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-4597
-8.635753
-4.478852
2.153795
other
Y4B10Pd28
42
141
593.41
mp-1207648
12.329664
9.716797
1.315165
other
Y4Cr4O8
16
141
221
mp-38280
12.741868
11.402218
1.340286
other
Li2Ti2O4
8
141
68.88
mp-37605
-4.30379
-4.171519
-3.883623
other
Li2Nd2Se4
8
141
202.57
mp-773667
2.684431
2.383371
1.587281
other
Ge16N16O8
40
141
428.9
mp-1213456
-9.098467
-0.715478
4.46564
other
Dy4B8Ir8
20
141
288.58
mp-1211450
12.019327
10.452911
0.480501
other
K4Re4O8
16
141
259.75
mp-1212926
12.545958
10.050281
0.724428
other
Eu4W4O8
16
141
262.46
mp-5767
13.84228
5.049224
-6.775211
other
Dy2P2O8
12
141
142.35
mp-2237174
7.227703
12.894345
-1.701863
other
Co4Hg2O8
14
141
172.44
mp-38593
-3.532205
-4.306498
-3.515641
other
Sm4As2Se2
8
141
207.69
mp-936760
-4.262849
-4.055845
-3.955577
other
Ho2Ag2Se4
8
141
196.98
mp-1246339
1.972624
2.086165
1.212762
other
Li12Ru4N8
24
141
294.05
mp-15845
1.915794
1.878316
1.214295
other
Sr2Li8N4
14
141
194.59
mp-5073
6.245162
4.914894
-4.410455
other
Rb9N9O27
45
144
678.55
mp-28726
8.356393
1.057564
1.88086
other
K18Y18F72
108
144
1,817.4
mp-1211849
8.367733
8.018937
-2.439042
other
Mg27Si18O81
126
144
1,649.51
mp-778749
14.193469
11.972068
-2.206052
other
V6O6F12
24
144
291.08
mp-569702
-4.019094
-2.45856
-3.440182
other
K24P24Se72
120
144
3,731.4
mp-30890
9.607063
6.901616
-4.087631
other
Hg9S3O18
30
144
441.27
mp-754598
9.37238
7.273266
-3.490728
other
Hg9Se3O18
30
144
461.4
mp-1201270
8.361997
1.07711
1.916443
other
K18Er18F72
108
144
1,784.59
mp-1204464
6.122118
5.151668
-4.472425
other
Tm3N21O45
69
144
1,041.61
mp-561851
6.265743
4.894428
-4.495819
other
Cs9N9O27
45
144
782.53
mp-1212536
6.152521
5.151297
-4.492644
other
Ho3N21O45
69
144
1,065.68
mp-1198288
10.044297
9.181921
-0.07842
other
Sn24Bi24O84
132
144
1,900.18
mp-1202279
8.340027
1.059445
1.926062
other
K18Ho18F72
108
144
1,780.46
mp-777553
10.295815
0.435486
0.17458
other
Li6Fe6F24
36
144
413.85
mp-1208095
6.022871
5.196613
-4.431045
other
Yb3N21O45
69
144
1,120.73
mp-27209
8.470556
0.911123
0.330618
other
K6Tl6F24
36
144
574.36
mp-1574993
11.40246
2.956165
1.312829
other
V6O3F15
24
144
297.29
mp-1214358
7.957809
5.537492
-5.68526
other
Ca9C9O36
54
144
866.92
mp-1212343
-5.326338
-4.261721
5.283275
other
Li66Cu63Si42
171
144
2,313.14
mp-759679
10.592505
0.060538
0.196554
other
Li6Mn6F24
36
144
457.62
mp-752631
9.960629
12.074798
-4.630857
other
V6O12F6
24
144
289.91
mp-1225408
5.920462
11.742406
-2.226229
other
Fe12Si3O27
42
144
576.37
mp-1201805
8.628223
5.863461
-6.138772
other
Ca6S6O27
39
144
552.72
mp-557704
6.399952
4.903266
-4.640674
other
Tl9N9O27
45
144
663.27
mp-1216186
-6.575868
-2.365883
1.321982
other
Y2As7Rh12
21
143
330.98
mp-1218725
-6.202015
-1.709943
1.29329
other
Sr2P7Rh12
21
143
319.08
mp-1227454
-6.155706
-1.579784
1.304194
other
Ca6P19Rh30
55
143
815.75
mp-773918
9.519728
8.613875
-0.56246
other
Zn1Bi38O60
99
143
1,684.84
mp-1220209
11.915045
6.814904
-4.398257
other
P6Pb10O25
41
143
653.09
mp-686121
8.71512
1.785758
1.244842
other
K18Sn36F90
144
143
2,749.87
mp-30142
6.352304
5.02749
-4.624187
other
Be12N18O57
87
143
1,007.37
mp-758289
10.951444
11.63904
3.030398
other
Th4Ta18O53
75
143
1,001.56
mp-1222205
7.674104
6.65485
-3.112815
other
Mg1I2O6
9
143
138.82
mp-1201267
7.179587
7.775451
-3.042218
other
Ni6Sb12O108
126
143
1,520.39
mp-851115
11.607155
11.224631
-2.048961
other
Ti7W6O30
43
143
557.06
mp-1218700
-6.558918
-2.414898
1.248837
other
Sr6As19Rh30
55
143
895.54
mp-1226033
-6.624475
-4.038516
0.896269
other
Eu2As7Pd12
21
143
374.69
mp-1173594
-4.321377
-3.90078
-3.736881
other
Pr24Si10Se56
90
143
2,416.73
mp-1220256
-2.833087
-2.517071
-5.795476
other
Nd6Ge3S14
23
143
527.5
mp-1225463
-6.576737
-2.373592
1.31178
other
Dy2As7Rh12
21
143
330.38
mp-685442
-4.57275
-2.748382
-4.117771
other
Tl18Ag59Se39
116
143
2,825.56
mp-1219892
-4.28339
-3.872071
-3.714161
other
Pr6Ge3Se14
23
143
609.98
mp-758160
7.592647
6.621368
-3.199107
other
Co4I8O24
36
143
547.7
mp-1220273
-4.34985
-3.904933
-3.7216
other
Nd6Ge3Se14
23
143
599.56
mp-1220067
12.170915
6.637602
-4.831573
other
P6Pb9O24
39
143
601.34
mp-1227589
13.480745
5.342706
-6.16185
other
Ca10P6O25
41
143
549.79
mp-1221507
10.095809
10.456202
-3.905951
other
Mo6N1O18
25
143
390.65
mp-704406
11.890304
11.154257
-3.110591
other
U9Mo18O72
99
143
1,694.91
mp-1229223
11.778131
7.748521
-3.95069
other
As14H6O31
51
143
665.59
mp-1215876
-6.288879
-1.730757
1.273362
other
Yb6P19Rh30
55
143
804.27
mp-779162
6.379013
5.030248
-4.72789
other
Mg12N18O57
87
143
1,349.02
mp-554541
9.353539
11.365146
1.603402
other
Sr12Cr9O27
48
143
653.43
mp-676909
1.240898
2.008133
-5.569591
other
Na3Eu6Cl18
27
143
652.59
mp-1219276
-7.295133
-2.396657
4.432249
other
Sm6Si19Rh30
55
143
844.18
mp-1219162
-4.368943
-3.802423
-3.648911
other
Sm6Ge3Se14
23
143
583.64
mp-1226131
-2.668326
0.536487
2.549844
other
Er15Fe8C25
48
143
611.31
mp-34806
8.567878
1.207384
1.859948
other
Na3Y3F12
18
143
226.81
mp-1216503
-4.753613
0.178002
-4.468693
other
V6In1S8
15
143
235.58
mp-1196124
11.689573
7.415305
-0.8784
other
Ba3Ge12O27
42
143
582.42
mp-1225165
-6.595258
-2.395801
1.301147
other
Er2As7Rh12
21
143
338.7
mp-675363
-4.391016
-3.892281
-3.723153
other
Nd24Si10Se56
90
143
2,379.19
mp-1182236
3.358808
-0.765306
-2.268247
other
Ba3Re3H27
33
143
333.15
mp-686295
8.748511
1.81932
1.273407
other
K18Sn36F90
144
143
2,677.77
mp-1219880
-2.751566
-2.529796
-5.785681
other
Pr6Ge3S14
23
143
537.37
mp-764370
10.007293
0.477258
0.363904
other
Li3Co3F9
15
143
172.26
mp-676129
0.863035
1.273646
-4.336831
other
Na3Sm6Cl18
27
143
637.34
mp-741677
6.342766
6.067032
-3.664804
other
Sn3Cl24O75
102
143
1,769.71
mp-574250
-5.825589
-3.444214
-1.677999
other
In1Si1Te3
5
143
245.7
mp-766877
11.585102
7.347518
-1.546248
other
Si6Bi9O26
41
143
582.53
mp-1218894
13.444468
5.608501
-5.845695
other
Sr10P6O25
41
143
594.52
mp-1020670
13.804211
4.226835
-2.26829
other
Sr9B36O63
108
143
1,113.73
mp-557340
11.467158
7.503859
-1.515541
other
Ge9Pb15O33
57
143
1,027.94
mp-685855
1.311618
2.30723
-5.185736
other
Nb6Bi20Cl36
62
143
1,847.74
mp-685440
0.937477
1.622271
2.680068
other
Li11Ta37N48
96
143
968.53
mp-891956
10.861857
12.259995
-3.306213
other
Ca10V6O25
41
143
609.99
mp-558572
9.135024
2.059624
1.979967
other
Na4U2F12
18
143
226.88
mp-1276507
10.679804
12.554501
0.006991
other
Nb4Co8O18
30
143
337.78
mp-1229174
-6.124764
-1.622733
1.334684
other
Eu6P19Rh30
55
143
823.25
mp-1217650
-4.355971
-3.874913
-3.656153
other
Tb6Ge3Se14
23
143
567.56
mp-1216932
11.090192
7.957887
-1.604443
other
Tl6Si2O7
15
143
376.99
mp-1190518
10.72697
10.242318
1.063598
other
Ta3Al4O14
21
143
221.38
mp-676818
-3.328336
-1.07549
-5.258913
other
Sr24Ti21S63
108
143
2,460.96
mp-1219159
-2.851301
-2.473741
-5.743901
other
Sm6Ge3S14
23
143
512.2
mp-764357
11.284419
2.958991
1.198449
other
V6O3F15
24
143
292.74
mp-1201975
7.151442
7.901843
-3.167876
other
Co6Sb12O108
126
143
1,550.9
mp-1222619
-6.685308
-0.660814
3.664922
other
Mn31Si11P1
43
143
501.98