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-768704
10.263721
13.811942
-0.328638
other
Li8Cr6Fe2O16
32
2
289.64
mp-555234
8.012036
1.54835
0.928578
other
Rb2Sb2Br2F6
12
2
287.52
mp-772654
11.353799
7.784363
-7.676657
other
Li8Co4P6O24
42
2
476.24
mp-764865
6.565852
14.206008
-1.689682
other
Li8Fe1Co9O20
38
2
332.68
mp-1219605
13.053893
6.22309
-0.525582
other
Rb2Al2Si6O16
26
2
388.96
mp-781020
13.275419
8.220029
-1.215616
other
Li4V4Si8O22
38
2
434.5
mp-758690
7.154994
14.732183
-1.151105
other
Li4Mn2Ni3O10
19
2
175.42
mp-1175533
3.921397
22.939428
-1.332361
other
Li9Mn2Co5O16
32
2
286.69
mp-768741
9.997988
14.007292
-0.465298
other
Li8Cr6Co2O16
32
2
286.25
mp-697501
10.251095
6.233953
-4.03575
other
V2H4Se2O10
18
2
213.45
mp-768692
8.742722
14.104664
-0.710355
other
Li8Cr2Fe6O16
32
2
302.66
mp-1370081
7.855535
6.173472
-1.52517
other
Li8Cr6Ni2O16
32
2
290.63
mp-1177725
8.231744
13.386755
-0.643095
other
Li6Al2Fe4O12
24
2
250.16
mp-707955
5.467594
3.22566
-4.637672
other
Ru16C48N8O52
124
2
2,147.26
mp-1194610
11.51447
11.04594
-2.363927
other
K8Mg2W6O24
40
2
753.27
mp-765947
11.95365
7.555437
-7.362876
other
Li6Ni9P8O32
55
2
606.44
mp-729641
7.837576
5.068548
-1.673378
other
Li10Mo4P10O36
60
2
670.54
mp-696379
9.723066
2.280003
-2.41444
other
B2H6O2F8
18
2
180.37
mp-1983740
12.553421
7.760099
-6.688853
other
Co4Sb4P8O32
48
2
637.56
mp-1223362
10.383663
10.940878
1.548423
other
La7Ta3W4O30
44
2
599.56
mp-1475733
2.843348
3.104782
-4.239296
other
Pd1Au2N4Cl8
15
2
412.15
mp-756015
12.778429
9.485291
-0.255643
other
Li4Al4Fe4O12
24
2
256.08
mp-1196955
7.863216
8.466103
-3.210032
other
K6Ga2Te4O22
34
2
532.67
mp-1308768
7.2817
18.540295
-0.385007
other
Li8Mn6Co2O16
32
2
304.83
mp-559417
13.691754
4.419544
-1.923612
other
La2B4Cl2O8
16
2
221.58
mp-570869
1.195312
2.292884
-4.158394
other
Li2Nb6In2Cl18
28
2
680.12
mp-1175426
4.268997
22.297529
-1.307176
other
Li9Mn2Co5O16
32
2
280.52
mp-1211822
11.372855
10.972749
-3.701491
other
K8Co2Mo6O24
40
2
743.51
mp-1339913
7.857555
5.382661
-1.701087
other
Li5V2Co3O10
20
2
184.8
mp-1210856
9.325322
7.700665
-5.180132
other
Li2Ga2P2O10
16
2
175.55
mp-605707
12.042642
4.920368
-5.1058
other
Gd8P12H32O46
98
2
1,159.23
mp-1182805
11.596942
6.64828
-1.253566
other
Ca13Si10O34F10
67
2
985.01
mp-1445771
7.421488
4.780121
-1.643301
other
K4P4H4O14
26
2
439.8
mp-573030
-3.447605
-1.172172
-5.372075
other
Cs4Li2Nb2S8
16
2
517.59
mp-754143
10.244225
11.673312
-3.295594
other
Li2V2W2O12
18
2
221.44
mp-26585
13.703985
7.206781
-6.489082
other
Li10Sb4P10O36
60
2
716.81
mp-769868
11.158657
4.0069
-3.860609
other
Li6Bi2H16O14
38
2
330.8
mp-560323
9.140907
3.080756
-5.17089
other
H22C8N2O20
52
2
490.54
mp-1190778
11.570232
5.035369
-4.665666
other
Zn3As2H8O12
25
2
256.17
mp-1233297
14.406852
11.958624
-0.801688
other
Mg1V8O8F8
25
2
294.94
mp-768934
9.999547
14.002248
-0.464175
other
Li8Cr6Co2O16
32
2
286.21
mp-757564
8.018879
16.062006
-0.387951
other
Li5Mn3Fe2O10
20
2
190.37
mp-2240995
9.637444
10.717123
-1.95013
other
Mg1Cu3Te2O10
16
2
216.53
mp-769608
11.657163
13.414537
-0.127873
other
Li8V2Cr6O16
32
2
297.05
mp-1175941
3.820206
23.22525
-1.328939
other
Li9Mn2Co5O16
32
2
289.7
mp-1239143
-5.156683
-0.19284
-5.545983
other
Ti4Cr4Cu4S16
28
2
477.95
mp-1042037
14.345189
7.477732
-6.197422
other
Mg4Fe4P8O28
44
2
502.44
mp-1403321
7.778031
5.265688
-1.865419
other
Li3Co3Sb1O8
15
2
156.21
mp-1223576
-5.621471
1.12709
-4.642752
other
La1Ce1Mo12S16
30
2
555.26
mp-1197142
10.151325
3.362613
-4.482623
other
H36Se6N8O24
74
2
744.16
mp-1275523
5.459037
19.974554
-1.122809
other
Li6Mn2Co4O12
24
2
221.15
mp-1106166
9.720261
7.62694
-5.835246
other
Li2Ga2P2O10
16
2
192.39
mp-556508
11.445213
11.012287
-3.662118
other
K16Th2Mo12O48
78
2
1,391.78
mp-1374032
7.513884
5.037921
-1.753862
other
Li2Cr2Si6O16
26
2
304.03
mp-705375
9.481853
7.829038
-6.012972
other
Li2Ni8P14O48
72
2
918.05
mp-1201827
-4.519827
-5.609214
0.484991
other
Cs13Nb2In6As10
31
2
1,256.24
mp-759838
13.194921
5.622299
-7.275846
other
Na2Sn4P6O24
36
2
497.12
mp-1175612
4.064476
22.687815
-1.326788
other
Li9Mn2Co5O16
32
2
285.15
mp-1344325
12.408092
7.368133
-6.99552
other
Zn4Ni4P8O28
44
2
494.45
mp-558429
11.805119
11.091988
-3.395948
other
Na2Fe8Mo10O40
60
2
901.04
mp-772557
12.705232
8.690757
-7.953259
other
Li12V6P16O58
92
2
1,166.46
mp-1313908
12.62008
13.408556
-0.703824
other
Li4Ti2V6O16
28
2
304.21
mp-1193540
10.868617
6.38192
-4.887045
other
V4Cu2H6O14
26
2
276.69
mp-24407
11.736967
4.697636
-5.046702
other
Cd2P4H12O14
32
2
350.16
mp-1348186
7.843277
5.261323
-2.143695
other
Na4Co2P4O14
24
2
290.85
mp-1223055
9.227986
10.938674
2.336897
other
La8Mg2Cr6O24
40
2
490.2
mp-1180423
6.379645
5.782749
-3.743922
other
Mg1Te1Cl6O6
14
2
283.14
mp-763752
7.553706
13.729438
-1.162803
other
Li3Mn2Ni2O8
15
2
142.09
mp-1542939
13.792276
8.194872
-5.75851
other
Ba1Mo1P2O8
12
2
178.95
mp-555752
11.605487
11.119498
-3.650217
other
Na2Fe4Mo6O24
36
2
549.68
mp-1174393
4.154994
22.653936
-1.278259
other
Li8Mn2Co4O14
28
2
246.74
mp-758419
14.069711
7.915528
-7.152955
other
Li10V2P8O28
48
2
516.32
mp-723093
10.165807
4.338072
-4.114396
other
Na5H29I2O24
60
2
617.38
mp-1212629
8.192059
2.204153
-4.637071
other
H22C4N22O6
54
2
584.83
mp-1175158
6.462125
20.184019
-0.44896
other
Li7Mn4Co1O12
24
2
214.81
mp-1377395
7.633361
5.377253
-1.79435
other
Li5Mn2Ni3O10
20
2
174.94
mp-2228828
8.726838
3.517132
-7.390441
other
Mg1V2C4O12
19
2
204.76
mp-1222571
12.952369
6.410425
-0.650929
other
Li2Al2Si6O16
26
2
317.75
mp-556434
-2.54213
-0.520526
-5.413399
other
Ag2Bi2P4S12
20
2
457.33
mp-557186
13.727869
5.805574
-7.344342
other
Cs2Ta4P10O36
52
2
802.52
mp-1304149
6.349882
13.186359
-1.416114
other
Li4Ni6Sn2O16
28
2
293.62
mp-1200791
11.44551
7.942461
-3.009926
other
In8As10Br6O24
48
2
947.88
mp-707840
11.072278
3.954619
-4.077873
other
Na4Si2H20O16
42
2
405.15
mp-780235
13.038778
5.986831
-7.116031
other
Li2Sn4P6O24
36
2
488.05
mp-779959
6.269561
13.871096
-1.683818
other
Li3Co2Ni2O8
15
2
135.33
mp-720430
12.309065
4.17168
-3.188013
other
Ca2B6H14O18
40
2
358.71
mp-558108
7.898569
6.760719
-3.674298
other
U3Tl2I4O20
29
2
521.59
mp-769574
10.258178
12.412004
-3.169616
other
Li7V6Ni5O24
42
2
427.12
mp-1227651
-7.523918
0.865073
4.852157
other
Ce2Fe20Si2C1
25
2
320.27
mp-558607
9.807288
9.684206
-0.901286
other
K6B2Sb8O26
42
2
601.69
mp-1192711
8.36881
6.187766
-5.405231
other
K2Pt2S4O18
26
2
398.98
mp-558070
11.272296
11.106421
-3.540681
other
K6U2Mo4O21
33
2
600.6
mp-758816
10.664401
8.088058
-7.229684
other
Li4Mn2P4O16
26
2
276.57
mp-1374455
7.544811
5.200923
-1.85204
other
Li2Mn2Si6O16
26
2
307.26
mp-1214206
4.964466
4.262562
-4.060183
other
Cr2N8Cl4O6
20
2
391.51
mp-768711
15.201468
6.594957
-2.077994
other
Li4Cr4B4O12
24
2
247.94
mp-754035
6.133678
13.140282
-1.437135
other
Li4Fe2Ni3O10
19
2
178.31
mp-1280871
6.264269
10.597189
0.77855
other
Ca4La8Co4O24
40
2
529.93
mp-1330331
13.973269
6.996172
-5.354078
other
Ca2Sn2P4O14
22
2
303.1
mp-1228898
7.102793
11.223253
0.817631
other
Ba5Eu5Fe10O26
46
2
627.97