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-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
mp-1104298
8.659105
7.708566
-2.412868
other
Na2Ca2Si2O8
14
11
188.44
mp-774802
14.101182
7.682855
-6.013756
other
Nb2Cu2P4O16
24
11
316.32
mp-1192630
13.204495
5.506497
-5.981704
other
K6Ho2P4O16
28
11
402.85
mp-1346599
7.873925
10.845119
1.390006
other
Ca4Ta2Cu2O12
20
11
239.62
mp-775270
9.998091
8.294641
-7.032367
other
Mn2Co2P4O16
24
11
283.64
mp-1198984
11.197201
7.859109
-7.39224
other
Fe6P6Pb2O26
40
11
496.65
mp-540310
14.11054
7.660017
-5.951656
other
Li4Mo2P10O30
46
11
633.05
mp-24124
10.944352
4.127966
-3.191176
other
Nd2H4Cl2O4
12
11
156.11
mp-1193725
3.170918
2.988471
-4.619872
other
Pb8C2Cl12O8
30
11
658.85
mp-775018
14.170935
7.960966
-6.369629
other
Ti4Fe4P8O32
48
11
601.1
mp-1286896
11.25242
7.820378
3.025142
other
La4Fe4As4O4
16
11
313.1
mp-556708
12.95006
6.379922
-6.661273
other
K8U8P24O88
128
11
1,987.36
mp-1373426
11.799504
10.816012
1.748471
other
Ca4Ta2V2O12
20
11
241.71
mp-1192352
13.131118
5.591041
-5.891976
other
K6Pr2P4O16
28
11
419.09
mp-772565
12.564212
6.302109
-3.216532
other
Li4Fe10B6O26
46
11
457.32
mp-1041181
13.855748
7.022948
-5.712873
other
Mg2Sn6P6O26
40
11
558
mp-772031
14.698069
8.153873
-4.720989
other
Nb2Fe2P4O16
24
11
312.68
mp-1182786
10.888539
4.323832
-3.81383
other
Cs2Li4H6O6
18
11
231.69
mp-1366740
11.986401
11.065325
2.117033
other
Ta2Ti2Zn4O12
20
11
217.82
mp-1195686
12.445299
6.511169
0.200011
other
Ba2Ho8Si10O34
54
11
736.87
mp-758849
11.931624
7.467989
-7.133587
other
Cu2Sn2P4O16
24
11
303.67
mp-979964
8.607774
7.348724
-3.608881
other
Yb2H4Cl2O4
12
11
142.98
mp-16382
12.770444
6.132354
-6.378449
other
K2Cd12P14O48
76
11
1,016.67
mp-16381
14.051086
7.566947
-7.003785
other
Na2Mn12P14O48
76
11
934.78
mp-1013917
10.537689
8.295093
-7.599388
other
Li2Mn6P6O26
40
11
487.47
mp-1200213
5.805862
5.122401
-4.244115
other
Pd2Rh2N20O20
44
11
808
mp-1374281
8.372328
11.78272
-0.722579
other
Mg4Ni2Sb2O12
20
11
208.18
mp-1373183
12.001586
10.627444
-0.1947
other
Mg4Sb2Mo2O12
20
11
228.19
mp-1189041
5.777359
3.176175
-3.35511
other
Al2C10N2Cl2
16
11
308.54
mp-6781
5.114485
2.980565
-3.842772
other
Ag2C2N2O2
8
11
141.13
mp-1307652
10.422198
13.931873
-0.590902
other
Li4Ti2Cr6O16
28
11
302.27
mp-558331
1.884384
2.325409
1.309164
other
Ca10W2N8O4
24
11
356.31
mp-1212645
8.024993
3.504082
-4.690037
other
H12C2N16O10
40
11
531.74
mp-1366504
12.207551
11.918838
0.506851
other
Ta2V2Zn4O12
20
11
216.78
mp-1217058
9.463094
3.673308
-4.145091
other
U2H4Cl4O6
16
11
323.12
mp-1212160
8.184182
1.975881
-0.611221
other
K6U4O12F14
36
11
695.21
mp-1345395
11.860136
11.658777
-0.515598
other
Mg4V2Sb2O12
20
11
214.92
mp-1219452
-5.781931
1.368062
-4.728439
other
Sc2Tl4Mo30S38
74
11
1,493.77
mp-1194156
8.547722
7.874463
-2.681022
other
Ca2Al4Si4O20
30
11
339.76
mp-863292
11.48737
7.909578
-7.247061
other
Na6V2P4O18
30
11
378.36
mp-560222
10.915382
4.026752
-7.398979
other
Na36S12O48F12
108
11
1,423.28
mp-774823
13.975328
7.610789
-7.055656
other
Ti4Mn4P8O32
48
11
613.27
mp-10555
1.235129
2.030035
1.513076
other
Ba4Li2Re2N8
16
11
285.42
mp-760599
14.209609
7.48281
-5.69452
other
Ti2Sn2P4O16
24
11
345.7