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-11115
-4.732904
-2.333741
-3.490022
other
Rb2Cu2Pd2Se10
16
11
429.28
mp-756899
10.732975
8.25624
-7.55083
other
Mn2Fe2P4O16
24
11
289.46
mp-1178412
10.543177
8.268868
-7.196018
other
Cr2Co2P4O16
24
11
275.83
mp-1012742
10.514008
8.268723
-7.447236
other
Na2Mn6P6O26
40
11
488.65
mp-1239269
-5.306608
0.018196
-5.665937
other
Nb2Cr6Ag4S16
28
11
552.34
mp-542181
10.584396
12.147229
-3.522553
other
K6Eu2V4O16
28
11
466.9
mp-759915
12.581686
6.562418
-6.610462
other
Li4Bi2P6O20
32
11
467.15
mp-1379512
7.672162
10.731926
0.498899
other
Ca4Co2Sb2O12
20
11
239.77
mp-1368521
11.615944
10.558999
1.484763
other
Ta2Zn4Sn2O12
20
11
238.22
mp-556737
10.820439
7.950563
2.812321
other
Pr12Ti4S14O12
42
11
789.2
mp-1211175
7.86234
7.793042
-3.598054
other
Mg2Si6H2O24
34
11
535.46
mp-1341944
8.95963
11.35867
2.00616
other
Ca4Ta2Fe2O12
20
11
242.11
mp-1195470
11.526215
8.702272
0.006655
other
Rb8U6As4O32
50
11
913.56
mp-1315810
12.812531
12.192824
0.816376
other
Li6Ti6V2O16
30
11
301.05
mp-1101597
13.298553
7.874132
-7.460025
other
Li4Cr4P8O28
44
11
492.78
mp-1198284
8.053244
8.041742
-3.901524
other
U6P4Pb4O42
56
11
904.91
mp-1227410
7.13354
12.107224
1.806307
other
Ca2La2Mn4O12
20
11
234.65
mp-1377924
7.891112
10.806624
-0.608927
other
Ta2Zn4Ag2O12
20
11
234.54
mp-1173912
6.247515
19.420925
-0.798486
other
Li4Mn2Co2O8
16
11
148.92
mp-18019
13.156313
5.590652
-5.898739
other
K6Sm2P4O16
28
11
394.46
mp-6285
9.986192
10.662286
3.417204
other
Ba4Nd8Ti12O40
64
11
861.55
mp-1214624
9.144203
1.314583
1.439655
other
Ba4Mn4Cl2F14
24
11
422.71
mp-759040
13.748012
7.312489
-6.968574
other
Li2Mn4P10O30
46
11
580.1
mp-1047809
11.125064
7.969379
-7.382328
other
Zn2Fe6P6O26
40
11
483.67
mp-1202275
10.827935
4.435427
-5.592091
other
Mn10H16S6O32
64
11
732.43
mp-1343823
11.473621
10.193079
2.081704
other
Ca4Ta2Sb2O12
20
11
272.21
mp-1275133
8.73366
12.15698
-0.619059
other
Mn4Zn8Sb4O24
40
11
437.01
mp-774620
13.506748
8.653814
-7.260761
other
V2Fe2P4O16
24
11
292.07
mp-705362
11.454739
7.79992
-7.334299
other
Li4Co2P10O30
46
11
594.58
mp-1203163
9.473021
7.65798
-3.911752
other
Gd4V4Se8O32
48
11
657.79
mp-759675
12.853642
7.407222
-6.942268
other
Na2Co4P6O20
32
11
369.16
mp-553997
12.187842
7.271041
-7.489997
other
Na4Mn2P10O30
46
11
632.25
mp-976713
10.921682
3.883818
-3.294299
other
Ho2H4Cl2O4
12
11
142.08
mp-1211456
9.64911
9.513378
3.322685
other
La8Zr4Cu4O24
40
11
543.87
mp-1372745
12.60248
10.655629
0.518673
other
Mg4Ta2W2O12
20
11
227.19
mp-1209268
8.715683
0.951085
1.691315
other
Rb2Er2Be2F12
18
11
240.03
mp-727170
7.646191
9.789455
-3.753521
other
K2Cr4Fe2O18
26
11
414.89
mp-561048
10.938708
11.646346
-2.657859
other
K6V2S2O6
16
11
347.68
mp-561179
8.144812
8.913786
0.906151
other
Ba8Cu4I4O8
24
11
695.82
mp-1262892
12.773438
6.429205
-1.023483
other
Li8Cu4Si16O40
68
11
883.9
mp-553025
9.46138
8.247049
-0.315376
other
Ca2Bi2Cl2O4
10
11
205.58
mp-757865
12.934047
6.547784
-1.038808
other
Li8Co4Si16O40
68
11
894.1
mp-1101836
10.832191
4.010645
-3.208666
other
Gd2H4Cl2O4
12
11
148.75
mp-1101161
9.369634
7.908315
-5.666682
other
Zn2Fe2P4O16
24
11
293.6
mp-1199256
10.539727
7.9106
-2.532468
other
Ag26As6I8O24
64
11
1,221.39
mp-673134
14.063328
7.105812
-5.450741
other
Li2Sn4P6O20
32
11
469.1
mp-780874
9.735246
13.35587
0.206455
other
K2Li4Mn4O8
18
11
227.31
mp-772573
14.179046
7.301428
-2.362571
other
Li4Cr10B6O26
46
11
450.25
mp-1212537
10.163019
7.421147
-1.966625
other
K8Yb4Ge16O44
72
11
1,225.7
mp-540330
14.017368
7.766288
-6.862972
other
Li4V2P10O30
46
11
603.44
mp-12376
-3.41107
-1.554311
-5.511646
other
K2Yb2Si2S8
14
11
347.1
mp-1194834
12.756632
6.485526
-0.029616
other
Ba2Sc4Si6O20
32
11
400.03
mp-754539
10.814209
8.570655
-3.596721
original
Li2V2Si2O10
16
11
179.76
mp-1095429
11.490695
8.696284
1.027961
other
K2U2Cl2O6
12
11
258.79
mp-1207664
8.254307
2.001905
-0.557999
other
Yb2Be2N2F12
18
11
296.02
mp-1306174
12.668452
13.491008
-0.803071
other
Li4Ti2V6O16
28
11
307.2
mp-1223007
8.499931
1.278975
1.473692
other
La2Th8O2F38
50
11
692.3
mp-759704
12.265024
7.310843
-7.30237
other
Li4Cu4P8O26
42
11
468.05
mp-1520584
7.56657
8.284518
0.501102
other
Ba2Tb4Dy2O12
20
11
317.43
mp-1218300
10.304456
7.292441
-3.197814
other
Sr2Mn4Si4O20
30
11
343.34
mp-1376673
8.574916
7.658694
-4.050528
other
Mg2Bi2P2O12
18
11
255.88
mp-761614
9.346734
8.000548
-6.031827
other
Co2Cu2P4O16
24
11
294.79
mp-753690
11.092528
4.127145
-3.725592
other
Li8H6Br2O6
22
11
283.05
mp-558368
-3.85786
-1.65647
-5.261451
other
Ag2Bi4S6Cl2
14
11
336.53
mp-754753
11.871367
7.576716
-8.120049
other
Li12Mn4P8O32
56
11
579.8
mp-555830
13.716752
5.988584
-2.787416
other
Mg6Mn6B4O20
36
11
365.01
mp-1650698
12.898274
7.764662
-6.572208
other
Co4Sb4P8O32
48
11
626.79
mp-1012865
14.619268
7.921432
-4.847127
other
Li2Ti6P6O26
40
11
507.21
mp-551131
10.941516
8.004589
-4.735899
other
Co4As2Cl2O8
16
11
233.25
mp-557606
7.703366
2.229783
-1.218916
other
Sb2As6Se8F12
28
11
693.16
mp-14885
13.027295
6.361914
-0.857497
other
Rb4Cu4Si16O38
62
11
988.66
mp-1047865
9.213331
7.990595
-5.844774
other
Mg2Ni6P6O26
40
11
465.44
mp-1369747
12.025134
10.839009
2.202262
other
Mg4Ta2Ti2O12
20
11
215.14
mp-555944
12.451971
11.062986
-1.800876
other
Na2P2W4O16
24
11
338.39
mp-753121
12.412134
11.125535
-1.863347
other
Li2P2W4O16
24
11
336.94
mp-1182913
4.756797
2.628886
-3.4773
other
Al2C10N2Cl2
16
11
419.07
mp-1047886
11.116268
7.992935
-7.876157
other
Ca2Mn6P6O26
40
11
498.77
mp-26009
11.661885
8.933357
-5.645584
other
Li4Mo8P8O44
64
11
843.89
mp-1188395
10.840559
4.106849
-3.912513
other
K2Li4H6O6
18
11
183.85
mp-1202951
8.915525
7.563636
-2.249566
other
Ba2Yb4Si6O20
32
11
457.54
mp-1246369
-4.90169
-0.366132
-5.480977
other
Hf2Cr2Ag2S8
14
11
272.83
mp-1047808
11.222126
8.122334
-8.112067
other
Mg2Mn6P6O26
40
11
482.82
mp-17089
12.006955
6.101184
-6.098596
other
K6Eu2P4O16
28
11
420.64
mp-699445
12.439889
5.237848
-5.550956
other
K12P12H12O42
78
11
1,086.2
mp-849775
12.843118
6.477616
-1.015373
other
Li8Cu4Si16O40
68
11
853.3
mp-542451
8.976556
0.728019
1.421507
other
Rb4Na2Al6F24
36
11
513.62
mp-1041465
14.147344
8.901954
-3.983476
other
Mg2Mo6P6O26
40
11
541.56
mp-31557
12.811427
7.654099
-6.781787
other
Li2Co12P14O48
76
11
871.78
mp-25841
11.118974
7.784533
-7.259289
other
Li4Ni2P10O30
46
11
595.15
mp-1212470
2.837386
3.138438
-4.223805
other
Ir4Rh4N20Cl28
56
11
1,207.62
mp-1207555
8.711799
8.097621
-3.860077
other
Zn2As4Pb4O18
28
11
401.87
mp-22219
11.156957
7.94873
-1.860442
other
Fe4Cu4Ge8O26
42
11
524.75
mp-1209211
8.61842
0.996831
1.734519
other
Rb2Dy2Be2F12
18
11
254.39
mp-1275528
11.587949
11.782953
-0.630955
other
V4Zn8Sb4O24
40
11
436.14
mp-651005
-3.799231
-1.971052
-5.344529
other
In6Bi14Pb8S36
64
11
1,613.32
mp-755760
10.050292
7.715282
-6.111655
other
Cu2Bi2P4O16
24
11
349.47
mp-1192731
1.881132
2.184227
1.52642
other
Eu8B4I4N8
24
11
559.14
mp-559094
9.965105
3.733001
-4.106441
other
Cu4H6Cl2O6
18
11
205.61
mp-766463
13.768611
4.157047
-2.28565
other
Na6Ga2B8O18
34
11
374.9
mp-1239202
-5.519882
-0.149651
-5.661513
other
Nb2Cr6Cu4S16
28
11
471.91