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-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
mp-1239118
10.977959
4.466468
-3.849022
other
Cs2Li4H6O6
18
11
243.82
mp-1195911
8.477488
7.773322
-2.410809
other
Sr2Yb8Si10O34
54
11
749.31
mp-556292
9.015971
0.777303
0.916486
other
Ba4Ni4Cl2F14
24
11
387.87
mp-1041169
9.471082
7.783442
-5.939923
other
Mg2Cu6P6O26
40
11
460.55
mp-1239233
-5.008988
-0.493268
-5.402359
other
Hf2Cr2Cu2S8
14
11
250.76
mp-1344257
8.269636
11.247042
0.133577
other
Mg4Ta2Cu2O12
20
11
210.59
mp-1102075
11.114136
4.115919
-3.143471
other
Tb2H4Cl2O4
12
11
145.25
mp-1214659
10.140381
11.854793
-3.775084
other
Ba4V4Fe2O18
28
11
430.07
mp-772100
14.029788
7.529406
-6.285079
other
Cr4Sn4P8O32
48
11
630.61
mp-16799
11.017012
12.031567
-3.275959
other
K6Nd2V4O16
28
11
468.75
mp-863030
-2.547813
-0.350485
-4.637625
other
B2P8S6Br6
22
11
639.28
mp-1214281
10.762373
7.444185
-2.816764
other
Ca4Mn6Si6O28
44
11
523.31
mp-1340585
9.715665
12.67586
0.910121
other
Ta2Zn4Fe2O12
20
11
216.84
mp-1202393
12.901999
5.412019
-2.084018
other
U2Al8B6O28
44
11
537.27
mp-1190356
9.075134
7.710348
-5.204823
other
Ti2P4N2O16
24
11
374.73
mp-850438
10.640247
8.960366
-4.149962
other
Li2V2Ge2O10
16
11
201.97
mp-1041145
12.315721
6.518564
-5.734739
other
Mg2Bi6P6O26
40
11
648.25
mp-25247
10.95752
11.132584
-3.920811
other
Fe2Mo2Cl2O8
14
11
257.59
mp-1326240
11.269897
12.09015
1.614479
other
Ta2Zn4Cr2O12
20
11
213.84
mp-22042
12.850431
7.522355
-7.001308
other
Li2Co4P6O20
32
11
358.68
mp-1239258
-5.218134
-0.166332
-5.577126
other
Ta2Cr6Cu4S16
28
11
568.31
mp-1189974
4.806769
1.993401
-2.540805
other
Li2La2C4N8
16
11
207.55
mp-1188838
12.223306
5.000632
-5.209088
other
Cs2P2H4O8
16
11
249.58
mp-1378723
10.962612
10.277265
1.372146
other
Ta2Zn4Bi2O12
20
11
251.03
mp-1210232
11.573073
9.134638
-5.105891
other
Na2Mo6P4O28
40
11
562.53
mp-1106012
7.824084
6.624128
-4.876054
other
Na2Mg2S2O14
20
11
319.5
mp-1238858
-5.401151
-0.137548
-5.692137
other
Ta2Cr6Ag4S16
28
11
504.28
mp-1197531
7.336929
6.858188
-4.070585
other
Cd4Se6N4O30
44
11
736.06
mp-25955
11.393621
8.007414
-8.022826
other
Li4Mn4P8O28
44
11
499.72
mp-1221126
8.42847
11.693093
-0.836332
other
Na2Cd2Rh8O16
28
11
312.83
mp-773399
12.058674
7.463915
-7.868161
other
Li6Fe2P4O16
28
11
287.84
mp-1019806
13.284566
5.954317
-6.553839
other
K2Mg12P14O48
76
11
875.54
mp-757451
12.042146
7.555363
-7.744715
other
Li12Fe4P8O32
56
11
639.22
mp-1194422
7.407344
5.562582
-5.078192
other
Na6S2N2O16
26
11
363.55
mp-1198053
-3.515642
-1.431252
-5.315986
other
Cs6Ag4Sb6S16
32
11
1,017.98
mp-1047887
9.781154
8.244119
-6.668678
other
Mg2Co6P6O26
40
11
467.16
mp-1370970
8.938244
12.031552
-0.657308
other
Zn4Fe2Sb2O12
20
11
217.52
mp-726915
5.641742
3.273343
-4.718281
other
Os8C24S2O24
58
11
1,016.78
mp-1194659
10.895076
12.074502
-3.820212
other
Cs4Nb4V8O32
48
11
878.63
mp-17306
11.598471
9.118145
-5.144136
other
K2Mo6P4O28
40
11
587.97
mp-754649
8.348902
5.563429
-6.210129
other
Mn2C2S2O14
20
11
278.11
mp-775016
11.694034
8.299945
-7.991984
other
Mn2Cr2P4O16
24
11
280.78
mp-24007
0.566096
1.788278
-5.071319
other
Rb4H2Br2O2
10
11
263.38
mp-11170
-3.282563
-1.88993
-5.564102
other
K2Ce2Si2S8
14
11
367.3
mp-1198106
8.148215
2.535053
-1.652157
other
As2C8N4F34
48
11
667.67
mp-1372414
11.26729
10.36811
0.916967
other
Ca4V2Sb2O12
20
11
242.83
mp-1211778
12.013716
7.246293
-3.60406
other
K6Ce2As4O16
28
11
463.95
mp-1195504
5.387302
-0.408691
-3.016003
other
K8Gd4B20H80
112
11
1,265.65
mp-1213833
8.78842
5.789018
-6.020359
other
Ce2S4N2O16
24
11
337.69
mp-26531
12.136339
7.38063
-7.101374
other
Li2Cu4P6O20
32
11
355.7
mp-26977
13.977367
7.515487
-7.168486
other
Li2Mn4P6O20
32
11
377.26
mp-1372341
8.30282
10.817127
-0.362642
other
Mg4Cu2Sb2O12
20
11
216.73
mp-1019546
12.423831
6.516831
0.113717
other
Ba2Y8Si10O34
54
11
746.06
mp-570245
-5.016459
-6.27398
2.846586
other
Ba4Ga2Ge2N2
10
11
276.97
mp-867746
10.3883
8.125942
-6.942042
other
Cr2Cu2P4O16
24
11
295.24
mp-1188943
7.760979
8.173748
-3.097432
other
Na2Ho2B2O10
16
11
187.41