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-757404
12.56175
6.660882
-1.245373
other
Li4Cu4Si10O26
44
2
498.69
mp-1201359
7.256029
6.752326
-4.472461
other
Mg1Fe4S6O46
57
2
947.2
mp-1195492
8.003903
5.288252
-6.371985
other
Co4Cu4C4O20
32
2
322.12
mp-584129
12.633427
7.293612
-7.470602
other
Li8Ni4P8O28
48
2
525.22
mp-557001
8.09692
5.868451
-5.076592
other
Rb2S2O8F2
14
2
235.11
mp-801999
8.282658
5.160071
-2.037493
other
Li4Fe4Si8O22
38
2
464.73
mp-1212601
7.509939
6.789001
-3.749562
other
Na3W6N2O31
42
2
701.33
mp-1190837
8.11267
2.704648
-2.16241
other
As2C4O4F12
22
2
357.65
mp-770402
14.303151
5.497272
-2.306296
other
Li6B4Sb2O12
24
2
279.03
mp-1193143
7.834956
9.483003
-3.780424
other
Ba2Cr4As2O20
28
2
440.48
mp-1174450
3.864715
23.159721
-1.298905
other
Li8Mn2Co4O14
28
2
252.63
mp-2217725
12.395626
10.868744
1.708336
other
Mg1Ti2Zn2O6
11
2
146.7
mp-1176794
13.349349
7.892426
-7.353366
other
Li2Cr2P4O14
22
2
269.73
mp-761254
12.830924
7.145581
-7.384309
other
Li10Cu2P6O22
40
2
423.36
mp-1204406
-1.62217
2.08213
-2.69459
other
Nb4Mo6I22O1
33
2
1,501.55
mp-1219260
-7.682405
1.105791
4.938634
other
Sm2Fe17C1N1
21
2
273.75
mp-765771
13.712305
7.473672
-0.868861
other
Li4Fe4Si8O22
38
2
464.73
mp-1042104
12.382819
7.296942
-7.014742
other
Zn4Ni4P8O28
44
2
498.69
mp-817963
7.351719
4.653628
-1.48599
other
P2W2O8F2
14
2
199.15
mp-1323680
7.765193
5.685908
-1.849966
other
Li5Ni3Sb2O10
20
2
198.94
mp-1175707
4.041761
22.703814
-1.330103
other
Li9Mn2Co5O16
32
2
287.21
mp-1182797
6.279751
8.63965
-1.023432
other
Ba2Yb1Bi1O6
10
2
166.75
mp-721875
11.727016
4.025514
-3.583575
other
Ca2B4H16O16
38
2
286.42
mp-1195149
7.930093
2.282789
-4.450444
other
H16Pt2N16O4
38
2
394.88
mp-1175624
3.850771
23.082668
-1.337366
other
Li9Mn2Co5O16
32
2
287.56
mp-1182508
7.856047
5.802903
-3.064221
other
Ba2Bi1Sb1O6
10
2
252.11
mp-1227163
10.329597
11.328114
3.137824
other
Ca4Zr4Ti8O28
44
2
523.97
mp-807769
9.378166
1.905011
-1.279809
other
Li2Co4O3F8
17
2
202.81
mp-1174097
4.304558
22.671652
-1.127511
other
Li6Mn2Co2O10
20
2
179.1
mp-1229045
7.520874
9.630486
1.396588
other
Ba10Ho5Cu15O33
63
2
904.22
mp-859789
12.740058
6.788788
-1.2743
other
Li4Si10Ni4O26
44
2
497.44
mp-1237215
8.220057
2.123097
-4.605599
other
H16C4N16O4
40
2
370.4
mp-1046764
12.673923
10.702012
1.199129
other
Mg4Nb4W2O16
26
2
309.85
mp-753817
8.859072
10.57336
0.891016
other
Sr8Li8Ni4O16
36
2
480.48
mp-540292
10.859901
8.234862
-7.065117
other
Li4Cr4P4O20
32
2
343.36
mp-1041696
13.916516
6.858918
-5.5265
other
Ca2Sn2P4O14
22
2
299.91
mp-1236902
7.539541
6.265082
-3.456022
other
H8I6N2O18
34
2
472.88
mp-1213859
12.757789
5.940248
-6.143207
other
Cs6P6H2O18
32
2
664.72
mp-1189864
10.192333
7.221876
-2.088062
other
Li4Lu2Si2O10
18
2
216.8
mp-768694
10.955763
13.410672
-0.021515
other
Li8Al2Cr6O16
32
2
287.26
mp-763659
10.716583
13.825754
-1.043331
other
Li3V2Fe2O8
15
2
150.82
mp-19134
14.358865
7.219316
-6.030527
other
Ca4Cr4P8O28
44
2
556.65
mp-778583
6.766807
17.948629
-0.987041
other
Li3Mn2Co2O8
15
2
143.12
mp-1175544
3.974055
22.850941
-1.323186
other
Li9Mn2Co5O16
32
2
285.36
mp-1234643
12.811527
6.856106
-1.249434
other
Mg1Mn4Si8O22
35
2
454.67
mp-1641248
14.550389
7.54775
-6.278521
other
Li8Fe4P8O28
48
2
556.5
mp-1278660
10.082518
0.559055
-0.014867
other
Li16Co4O4F20
44
2
451.08
mp-695780
13.989393
7.26216
-7.057217
other
Li8Mn4P8O28
48
2
558.85
mp-557991
8.388668
3.236306
-4.730031
other
H12Pd1N10O8
31
2
317.9
mp-698158
8.544742
2.894462
-5.012978
other
V2H14C8O16
40
2
413.49
mp-1045892
12.601888
11.020603
-0.649407
other
Al1Cu3W4O12
20
2
231.48
mp-1331846
7.891597
4.564279
-1.929297
other
Te4C32O16F48
100
2
1,483.18
mp-1177902
13.91527
7.291395
-7.104579
other
Li8Mn4P8O28
48
2
569.05
mp-504194
14.122994
8.866655
-5.007522
other
Li4Mo4P4O20
32
2
386.25
mp-1200043
7.432893
6.800714
-4.300711
other
U4Cu3S2O34
43
2
676.21
mp-1180910
7.23813
4.87149
-4.561454
other
Mo8C16N4O28
56
2
957.75
mp-1181160
7.38776
6.747882
-4.572563
other
Mn2Fe4P4O32
42
2
722.78
mp-19015
11.095615
11.785198
-3.84916
other
V2Cr2Mo2O14
20
2
297.83
mp-1222228
13.529858
5.53991
-6.721985
other
Na14Mg9P16O56
95
2
1,171.26
mp-1374356
7.814832
5.159051
-1.8029
other
Sr2P4W2O16
24
2
343.6
mp-1204957
7.41063
4.958827
-5.263861
other
K6U2C10O34
52
2
936.17
mp-755267
10.147653
12.376027
-0.215849
other
Li10Co6Sb4O20
40
2
401.14
mp-1333616
9.349049
12.942545
-1.373364
other
Fe13Si2Sb2O28
45
2
541.41
mp-1193342
6.667991
5.950871
-3.871706
other
Ba2Re6S8O14
30
2
632.08
mp-1041683
14.521123
8.055364
-3.875036
other
Ti2Zn2P4O14
22
2
266.02
mp-1390220
7.506831
5.184716
-1.725077
other
Li5Mn1Co2O8
16
2
139.93
mp-1042062
14.390607
7.4871
-6.034098
other
Zn4Cr4P8O28
44
2
511.65
mp-1047173
11.784211
11.246552
-1.862392
other
Y1Co1W2O8
12
2
160.75
mp-1175694
3.7123
23.1103
-1.492143
other
Li9Mn2Co5O16
32
2
278.53
mp-1175170
6.360078
20.326237
-0.446924
other
Li14Mn8Co2O24
48
2
434.54
mp-764951
12.606326
12.423343
-0.05867
other
Li12V4O10F4
30
2
299.47
mp-1175749
3.937762
22.949091
-1.373902
other
Li9Mn2Co5O16
32
2
283.35
mp-1641256
14.461518
8.477937
-6.706373
other
Li4V4P8O28
44
2
506.58
mp-1226314
9.200561
0.332885
0.40367
other
Cs2Co1Cu3F10
16
2
262.11
mp-567743
1.130341
2.247856
-4.768997
other
Al8Sb16Te16Cl32
72
2
2,450.01
mp-1275006
6.347349
13.170444
-1.415939
other
Li4Ni6Sn2O16
28
2
294.3
mp-559071
-3.762311
-1.558743
-5.33267
other
Ag8Bi8S12Cl8
36
2
902.39
mp-1391871
7.485387
4.898734
-1.59769
other
Li2Ti1Cr3O8
14
2
149.71
mp-1178711
4.5747
2.990948
-3.619031
other
Zn2C4Br8N12
26
2
714.97
mp-1306790
8.166456
14.734294
-1.180809
other
Li4Mn6Co2O16
28
2
291.71
mp-1179029
7.058274
5.876701
-4.200564
other
Tc2Pt1N4O8
15
2
240.78
mp-562366
11.250107
9.25005
-0.165303
other
Cs2U3Te2O14
21
2
428.36
mp-759550
13.543166
7.166009
-5.970025
other
Li6Sb6P8O32
52
2
749.45
mp-26884
13.564696
5.949165
-7.548171
other
Li2Ti4P6O24
36
2
466.4
mp-1174190
7.296379
18.585976
-0.348747
other
Li4Mn3Co1O8
16
2
151.82
mp-556755
11.492022
7.543099
-1.070688
other
K2Cu3Ge5O14
24
2
340.91
mp-1174481
3.505482
23.351828
-1.402328
other
Li8Mn2Co4O14
28
2
253.94
mp-1019529
13.623996
4.63507
-1.664995
other
Ba8Al10B12O41
71
2
961.96
mp-766085
12.95058
9.084164
-7.526907
other
Li3V4P6O24
37
2
432.63
mp-1196039
10.335435
4.092681
-4.506698
other
Cu2H20S2O18
42
2
365.03
mp-1277684
6.788128
14.204927
-1.830906
other
Li4Mn2Co6O16
28
2
280.89
mp-757557
14.884689
7.784123
-5.99542
other
Li10V2P6O22
40
2
438.59
mp-26703
8.819397
8.128023
-4.881517
other
Li2Fe4P6O24
36
2
433.94
mp-1639368
6.453252
20.201897
-0.443864
other
Li14Mn8Co2O24
48
2
431.51
mp-1195865
10.308512
9.371263
-1.867815
other
Ce4Te8Cl4O22
38
2
715.35
mp-558136
8.296161
2.28569
-0.993459
other
Te8W2O10F40
60
2
1,096.12
mp-1444506
7.533255
5.150002
-1.720705
other
Li3Mn2Co2O8
15
2
143.12
mp-1385211
7.618986
5.162895
-1.699666
other
Na3Tb3Si6O18
30
2
439.44
mp-1386638
7.800022
5.198335
-2.035219
other
Na5Cu3P4O16
28
2
344.29
mp-667579
7.584795
5.572197
-2.557411
other
Ag4P4Pb2O14
24
2
354.88