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-1213119
12.704657
6.516479
-0.535004
other
Dy2Cu1Si4O12
19
2
238.76
mp-1177772
8.154392
13.946733
-1.068328
other
Li3Cr2Fe3O10
18
2
185.84
mp-17982
11.427926
11.3275
-2.113774
other
Sm2Cu2W4O16
24
2
325.9
mp-1369347
7.676706
5.160196
-2.015672
other
Rb2Na10Be16O22
50
2
557.01
mp-1194238
10.914732
5.837959
-4.639663
other
Mg1V4H8O14
27
2
304.03
mp-753416
13.329926
5.281097
-2.967169
other
Li2Cu2B2O6
12
2
114.51
mp-695894
8.197225
4.075712
-4.512629
other
Nd2H24N6O30
62
2
659.72
mp-807992
7.357515
5.563879
-2.238654
other
V6Fe4Cu2O24
36
2
490.83
mp-555388
9.243264
4.778282
-6.024981
other
K4S4N2O14
24
2
385.8
mp-567975
2.673397
2.724556
-4.749207
other
Al2P2N2Cl10
16
2
471.72
mp-726645
9.78963
7.401604
-5.109622
other
Ba1Al2P2O10
15
2
180.21
mp-26015
12.710057
7.445994
-7.198958
other
Li4Co4P12O36
56
2
706.01
mp-1175537
3.868613
23.017447
-1.334902
other
Li9Mn2Co5O16
32
2
288.84
mp-1147744
15.088996
8.556423
-5.323846
other
Li8V4P4O20
36
2
372.39
mp-1175501
3.490075
23.341208
-1.443717
other
Li9Mn2Co5O16
32
2
292.68
mp-1174394
3.951052
23.051878
-1.28928
other
Li8Mn2Co4O14
28
2
250
mp-2226510
12.901757
10.864949
-0.307539
other
Mg1Zn2Mo3O8
14
2
171.65
mp-1306027
6.865044
13.247465
-1.329455
other
Li4Ti2Fe6O16
28
2
304.51
mp-720921
10.522334
4.994643
-4.040271
other
Na4Te4H8O14
30
2
414.47
mp-754348
9.687249
13.936987
-0.478779
other
Li6Cr3Fe3O12
24
2
224.09
mp-758356
8.766048
1.350949
-4.088765
other
P4H24N14Cl2
44
2
445.24
mp-1223166
6.799681
11.293096
1.10921
other
La4Fe1Ni3O12
20
2
236.48
mp-542161
13.753556
7.482389
-6.787547
other
Mn6Ag4P8O28
46
2
570.5
mp-540421
13.991543
7.344903
-7.101448
other
Li4Mn2P4O14
24
2
278.98
mp-1106265
-4.563172
-3.453596
-3.753795
other
Ba4Y2Ga2Se10
18
2
545.65
mp-1175655
3.545332
23.461958
-1.475986
other
Li9Mn2Co5O16
32
2
282.25
mp-1104379
2.546696
3.145598
-4.303625
other
Rb2Mn2Cl6O4
14
2
369.26
mp-555696
12.889441
6.382993
-0.777998
other
Cs4Nb2Si8O23
37
2
589.92
mp-1408914
7.535065
5.140148
-1.868976
other
Ca2Zn2Si6O16
26
2
350.76
mp-1233537
10.222417
8.055612
-6.793249
other
Mg1Co5P8O28
42
2
569.37
mp-758658
12.899742
6.346347
-0.32433
other
Ca4Al8Si8O32
52
2
663.96
mp-1412166
7.354728
5.097311
-1.690839
other
Li2Co1Ni3O8
14
2
136.93
mp-1291788
12.532845
12.718769
-0.887392
other
Mn4V6Ni2O16
28
2
322.31
mp-1177120
14.200717
7.409941
-6.99641
other
Li10Mn4P6O24
44
2
524.21
mp-704489
5.651556
3.355641
-4.711421
other
Co12C36S4O36
88
2
1,508.03
mp-1222877
-6.969333
1.406285
-4.143407
other
La1Yb1Mo12Se16
30
2
636.73
mp-1180191
8.067533
6.001029
-4.627794
other
Ni1H6S2O12
21
2
355.22
mp-1310376
5.22406
21.162434
-0.875679
other
Li10Mn4Co2O16
32
2
280.09
mp-1345532
7.779481
5.329319
-1.814277
other
Li5Ti2Ni3O10
20
2
181.1
mp-756553
9.269605
12.286702
-0.420405
other
Li5Cu3Sb2O10
20
2
204.28
mp-1272308
11.876243
13.077765
-1.388272
other
Ca2Mn6V8O24
40
2
429.13
mp-1182624
6.958645
4.851006
-4.88601
other
Cu2C8N4O20
34
2
625.37
mp-1352297
7.015722
5.514534
-2.505668
other
Zr6C1I14O10
31
2
1,106.2
mp-1194285
11.79416
11.451489
-3.763624
other
Lu4Mo4Br4O16
28
2
492.19
mp-550763
10.867579
9.564784
-0.852266
other
Co4Sb8Br8O12
32
2
728.42
mp-759197
6.039672
13.237911
-1.477242
other
Li8Fe1Ni9O20
38
2
340.43
mp-680579
4.661186
2.687948
-3.662972
other
Zn4C8S8N8
28
2
595.03
mp-695793
10.892276
5.936713
-4.618817
other
Zn1As4H8O16
29
2
338.75
mp-556418
3.439714
2.778626
-4.380918
other
Al2S2Cl6O4
14
2
363.33
mp-1232429
4.086005
22.588621
-1.350689
other
Li9Mn2Co5O16
32
2
284.46
mp-755824
6.641891
13.65741
-1.197605
other
Li5Fe2Ni3O10
20
2
179.03
mp-1211546
10.0319
11.719187
0.837021
other
K4Li12Ti4O16
36
2
443.58
mp-2240985
8.105898
14.328467
-1.261439
other
Mg1Mn3Ni1O8
13
2
146.2
mp-758195
11.282001
13.528316
-1.213699
other
Li12V4O12F4
32
2
289.33
mp-1188402
10.73136
10.890615
-3.86354
other
Cu3Mo2H2O10
17
2
235.37
mp-1228658
6.172427
11.248133
0.62294
other
Ba6Nd6Co12O34
58
2
725.38
mp-1042631
12.518238
11.073527
-0.858201
other
Y2Ti2W4O16
24
2
302.44
mp-505102
12.028612
8.905302
-5.549942
other
Na2Mo6P6O32
46
2
597.28
mp-795830
7.449814
4.839197
-1.605429
other
Sr2Ni4P4O16
26
2
312.74
mp-662796
5.656956
3.254223
-4.708672
other
Os8C26S4O24
62
2
1,100.08
mp-1195322
9.18348
5.085291
-6.005023
other
Rb2Pd1S8O26
37
2
590.56
mp-31665
10.186432
8.157244
-6.580921
other
Li2Cr4P6O24
36
2
443.31
mp-1236966
5.951618
5.375976
-3.971532
other
Ni1Sn3Cl6O6
16
2
601.32
mp-770904
13.02166
5.690578
-2.956653
other
Li12Mn4B8O24
48
2
483.57
mp-1175210
5.143943
21.998343
-0.679962
other
Li7Mn4Co1O12
24
2
223.21
mp-1196702
8.033422
4.070856
-4.597256
other
Sc4H40N12O56
112
2
1,164.49
mp-1192599
9.140197
7.550639
-5.069136
other
Sr2P4H4O16
26
2
347.33
mp-582378
9.610001
7.401396
-3.552897
other
Gd4Mo2Se6O24
36
2
503.78
mp-755153
10.307272
13.771426
-0.314684
other
Li4Cr3Fe1O8
16
2
148.28
mp-556389
10.416335
9.513926
-1.74601
other
U2Tl4Te4O16
26
2
470.07
mp-1188722
9.79066
9.50601
-2.220388
other
Fe2Te4Cl1O12
19
2
287.72
mp-768687
10.268636
13.815768
-0.330183
other
Li8Cr6Fe2O16
32
2
289.85
mp-755845
11.311698
13.422983
-0.792603
other
Li5V3Ni2O10
20
2
188.03
mp-647708
5.763178
3.270038
-4.642738
other
Bi2Ir6C18O18
44
2
830.86
mp-1663786
11.701636
11.287235
2.187275
other
Mg4Ta4Cr2O16
26
2
308.02
mp-752803
10.209108
0.6427
0.486704
other
Li4Co7O2F14
27
2
318.57
mp-1302354
5.082054
21.353388
-0.9351
other
Li10Mn4Co2O16
32
2
279.64
mp-757278
14.50714
8.296564
-6.95933
other
Li9V3P6O24
42
2
445.08
mp-1345324
7.908328
5.256532
-1.689444
other
Li5Mn3V2O10
20
2
194.36
mp-734160
7.542484
5.62666
-4.206149
other
Na2H10S6O24
42
2
692.97
mp-1047448
11.488035
11.475843
-2.246939
other
Al1Ni1W2O8
12
2
136.66
mp-780543
9.700169
14.113307
-0.924327
other
Li2Mn1Cr3O8
14
2
148.1
mp-730139
8.029181
5.580825
-1.902915
other
Ca2Zr2Ge2O10
16
2
219.85
mp-1194436
-4.426669
-1.595028
-5.500776
other
K4Cu8Bi4S12
28
2
655.09
mp-1174466
3.624763
23.444284
-1.410511
other
Li8Mn2Co4O14
28
2
248.54
mp-1645095
13.044552
8.334606
-0.843089
other
Ca4Cr4Ge8O24
40
2
519.46
mp-1223268
7.874115
11.457188
2.192254
other
La10Mg4Mn6O30
50
2
605.91
mp-1201470
8.298979
2.297769
-0.924444
other
Sb4Os2O4F28
38
2
530.18
mp-2218951
-5.465364
-1.239316
-3.575239
other
Mg1Fe4As4S4
13
2
198.52
mp-1105212
-2.696856
-0.648663
-5.418154
other
Rb4Ag2P2S8
16
2
458.11
mp-1112878
8.81312
1.858575
1.423356
other
K2Ta1Cu1F6
10
2
179.75
mp-677864
7.50377
4.975759
-1.740198
other
Li2Sn4P6O24
36
2
483.04
mp-1174855
3.962726
23.237026
-1.257507
other
Li7Mn2Co3O12
24
2
214.66
mp-554227
9.170028
6.842086
-3.650226
other
Ca2U2Se4O16
24
2
385.24
mp-24391
11.418371
3.901449
-3.879228
other
Mg2B6H30O26
64
2
505.48
mp-752487
10.173861
0.515358
0.271686
other
Li4Co7O2F14
27
2
323.99
mp-1183664
12.753781
6.199893
-0.644485
other
Ca6Si6H2O19
33
2
453.07
mp-1013577
12.967425
7.102017
-6.998762
other
Na8Co4P8O28
48
2
583.87
mp-1175843
3.651858
23.426325
-1.367606
other
Li9Mn2Co5O16
32
2
294.65
mp-24102
9.965873
6.884209
-4.72987
other
V2Fe2H4O10
18
2
199.54