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-26100
9.123154
7.813528
-5.146894
other
Bi8P12O48
68
14
1,050.15
mp-767516
-5.472581
-5.184078
-0.3224
other
Li36Sb12S4
52
14
1,021.6
mp-555682
9.24964
7.105052
-3.515179
other
Sn2Se4O12
18
14
269.22
mp-768423
-3.814064
-0.524008
-5.441813
other
Li12V4S16
32
14
631.53
mp-775762
12.56079
6.874912
-5.591271
other
Ag4P4O12
20
14
264.73
mp-30094
7.400061
1.835121
-4.005239
other
H16C8N16
40
14
450.07
mp-1029625
1.495037
1.981292
2.169105
other
Li8Ta8N16
32
14
322.18
mp-770818
8.518474
10.968147
-0.119339
other
Li12Cu20O16
48
14
616.07
mp-4138
8.69485
3.820087
-7.08855
other
Rb8C4O12
24
14
430.43
mp-29516
-0.779466
1.02176
-4.123504
other
Bi28Rh4Br32
64
14
2,450.88
mp-775220
12.050307
8.738744
-2.11937
other
V4Ge8O24
36
14
459.23
mp-760196
8.583952
2.310386
-1.042675
other
Cr8O8F32
48
14
755.44
mp-1214253
5.477558
2.970319
-3.706649
other
C16Se4Br16
36
14
987.29
mp-758670
10.018825
2.293372
2.058993
other
Li12V4F20
36
14
423.84
mp-770773
10.005307
4.434881
-6.792737
other
Rb8S8O28
44
14
736.96
mp-1179954
10.622666
11.061165
-2.185331
other
Pb4W4O16
24
14
353.22
mp-19148
10.584913
10.728549
0.49608
other
K4Mn4O6
14
14
225.35
mp-779332
12.164677
5.723776
-3.83556
other
B8Te4O24
36
14
496.61
mp-23434
1.870887
2.430525
-5.068069
other
Al4Cu2Cl16
22
14
606.87
mp-1216301
-4.938864
-4.026063
6.128803
other
Y18Si40Os8
66
14
1,245.71
mp-27212
8.237739
2.207025
-0.934927
other
Sb8I4F60
72
14
1,092.77
mp-1203825
6.822309
6.405356
-3.776762
other
Y4I4O36
44
14
711.08
mp-766727
10.439184
12.945987
-0.349284
other
Li10Fe22O32
64
14
629.15
mp-705872
9.045215
11.445423
-1.570682
other
Ni34As12O64
110
14
1,128.23
mp-1211784
-1.250369
2.046225
-1.682355
other
K4Ba8I20
32
14
1,447.37
mp-542084
13.503839
7.238569
-6.91773
other
Mn4P16O44
64
14
911.6
mp-26286
9.067373
7.846058
-5.026585
other
Bi8P12O48
68
14
1,016.55
mp-5732
12.178696
6.672017
0.44489
other
La8Si8O28
44
14
630.59
mp-778795
10.881371
11.536048
2.162356
other
Ta8Zn16O36
60
14
662.9
mp-541668
13.069612
7.232156
-6.417321
other
Sb8P16O56
80
14
1,059.65
mp-776727
10.23052
1.77676
2.133008
other
Li8Fe12F32
52
14
721.23
mp-1213596
11.323239
11.329361
-3.028562
other
Fe16W24O96
136
14
2,327.48
mp-1176564
9.661475
8.781971
3.270539
other
Li4Tm4O8
16
14
194.54
mp-753852
9.044062
3.025506
-0.099621
other
W4O4F16
24
14
392.28
mp-30525
11.45848
11.438262
-2.438794
other
V4Te4O16
24
14
304.87
mp-760179
9.406492
1.083368
-0.289361
other
Cu6O4F4
14
14
162.7
mp-669523
8.204903
2.076382
-0.481367
other
U4Sb8F60
72
14
1,451.35
mp-779874
10.332764
0.883411
1.527798
other
Li24Mn12F48
84
14
1,009.72
mp-1211654
8.170205
0.872353
1.707741
other
K6Dy2F12
20
14
367.9
mp-1194903
9.637953
7.860611
-3.271034
other
Bi8P4O24
36
14
496.38
mp-31276
0.996981
1.942111
-5.26414
other
Cd8P4Cl8
20
14
506.7
mp-1183302
-4.706699
-5.170455
0.332469
other
Ba4Ga8As8
20
14
529
mp-31068
11.712366
6.947576
-4.117404
other
P8Pb16O36
60
14
956.95
mp-1182727
7.585363
7.769449
-3.905042
other
Co2Mo12O68
82
14
1,579.41
mp-1220556
-0.175975
1.438643
-4.047785
other
Nb4Br12O4
20
14
561.59
mp-1196536
8.520899
7.150572
-4.270936
other
Np8Se4O36
48
14
787.95
mp-4199
9.752006
4.670815
-6.155757
other
Na8S8O12
28
14
459.63
mp-638261
11.224369
7.635726
0.922898
other
La8Ge4O20
32
14
486.51
mp-772566
11.711845
11.158701
-2.434829
other
Ho8W12O48
68
14
1,464.84
mp-556711
8.674255
10.698607
0.0496
other
Mn8Bi8O24
40
14
554.78
mp-1193103
7.276093
6.654762
-3.817626
other
Cu4Se4O20
28
14
437.04
mp-771911
12.043365
7.606189
-6.823999
other
Ni12P8O32
52
14
581.66
mp-769345
8.456553
10.810411
1.690786
other
Ho12Re4O32
48
14
570.23
mp-728970
7.873455
5.375988
-6.077362
other
Mg4C8O24
36
14
553.41
mp-1197377
13.467847
5.244792
-6.343117
other
Ca72P48O192
312
14
4,444.99
mp-1197378
7.784667
7.788633
-3.928709
other
Mn8Se12O48
68
14
1,056.93
mp-29739
-5.270524
-6.096943
0.658642
other
Na40Sn8Sb24
72
14
2,163.98
mp-1047086
8.98711
9.657445
-3.51385
other
Mo2Ir2O12
16
14
204.69
mp-27297
2.187435
2.88983
-4.531717
other
Re8Cl32O8
48
14
1,477.34
mp-29124
2.382936
2.904979
-4.311702
other
Se16N8Cl40
64
14
1,959.13
mp-1190526
14.28641
7.421099
-4.721989
other
Pu4P4O16
24
14
293.59
mp-557042
13.49253
7.299738
-6.904633
other
Mn4P16O44
64
14
876.4
mp-553960
8.413064
10.378026
0.201218
other
K8Fe4O10
22
14
368.12
mp-769239
11.686502
10.581462
1.472739
other
Ce4Re4O16
24
14
310.42
mp-21577
-3.415314
-4.681083
0.753331
other
Na24In8P16
48
14
1,049.56
mp-777919
7.608259
10.55214
-0.547952
other
Na12Co4O12
28
14
419.56
mp-1208299
-2.304358
-2.118901
-5.528534
other
Tb4S4Br4
12
14
314.58
mp-1178278
5.222402
11.760433
-2.369539
other
Fe10O16F4
30
14
326.28
mp-1211448
-1.165473
2.086778
-1.85448
other
K4Sr8I20
32
14
1,315.42
mp-1020709
11.005572
7.758861
0.903848
other
Sr10Ga12O28
50
14
754.37
mp-727023
11.247962
5.57797
-2.874483
other
Be4B16O32
52
14
578.55
mp-779474
8.657708
12.43724
-0.181728
other
Li32Fe8O28
68
14
697.17
mp-1238219
9.917273
9.431153
1.040705
other
Ho4Sb4O16
24
14
296.16
mp-1214363
6.62761
2.762088
-3.75982
other
C32Cl16O12
60
14
1,063.57
mp-29073
-5.491182
-2.08412
-1.577416
other
Nb8Ge4Te16
28
14
776.47
mp-504265
9.182524
7.803787
-5.696372
other
Cu4P4O16
24
14
267.39
mp-1178445
14.279179
7.5233
-6.077695
other
Cr8P16O48
72
14
927.09
mp-770390
7.729195
9.947276
-3.905201
other
Li8Cr16O52
76
14
1,186.69
mp-752405
11.80386
7.118193
0.719313
other
Dy8Si4O20
32
14
409.89
mp-561084
10.654185
8.145797
2.321228
other
Nd16Al8O36
60
14
903.22
mp-27700
10.85367
9.271123
-0.810768
other
Sb8Br4O10
22
14
462.42
mp-1200077
9.367001
6.941464
-5.250687
other
Mn8P16O40
64
14
1,213.31
mp-607169
-7.733689
-4.579294
3.238172
other
Eu4Ge8Pt8
20
14
455.95
mp-28414
11.181005
8.429031
1.297798
other
Nd8Ge4O20
32
14
501.6
mp-25950
13.10334
6.985225
-6.448898
other
Sb4P8O28
40
14
583.47
mp-1102534
-5.40032
-1.562379
-2.071606
other
P4Os4S4
12
14
182.24
mp-755771
11.836447
7.129705
-3.667249
other
Sr6As4O16
26
14
457.1
mp-510661
7.561803
6.582339
-3.03749
other
Gd4I12O36
52
14
780.4
mp-776642
10.17965
1.899547
2.132955
other
Li4Fe6F16
26
14
345.03
mp-29224
7.081917
4.06383
-4.641691
other
S12N8O20
40
14
676.95
mp-1194038
-8.600806
-6.213607
2.366669
other
Na4Ga8Au16
28
14
538.96
mp-1196285
7.37585
6.309672
-4.614289
other
S12N24O24
60
14
1,144.44
mp-1192494
13.819504
8.771715
-1.199198
other
Fe8Si4O16
28
14
319.75
mp-776036
9.953436
12.513585
-4.158717
other
Li4V24O60
88
14
1,103.26
mp-1236840
9.871944
9.498607
0.954232
other
Dy4Sb4O16
24
14
298.57
mp-1197422
9.16037
6.436627
-3.580397
other
Ca4B12O32
48
14
592.78
mp-555558
12.567798
7.586985
-1.972869
other
Co8Si4O16
28
14
303.19
mp-16163
8.221465
10.57632
1.698024
other
Pr12Re4O32
48
14
655.41
mp-556091
-3.336618
-0.799717
-4.906986
other
Cs12Ta8S44
64
14
1,954.23
mp-1183036
6.400417
5.54803
-4.301219
other
Al4N12O72
88
14
1,906.92