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-779900
6.194717
13.721539
-1.636273
other
Li4Co2Ni3O10
19
2
170.41
mp-1229067
7.596759
9.538553
1.422526
other
Ba10Y5Cu15O32
62
2
916.55
mp-765592
12.5951
7.358368
-7.536564
other
Li4Ni2P4O14
24
2
260.56
mp-780964
7.349211
4.731352
-1.606758
other
Li4Cr2P4O14
24
2
282.79
mp-1175868
4.13348
22.537495
-1.320247
other
Li9Mn2Co5O16
32
2
286.01
mp-17540
9.531743
6.93533
-3.419927
other
Sr4Co2Se6O18
30
2
475.14
mp-1182559
7.225624
5.284479
-4.86166
other
Ba2Cu2C8O28
40
2
607.9
mp-1200782
10.428471
3.866599
-4.280663
other
Na4H32S2O24
62
2
556.27
mp-560314
10.352507
4.332754
-5.321744
other
In4H20S6O34
64
2
724.4
mp-2218843
9.163743
3.020027
0.54958
other
Mg1W2O2F8
13
2
212.25
mp-1080610
2.033807
3.033138
-4.757182
other
Cs2Mn1Cl4O2
9
2
272
mp-985701
11.378202
7.55876
-4.264347
other
Ag2As6H4O18
30
2
373.6
mp-758922
7.550602
13.628089
-0.916893
other
Li8Ti4Ni6O20
38
2
357.92
mp-1192505
11.831013
11.275462
-2.259191
other
Y4W4Br4O16
28
2
522.26
mp-1400982
7.369499
5.11097
-1.717045
other
Li2Mn1Ni3O8
14
2
138.16
mp-1174868
3.956675
23.200176
-1.227171
other
Li7Mn2Co3O12
24
2
215.81
mp-1307881
10.169222
13.904196
0.256707
other
Li6Ti2Mn8O16
32
2
328.19
mp-1105550
13.616736
7.830236
-0.757454
other
Na2Ti2Si4O12
20
2
224.34
mp-1215150
9.662662
8.515266
-2.444939
other
Ag6H3I1O6
16
2
213.88
mp-769545
6.35182
13.560734
-1.288566
other
Li10Fe1Ni9O20
40
2
348.2
mp-753264
13.360432
8.883651
-7.148886
other
Li4V4P4O20
32
2
400.96
mp-755996
7.086136
13.617165
-0.997083
other
Li5Fe3Cu2O10
20
2
185.41
mp-1194506
6.523454
5.985242
-4.138039
other
Ca2Re6Se8O12
28
2
583.49
mp-1101527
13.175913
7.980186
-7.355715
other
Li2Cr8P14O48
72
2
893.93
mp-555083
8.620233
3.263711
-5.619989
other
Na3H5C4O8
20
2
239.15
mp-1311252
9.025584
14.491822
-0.685239
other
Li4Mn6Sb2O16
28
2
320.99
mp-556661
12.849929
5.968737
-1.739932
other
Y4Si2C2O14
22
2
259.2
mp-1214986
10.88989
10.869751
-3.642598
other
Ag6Mo6As2O26
40
2
567.29
mp-652711
5.507649
3.156618
-4.588549
other
Bi8Ru12C36O36
92
2
1,841.7
mp-774676
10.217129
5.094623
-4.356288
other
Ca2V10H38O46
96
2
975.97
mp-584817
9.990726
8.273
-6.862348
other
Li2Co10P16O56
84
2
1,032.14
mp-24364
11.516593
5.913955
-4.319633
other
Ca2As4H8O16
30
2
346.72
mp-1175225
6.310858
20.454527
-0.437455
other
Li7Mn4Co1O12
24
2
219.76
mp-1175856
3.485453
23.322639
-1.450783
other
Li9Mn2Co5O16
32
2
291.24
mp-1305382
9.984845
14.125209
0.187661
other
Li8Mn6Nb2O16
32
2
329.15
mp-2224452
10.278498
10.509501
0.63231
other
Na1Mg1Ni1O2
5
2
73.81
mp-755925
11.969051
8.231472
-1.051981
other
Li4Al4Co4O12
24
2
240.28
mp-1345407
7.740649
5.329918
-2.157494
other
Li2Sn2P4O14
22
2
289.87
mp-1173885
7.650754
16.445301
-0.655432
other
Li4Mn2Co2O8
16
2
145.61
mp-652337
5.983436
3.502667
-4.59611
other
Fe6Te4C18O18
46
2
797.8
mp-726359
8.605998
5.639537
-2.188136
other
Ca2Si2Sn2O10
16
2
202.97
mp-1221306
7.254292
7.068784
-4.019172
other
Nd2Te1Mo6O46
55
2
971.95
mp-1201685
10.539979
4.21006
-5.560454
other
Er4H16S6O32
58
2
610.87
mp-861746
12.549307
13.072392
-0.408802
other
Li8V6Cr2O16
32
2
303.72
mp-1366216
10.350581
8.149611
-3.88018
other
Cu8Sb8As16O56
88
2
1,488.78
mp-1174569
3.989499
23.130039
-1.234296
other
Li7Mn2Co3O12
24
2
214.54
mp-698050
10.642598
10.412636
1.535495
other
La5Co1Re3O16
25
2
329.48
mp-733838
10.328651
3.038958
-4.430318
other
P4H20N8O12
44
2
494.76
mp-770880
11.445555
6.209554
-3.402807
other
Li6Ni2B4O12
24
2
256.17
mp-1215341
8.42502
7.549006
-4.94362
other
Zr1Cu1P2O12
16
2
235.78
mp-1175802
3.495711
23.399069
-1.445633
other
Li9Mn2Co5O16
32
2
288.6
mp-1210446
13.282149
6.448818
-6.020421
other
Na3P6Pb2O18
29
2
426.71
mp-1317583
9.92578
13.934466
-0.513423
other
Li8Cr6Ni2O16
32
2
291.48
mp-1380343
6.777944
5.577796
-3.934246
other
K2La2C8O22
34
2
578.81
mp-780674
14.644375
5.254883
-2.635926
other
Li6Mn8B8O24
46
2
502.93
mp-558717
11.550931
7.764442
-4.627403
other
Li4U4As4O24
36
2
526.98
mp-757784
14.051215
8.379642
-7.461775
other
Li16V6P16O58
96
2
1,162.84
mp-818175
7.525908
4.975188
-1.851678
other
V2P2O8F2
14
2
175.82
mp-886210
12.832506
7.421111
-7.18408
other
Li5Ni6P8O28
47
2
509.08
mp-2230668
6.807892
13.074945
-2.464307
other
Mg1Co6O8F4
19
2
205.38
mp-25432
14.238183
9.067842
-4.392907
other
P2W2O8F2
14
2
199.15
mp-541763
11.396335
4.814238
-4.723231
other
Mn5As4H22O26
57
2
563.25
mp-540477
13.584873
7.283692
-7.119604
other
Li2Mn1P4O12
19
2
233.2
mp-1203991
9.163475
5.112465
-5.955703
other
K2Pd1S8O26
37
2
573
mp-1237354
8.31524
3.395633
-4.796641
other
H14C4N14O12
44
2
446.79
mp-1047139
12.135045
10.918088
0.323397
other
Ca2V1W1O6
10
2
123.59
mp-738668
8.643842
3.204638
-5.532729
other
Na6H18C12O24
60
2
735.08
mp-556010
11.56057
11.379615
-3.889512
other
Lu2Mo2Cl2O8
14
2
240.98
mp-706291
13.728999
4.267522
-2.346708
other
Ca4B16H4O30
54
2
542.83
mp-1217221
-4.429606
-0.229751
-4.361625
other
Ti4Fe1Co1S8
14
2
217.23
mp-540313
14.025993
7.498658
-6.404707
other
Li2Fe2P6O18
28
2
326.96
mp-769502
11.581733
12.316396
0.397215
other
Li8Nb4Fe6O20
38
2
418.7
mp-886023
7.61225
5.069189
-1.574939
other
Li5Fe3Sb2O10
20
2
211.3
mp-1228903
7.334177
9.669123
1.281982
other
Ba10Y5Cu15O34
64
2
903.72
mp-1217628
14.372197
7.429109
-6.154818
other
Ti12Mn5P18O72
107
2
1,377.53
mp-559387
10.613052
12.295271
-3.826772
other
Mn3V6Fe4O24
37
2
496.44
mp-1648759
12.977281
8.354298
-0.908267
other
Zn4Cr4Ge8O24
40
2
508.03
mp-733929
11.987802
5.08876
-5.210603
other
P4H8Pb2O16
30
2
369.46
mp-1042041
13.770512
7.304066
-6.791478
other
Mn4Zn4P8O28
44
2
513.31
mp-555576
10.02215
4.479062
-6.854023
other
K2Na2S4O14
22
2
326.49
mp-987731
0.811994
2.105146
-3.320331
other
Na1La6Os1I12
20
2
1,469.26
mp-572284
8.244394
2.336894
-0.887969
other
Sb4Xe4O4F36
48
2
844.84
mp-1237313
12.763167
9.570776
0.223124
other
Ca6As4W20O16
46
2
820.32
mp-1217243
9.725385
9.583307
-1.440624
other
U3Te5Pb8O32
48
2
727.43
mp-2216938
11.521866
11.212411
-2.629382
other
Mg1Hg8W8O28
45
2
706.99
mp-755736
10.075091
12.814621
-0.001431
other
Li5Nb2Ni3O10
20
2
191.81
mp-863376
10.853689
4.1321
-4.084668
other
Na18Cr4H54O42
118
2
1,076.25
mp-1211812
-0.380333
0.709636
-3.708384
other
K4Zr6Fe1Br18
29
2
1,009.11
mp-762657
13.990078
7.5031
-6.416102
other
Li2Fe2P6O18
28
2
344.93
mp-1174872
3.991338
23.161264
-1.23789
other
Li7Mn2Co3O12
24
2
215.57
mp-1173895
6.369055
19.223841
-0.766904
other
Li4Mn2Co2O8
16
2
149.7
mp-1193947
2.335631
2.597683
-4.399197
other
Bi2W4Cl16O4
26
2
722.32
mp-1176596
10.212488
2.457519
0.49441
other
Li2V6O2F22
32
2
433.35
mp-756861
10.475227
10.044644
3.194371
other
Li1La4Ti3O12
20
2
248.83
mp-760242
10.247981
1.855023
-0.133211
other
Li2V2O2F8
14
2
189.04
mp-727792
10.567221
7.589155
-1.962964
other
Na2Cd4Ge6O18
30
2
413.6
mp-1019526
13.728208
4.481125
-2.015684
other
Ba3Si2B6O16
27
2
321.08
mp-1174433
4.078601
22.840912
-1.273057
other
Li8Mn2Co4O14
28
2
247.71
mp-18698
8.706416
3.619138
-7.127978
other
Cs4Pr4C8O24
40
2
627.39
mp-1047030
11.416197
11.093418
2.469722
other
Ca4Nb4Cr2O16
26
2
341.67