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-1040385
17.642218
9.768023
7.70332
other
K1Na1Mg30O31
63
25
643.51
mp-1033841
15.815304
9.746833
4.994287
other
Hf1Mg14B1O15
31
25
324.48
mp-1034028
17.492281
9.632728
7.75033
other
K1Li1Mg14O15
31
25
322.83
mp-1035523
16.484468
9.844633
5.708676
other
K1Hf1Mg14O15
31
25
334.76
mp-1224982
-9.10076
-0.839295
3.215624
other
Gd1Tm1Fe2Ni8
12
25
164.72
mp-1247630
7.908603
11.972876
1.95285
other
Ca8Ti3Mn5O22
38
25
472.53
mp-1039824
17.328024
9.782395
6.961185
other
Na1Mg30B1O31
63
25
621.34
mp-1225295
-4.945487
-4.33882
5.894005
other
Dy2Zn1Cu1Si2
6
25
115.44
mp-2218800
8.007573
9.816207
0.730733
other
Sr2Mg1Cu4O6
13
25
194.76
mp-1227430
8.792977
3.557374
-7.154194
other
Ca2Cu1C1O5
9
25
112.41
mp-1040265
17.576511
9.762084
7.516057
other
Cs1K1Mg30O31
63
25
655.62
mp-1040252
17.491972
9.74995
7.411755
other
Cs1Rb1Mg30O31
63
25
667.64
mp-1048370
12.581448
9.997093
0.452396
other
Ba2Al1W3O7
13
25
204.28
mp-555835
9.880544
9.109033
2.654891
other
Gd12Sc8Ga12O48
80
230
1,037.76
mp-1333536
11.979985
7.83429
-0.942124
other
Mg12Ge12Bi8O48
80
230
1,047.47
mp-1214146
11.358766
12.239738
-2.964977
other
Ca12V12Co8O48
80
230
995.56
mp-6153
9.684178
1.84204
1.686356
other
Na12Li12V8F48
80
230
1,006.25
mp-1363993
12.157122
7.359283
-1.394253
other
Y8Si12Ni12O48
80
230
927.21
mp-1209643
8.780913
10.87637
1.778516
other
Sm12Sc8Fe12O48
80
230
1,047.94
mp-1329623
13.278587
9.076438
-0.934927
other
Zn12Ge12Mo8O48
80
230
956.18
mp-21932
9.528279
0.541291
-0.07708
other
Na12Li12Co8F48
80
230
981.11
mp-558501
9.365523
8.38807
-0.467817
other
K8Bi48I8O72
136
230
2,740.19
mp-1157227
13.415986
8.847478
-0.80407
other
Y8Si12W12O48
80
230
1,054.7
mp-6711
9.115541
0.917852
1.327298
other
Na12Li12Al8F48
80
230
861.26
mp-554003
13.411667
4.711553
-1.51437
other
Sr32Li8B24O72
136
230
1,724.23
mp-1207985
12.913728
8.696499
-1.102561
other
V8Cd12Ge12O48
80
230
980.16
mp-1154662
12.721669
7.950493
-0.544983
other
Y8Si12Sn12O48
80
230
1,103.65
mp-1013849
8.134389
8.31514
-3.264941
other
Li12Fe8Ge12O48
80
230
892.63
mp-1019565
11.82948
7.486504
-0.521437
other
Ca12Ga8Ge12O48
80
230
955.15
mp-1328221
12.162972
8.177928
-1.114593
other
Zn12Cr8Ge12O48
80
230
886.2
mp-559811
-4.306895
-1.488272
-5.416894
other
K24U8Cu48S60
140
230
3,300.7
mp-14047
12.433704
6.733849
-0.770833
other
Al8Cd12Si12O48
80
230
858.44
mp-1328058
11.636052
7.447071
-2.147695
other
Mn8Zn12Si12O48
80
230
836.34
mp-1013807
8.453313
8.511557
-3.416537
other
Li12Co8Ge12O48
80
230
834.49
mp-1013808
7.61457
8.524101
-3.002854
other
Na12Ni8Ge12O48
80
230
892.17
mp-1157674
12.255913
7.358626
-1.523417
other
Al8Si12Ni12O48
80
230
778.34
mp-1214263
10.762947
11.665657
2.19086
other
Ca12Ti12Cr8O48
80
230
1,005.47
mp-1013749
10.595203
7.782978
-1.86583
other
Li12Ti8Ge12O48
80
230
903.49
mp-23882
11.209132
4.174666
-3.772723
other
Ca12Al8H48O48
116
230
1,027.59
mp-6670
13.658746
8.173097
-1.106983
other
Cr8Fe12Si12O48
80
230
831.27
mp-1207682
8.029593
8.299363
-1.891978
other
Yb12Sc8Al12O48
80
230
970.76
mp-6480
13.375
7.72395
-0.903933
other
Mn12Al8Si12O48
80
230
809.68
mp-779404
12.049941
7.869849
-4.872819
other
Li12Cr8As12O48
80
230
893.82
mp-1364220
10.251836
8.123717
-2.596005
other
Zn12Co8Ge12O48
80
230
845.65
mp-1265011
10.702965
7.603234
-2.409566
other
Mg12Cu8Si12O48
80
230
804.22
mp-1207900
7.816267
8.540381
-0.693982
other
Yb8Nd12Ga12O48
80
230
1,108.04
mp-1214423
11.765759
7.39223
0.223118
other
Ca12Lu8Ge12O48
80
230
1,064.23
mp-14052
12.499696
6.562696
-0.418952
other
Ca12In8Si12O48
80
230
970
mp-765598
11.513588
7.683714
-7.633208
other
Li12Fe8P12O48
80
230
815.88
mp-1211386
9.951634
9.380155
0.128599
other
Li12Pr12Te8O48
80
230
1,010.51
mp-1209062
8.769028
8.035038
-1.82961
other
Sr12Yb8Ge12O48
80
230
1,166.86
mp-1207891
11.491757
8.176628
1.630412
other
Y12Al12Cr8O48
80
230
926.67
mp-555393
9.386267
8.43445
-0.491301
other
K8Bi48Br8O72
136
230
2,682.86
mp-1213017
11.05718
8.182085
2.297766
other
Gd12Sc8Al12O48
80
230
982.67
mp-669331
11.750108
7.41585
0.195913
other
Ca12Y8Ge12O48
80
230
1,087.79
mp-1163929
13.276918
8.137553
-0.714525
other
Al8Si12Sn12O48
80
230
934.58
mp-1211542
9.870674
9.398452
0.313016
other
Li12Ho12Te8O48
80
230
948.45
mp-740719
10.733679
4.102096
-3.556948
other
Ba12In8H48O48
116
230
1,483.57
mp-1324099
10.783076
7.868347
-2.440525
other
Mg12Co8Si12O48
80
230
772.81
mp-1211944
7.799103
8.501584
-0.794203
other
La12Yb8Ga12O48
80
230
1,148.82
mp-1327509
12.619534
8.311547
-1.00052
other
Zn12Sn8Ge12O48
80
230
993.78
mp-6239
12.755108
7.958445
-1.619355
other
Mn12Fe8Si12O48
80
230
856.63
mp-1325638
13.171269
8.388067
-0.712714
other
Mg12Ti8Ge12O48
80
230
907.39
mp-1337756
12.560472
8.296917
-0.777341
other
Ca12Ge12Sb8O48
80
230
1,103.35
mp-1324516
13.058352
8.354811
-0.616593
other
Ca12Ti8Ge12O48
80
230
985.26
mp-1330803
12.958797
7.434407
-0.727395
other
Ca12Si12Sn8O48
80
230
1,010.06
mp-1324648
11.146524
8.068716
-1.70722
other
Mg12Fe8Ge12O48
80
230
888.1
mp-757914
14.678402
7.86483
-4.559007
other
Li12Ti8P12O48
80
230
847.42
mp-6213
10.778122
12.407477
-3.48072
other
Na12Sc8V12O48
80
230
1,044.57
mp-1363500
11.159437
8.110153
-2.163482
other
Mn8Zn12Ge12O48
80
230
897.87
mp-1214233
9.59157
11.012905
0.011646
other
Ca12Fe12Sb8O48
80
230
1,050.3
mp-1326042
10.108209
7.799986
-2.336478
other
Ca12Co8Ge12O48
80
230
956.34
mp-677627
9.824257
9.371889
0.142343
other
Li12Nd12Te8O48
80
230
1,026.06
mp-6247
9.626324
0.529941
0.787123
other
Na12Li12Fe8F48
80
230
998.43
mp-1013795
12.533533
8.720284
-2.177496
other
Li12Ge12Mo8O48
80
230
948.06
mp-1363943
11.085703
8.084867
-2.078952
other
Zn12Fe8Ge12O48
80
230
896.87
mp-1163940
13.23748
8.237345
-0.785884
other
Mg12Si12Sb8O48
80
230
937.5
mp-1328117
12.604605
7.321857
-0.81646
other
Mg12Si12Bi8O48
80
230
972.18
mp-1211869
10.783856
8.161603
2.036244
other
La12Sc8Ga12O48
80
230
1,093.66
mp-1211871
10.620111
8.109956
1.335191
other
La12In8Ga12O48
80
230
1,120.7
mp-1324601
9.091724
8.114917
-2.837694
other
Zn12Si12Ag8O48
80
230
875.56
mp-1332100
11.823532
7.927869
-1.193563
other
Zn12Ge12Bi8O48
80
230
1,047.13
mp-1329814
8.997347
8.347662
-2.591696
other
Mg12Ag8Ge12O48
80
230
927.45
mp-14043
13.507207
8.23922
-0.818973
other
Mg12V8Si12O48
80
230
828.69
mp-15103
11.659858
7.454215
0.238376
other
Sr12Y8Ge12O48
80
230
1,165.6
mp-1364208
13.486525
9.055299
-0.874359
other
Mg12Ge12W8O48
80
230
952
mp-14046
14.040821
8.690869
-1.116227
other
Mn12V8Si12O48
80
230
862.47
mp-1210989
10.030121
9.442834
0.069917
other
Li12Er12Te8O48
80
230
902.68
mp-1325923
10.122548
8.060842
-2.364561
other
Zn12Cu8Ge12O48
80
230
870.28
mp-1364177
13.632881
8.241533
-0.86492
other
Al8Cr12Si12O48
80
230
811.53
mp-14051
11.577519
7.242306
-1.8724
other
Ca12Mn8Si12O48
80
230
916.55
mp-1163930
10.318832
7.624231
-2.516978
other
Ca12Co8Si12O48
80
230
895.98
mp-1327259
12.219438
8.102401
-0.926796
other
Mg12Cr8Ge12O48
80
230
876.61
mp-557717
10.032959
11.191269
0.460701
other
Li12Nd12W8O48
80
230
1,009.51
mp-6575
13.135127
4.8321
-1.389624
other
Ba32Na8B24O72
136
230
2,062.8
mp-1157822
12.448314
7.313591
-1.133554
other
Zn12Si12Bi8O48
80
230
976.09
mp-1213328
8.867142
8.375932
-0.17001
other
Eu12Sc8Al12O48
80
230
1,002.44
mp-1020161
13.349642
5.667152
-6.907628
other
Na12Al8P12O48
80
230
803.09
mp-16383
11.834708
7.741388
-4.561225
other
Na12Cr8As12O48
80
230
939.93
mp-1213255
11.13046
8.313356
2.378721
other
Er12Sc8Al12O48
80
230
949.45