8.433702
other
Li8Fe4P4C4O28
48
1
548.49
mp-2714971
10.951505
4.09202
-7.625033
other
Na18Ti3Zn21S36O144
222
1
2,971.19
mp-1221297
12.857413
7.53033
-6.834113
other
Na3Co6Ag1P8O28
46
1
536.33
mp-1173846
11.686549
5.35016
-2.7976
other
Na8Ga8Si12H16O48
92
1
1,173.07
mp-1173843
9.384573
3.468178
-5.519068
other
Na6H24Ru4C8O36
78
1
842.8
mp-775279
8.419609
14.032333
-1.060168
other
Li4Mn3Cu3Sb2O16
28
1
298.76
mp-1177571
13.450034
8.377874
-7.835189
other
Li12Mn4V4P12O48
80
1
865.38
mp-1235837
8.216195
10.29195
1.65036
other
Sr4Li1Tb2Ru2O12
21
1
289.24
mp-2715338
13.87754
4.977973
-7.238362
other
Na54Mg24Ta12P54O216
360
1
4,588.44
mp-1178138
11.62256
7.93928
-8.117495
other
Li24Mn14V2P24O96
160
1
1,856.84
mp-698668
10.539356
12.791297
1.238533
other
Nb3Zn1Fe3O12F2
21
1
269.06
mp-1076892
7.192908
11.298103
0.921339
other
Ba4Sr28Fe28Co4O80
144
1
2,057.35
mp-695648
12.959585
6.290815
-0.551144
other
K1Na6Al7Si9O32
55
1
761.26
mp-1221237
10.246089
11.446654
3.206505
other
Na3Nd1Ti2Nb2O12
20
1
242.3
mp-1218728
8.604718
7.828244
-2.66627
other
Sr2Ca4Al12Si12O60
90
1
1,037.41
mp-727221
7.601004
5.00277
-1.949342
other
Li2Zn2Cr6S12O48
70
1
894.93
mp-1228582
6.733541
10.620946
1.106422
other
Ba8Sr4Sm4Co8O30
54
1
825.16
mp-1177097
9.630815
8.114935
-6.000116
other
Li8Fe7Cu1P12O48
76
1
935.07
mp-780298
15.339874
5.598505
-2.298533
other
Li8Mn7Fe1B8O24
48
1
504.17
mp-1045091
12.330361
10.225548
0.628489
other
Sr4Al2Ga2W4O14
26
1
374.53
mp-1233304
-4.709188
-6.224125
1.05346
other
Rb2Ba8Mg1Sb6O2
19
1
733.47
mp-1176939
14.340619
8.493917
-7.046243
other
Li6V3Fe1P6O24
40
1
470.86
mp-1662795
11.119601
12.448284
-0.03154
other
Li8Ti4Fe6Sb6O32
56
1
657.09
mp-759820
11.799507
8.491575
-7.904342
other
Li3V3Fe3P12O42
63
1
787.72
mp-1076092
7.417567
11.525067
1.171469
other
Sr28Ca4Mn8Fe24O80
144
1
2,008.6
mp-1247597
6.522321
12.440491
1.129847
other
Sr4Ca28Mn28Al4O94
158
1
1,755.89
mp-725514
7.736955
5.20109
-1.89728
other
Na13Zr7Si5P7O48
80
1
1,148.15
mp-1099742
6.583539
10.503125
0.089508
other
Ba8Sr24Co12Cu20O80
144
1
1,994.27
mp-775132
12.020036
7.227835
-1.840129
other
Na2Li6Fe8Si16O48
80
1
874.14
mp-1044922
12.98637
11.443385
0.105067
other
Al4V13Si2Sb2O28
49
1
582.64
mp-777357
15.294594
5.576821
-2.304633
other
Li8Mn7Fe1B8O24
48
1
512.8
mp-2216952
12.683075
7.977904
-7.999773
other
Mg1Ti1Mn5P6O24
37
1
473.86
mp-1177909
11.781666
8.743773
-8.118618
other
Li4Mn2V2P6O24
38
1
463.13
mp-754916
9.516747
12.591681
-1.814423
other
Li4V1Cr1Te2O12
20
1
202.91
mp-703291
12.423892
6.28652
-5.104852
other
Ba6Cu2P4Br6O14
32
1
687.37
mp-1235734
9.314833
5.934332
-4.046132
other
K2Li1H2Se2O6
13
1
203.96
mp-777768
15.291118
5.574329
-2.304641
other
Li8Mn7Fe1B8O24
48
1
513.69
mp-1045980
11.949636
11.10401
-2.021824
other
Al2W6Se4Cl2O16
30
1
635.46
mp-1076175
6.260353
11.300565
0.115545
other
Sr16Ca16Co28Cu4O80
144
1
1,875.86
mp-690979
9.786894
9.512847
1.422609
other
Li18Nd12Sb6Te2O48
86
1
1,060.81
mp-2240160
9.442983
2.474308
1.672958
other
Na3Mg1Mo1O3F3
11
1
143.63
mp-1099810
7.56172
12.111558
1.597162
other
Sr8Ca24Mn28Fe4O80
144
1
1,890.67
mp-2714698
13.466937
5.034375
-7.440125
other
Na9La3Sn9P18O72
111
1
1,619.31
mp-2217693
12.596601
11.257975
0.151153
other
Mg1Mn2Fe1W1O6
11
1
136.32
mp-1097019
8.957788
1.428484
-4.198236
other
H24Pb4C4N4F12
48
1
539.27
mp-1233657
14.102624
10.822015
-0.978046
other
Mg1V8Ge4O16F8
37
1
453.48
mp-2713121
12.788859
3.770798
-8.372066
other
Y9Nb3P6S12O72
102
1
1,714.33
mp-1218409
2.686548
2.178893
1.748392
original
Sr1Ca1Al2Si2N6
12
1
146.98
mp-2713083
12.182583
4.001502
-8.345125
other
Mg6Ta6Si3S15O72
102
1
1,507.02
mp-2715272
14.197062
4.607757
-7.113433
other
Na18La6Sc6P18O72
120
1
1,750.32
mp-755440
10.717762
10.586146
2.898246
other
Li1La3Ti3Cr1O12
20
1
239.82
mp-694976
7.90977
11.713428
2.296856
other
Sr3La7Ti2Mn8O30
50
1
616.67
mp-1233080
11.504752
9.551043
-0.175143
other
Mg1Fe6Sb10I6O18
41
1
894.61
mp-695436
8.626386
1.086861
-4.40976
other
H96C32S4N8O16
156
1
1,332.84
mp-1100917
10.937619
10.882306
-3.442734
other
V1Cu6Ag1Mo5O24
37
1
481.03
mp-695505
14.389939
5.526275
-6.745773
other
K2Li1Nb6P3O24
36
1
554.02
mp-756264
15.585649
6.216651
-2.081627
other
Li4Mn1Fe3B4O12
24
1
250.62
mp-1235095
1.38275
2.488147
-4.497186
other
Li1Nb2Te4Cl10O1
18
1
565.82
mp-698622
10.894819
8.740371
2.097507
other
Sr10Mn5Zn9As10O10
44
1
962.67