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-19508
13.586552
6.651099
-0.808341
other
Sr4Cr4Si16O40
64
130
869.95
mp-1043550
13.979599
7.766809
-0.753796
other
Mg4Si16W4O40
64
130
833.79
mp-1043538
13.561726
6.81304
-0.893314
other
Zn4Cr4Si16O40
64
130
806.21
mp-1043519
13.82264
7.400616
-0.810026
other
Mg4V4Si16O40
64
130
806
mp-1043629
14.027792
7.762743
-0.797132
other
Zn4Si16W4O40
64
130
834.99
mp-1043372
13.899901
7.507347
-0.699936
other
Mg4Ti4Si16O40
64
130
808.7
mp-19518
13.555449
6.660848
-0.837192
other
Ba4Cr4Si16O40
64
130
959.31
mp-1043405
13.345464
6.69505
-0.844034
other
Zn4Si16Sn4O40
64
130
878.27
mp-1043525
13.46841
6.759542
-0.831913
other
Mg4Mn4Si16O40
64
130
813.23
mp-1043642
12.877523
6.580114
-1.152324
other
Ca4Si16Ni4O40
64
130
824.87
mp-1043643
13.503107
6.731899
-0.869527
other
Ca4Fe4Si16O40
64
130
859.78
mp-6189
12.903191
6.420523
-0.9748
other
Ca4Cu4Si16O40
64
130
839.86
mp-1209316
-3.647566
-1.136096
-5.540809
other
Rb4Ti2Ag4S8
18
132
492.75
mp-10489
-4.784888
-2.906065
-3.677315
other
Cs4Ti2Cu4Se8
18
132
508.48
mp-1211474
-4.010362
-1.190741
-5.629478
other
K4Ti2Cu4S8
18
132
398.51
mp-1189491
4.181642
2.286776
-3.21591
other
Zn2Pt2C8N8
20
132
402.65
mp-1180462
8.499102
7.650398
-3.676322
other
Na4Ti8Si4O36
52
132
773.56
mp-7129
-3.914357
-1.14242
-5.611403
other
Rb4Ti2Cu4S8
18
132
414.38
mp-10488
-3.664669
-1.17336
-5.457734
other
Cs4Ti2Ag4S8
18
132
522.78
mp-505342
10.447828
9.485036
-2.059166
other
Mn4Cu4Te16O40
64
133
1,036.69
mp-1195227
10.391183
9.347102
-2.002177
other
Na4Y4Te16O40
64
133
1,133.08
mp-26856
13.194122
6.848022
-6.851384
other
Li4Sn4P16O48
72
134
869.46
mp-704184
11.357084
7.812619
-7.587465
other
Li4Mn4P16O48
72
134
809.74
mp-557328
9.945007
10.749744
0.075774
other
Li3Zn2Sb1O6
12
12
120.59
mp-1174203
7.774614
17.396288
-0.357616
other
Li8Mn6Co2O16
32
12
300.05
mp-1100738
3.674708
23.428684
-1.389754
other
Li9Mn2Co5O16
32
12
289.64
mp-754887
10.07423
0.557983
-0.019285
other
Li8Co2O2F10
22
12
226
mp-754015
12.167006
13.250381
-0.258313
other
Li4V2Cr2O8
16
12
151.19
mp-772060
9.529459
13.468295
-0.43018
other
Li3Nb1Fe3O8
15
12
161.08
mp-770486
8.142288
13.298339
-0.729266
other
Li6Ni4Sn2O12
24
12
233.02
mp-1314006
11.297629
13.753597
-1.372446
other
Li2V2Ga2O8
14
12
148.98
mp-2218910
8.260799
14.516888
-1.201068
other
Mg1Mn3Cu1O8
13
12
148.13
mp-655613
-5.841423
-3.869063
-1.759896
other
Cs2Tb6Te7N2
17
12
572.31
mp-542474
-0.640403
1.247484
-4.914427
other
Hg12S8I4Cl4
28
12
879.87
mp-1210422
-5.891779
-3.626925
-1.922938
other
Na3Eu2Si2Te6
13
12
425.02
mp-1175162
6.487839
20.156864
-0.451318
other
Li7Mn4Co1O12
24
12
214.51
mp-1212721
9.51584
5.395172
-6.766467
other
Fe1Ag1S2O8
12
12
159.85
mp-1177408
8.283868
13.640379
-0.982526
other
Li4Fe5Sb1O12
22
12
242.88
mp-1176255
3.917209
22.899199
-1.324037
other
Li9Mn2Co5O16
32
12
289.34
mp-752652
10.635018
13.830104
-1.082913
other
Li3V2Fe2O8
15
12
132.99
mp-1191860
3.257325
3.190823
-3.910695
other
Co2Ir1N10Cl10
23
12
546.78
mp-773121
12.948914
11.413153
0.746717
other
Li12Nb8V4O24
48
12
476.9
mp-2232103
10.385054
12.895509
-0.322547
other
Mg1Mn4Fe2O8
15
12
175.35
mp-753687
9.561981
14.207478
-0.559269
other
Li3Cr2Co1O6
12
12
110.09
mp-555549
13.780085
8.201016
-5.777394
other
Ba1Mo1P2O8
12
12
179.02
mp-6238
11.107874
11.624198
2.787274
other
Ba2Ta6Te2O21
31
12
469.33
mp-2217575
12.131799
9.890373
2.207559
other
Sr2Mg1Ti2O6
11
12
144.02
mp-1078748
9.92186
10.011943
3.258033
other
Sr2Ta1In1O6
10
12
138.4
mp-765538
6.81983
14.510315
-1.497277
other
Li6Co4Ni2O12
24
12
203.62
mp-1101915
9.225863
12.098604
-1.172285
other
Li2Cu2Te1O6
11
12
123.05
mp-2210744
10.977765
10.382595
0.90612
other
Na1Mg1Mn1O2
5
12
97.06
mp-1223011
-3.838555
-1.311479
-5.629778
other
Mn1Ag2Sn3S8
14
12
362.25
mp-1192345
10.968277
11.163702
-2.383325
other
Ag2Bi2W4O16
24
12
337.61
mp-1225126
9.721547
10.794602
0.100747
other
Gd2Mn3Sb3O14
22
12
270.99
mp-1100743
3.423312
23.769035
-1.460651
other
Li9Mn2Co5O16
32
12
288.79
mp-771072
12.047597
13.614775
-0.965798
other
Li3V3Fe1O8
15
12
147.18
mp-755086
11.819667
12.095016
2.258327
other
Ta4Cr2N2O10
18
12
209.95
mp-1208979
11.166322
11.269315
-2.142751
other
Sm2Ag2W4O16
24
12
315.89
mp-557232
8.226535
9.968859
1.466425
other
K2Sm2Pd2O6
12
12
190.59
mp-754749
10.16115
0.678672
-0.537659
other
Li8Co4O4F12
28
12
296.68
mp-1214297
8.701096
8.125217
-3.093181
other
Ca4Fe6Si6O28
44
12
528.36
mp-1176242
3.969528
22.877148
-1.326977
other
Li9Mn2Co5O16
32
12
287.17
mp-1174185
7.289965
18.52331
-0.386103
other
Li4Mn3Co1O8
16
12
152.24
mp-1208614
13.561263
5.580994
-7.150189
other
Sr1Ti1P2O8
12
12
159.98
mp-1212790
11.597552
5.26546
-4.962061
other
Fe3P2H8O8
21
12
310.03
mp-1218637
6.459754
11.019837
0.543141
other
Sr8Co6Cl4O15
33
12
484.38
mp-553950
12.402452
7.707425
-0.939697
other
Li20Si4Pb2O20
46
12
468.91
mp-752570
6.364242
14.283251
-1.652652
other
Li3Fe1Co3O8
15
12
144.56
mp-2224460
11.13145
10.44423
0.802066
other
Na1Mg1Mn1O2
5
12
92.95
mp-754279
9.927576
13.930908
-0.519172
other
Li4Cr3Ni1O8
16
12
145.82
mp-1220727
-7.440751
0.814007
4.564766
other
Nd2Fe20Mo4N1
27
12
358.61
mp-1177382
6.770354
14.258923
-1.79001
other
Li4Mn1Co5O12
22
12
215.05
mp-2228630
9.104029
14.596938
-0.637794
other
Mg1Mn4Cu2O8
15
12
169.71
mp-1197988
11.39693
10.970884
-3.664462
other
Rb8Zr1Mo6O24
39
12
755.06
mp-1172870
-3.226056
-2.315654
-5.79534
other
K2Ho4Cu4S9
19
12
403.5
mp-559519
11.808941
7.200381
-4.14542
other
Na8Ti2As4O18
32
12
460.11
mp-752986
6.458794
13.359103
-1.348572
other
Li4Cu1Ni3O8
16
12
142
mp-555554
13.039531
6.308353
-6.696441
other
K2Ga2P8O24
36
12
541.45
mp-774874
10.93751
12.768273
0.865637
other
Li3Ti2Cu1O6
12
12
113.75
mp-1222601
8.500569
13.197815
-1.064197
other
Li3Al2Co1O6
12
12
102.57
mp-1204427
-3.715714
-2.019393
-5.385921
other
Cu2Bi8Pb6S19
35
12
908.42
mp-1227914
7.288884
11.888183
2.017694
other
Ba2Pr4Mn6O18
30
12
371.31
mp-2232105
9.407849
13.765936
-0.694805
other
Mg1Mn4Ni2O8
15
12
167.11
mp-1174571
3.355534
23.332184
-1.441157
other
Li7Mn2Co3O12
24
12
220.71
mp-1641399
7.459961
11.971018
1.98927
other
Sr8La2Mn10O26
46
12
609.07
mp-554412
13.910448
5.446861
-7.240274
other
Rb1Ta1P2O8
12
12
198.15
mp-756733
6.270433
12.841404
-1.420815
other
Li4Ni5Bi1O12
22
12
233.57
mp-1303020
9.337906
14.065678
-0.868513
other
Li4Mn6Te2O16
28
12
334.44
mp-755721
10.304675
13.773838
-0.315833
other
Li4Cr3Fe1O8
16
12
148.06
mp-2230038
11.653009
9.33988
1.891133
other
Er5Mg1Mo2O12
20
12
259.09
mp-559747
10.391745
10.353808
2.919808
other
La4Ti4Si2O18
28
12
357.23
mp-1275037
12.531872
13.193891
-0.826548
other
Li4V6Sn2O16
28
12
320.4
mp-26901
10.454919
8.063372
-6.62323
other
Li8Fe2P4O18
32
12
348.15
mp-560977
-2.620462
-0.418229
-5.206884
other
K2Ti2P2S10
16
12
419.54
mp-1103456
2.906866
3.298716
-4.361837
other
Cs2Cr1Cl5O4
12
12
326.76
mp-752502
11.040148
12.675121
0.130878
other
Li14Cr6Si4O24
48
12
410.19
mp-1986938
-4.372293
-3.107371
-4.100235
other
Sr2Bi2Se3O2
9
12
229.97
mp-1174600
3.865601
23.263952
-1.294384
other
Li8Mn2Co4O14
28
12
252.34
mp-1295190
5.204095
21.207226
-0.878019
other
Li10Mn4Co2O16
32
12
280.03
mp-24129
10.106492
2.933758
-3.874994
other
Mn1H4Br2O2
9
12
139.89