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-1233019
11.539663
0.072649
1.438438
other
Ca1Mn6O4F8
19
1
255.47
mp-1216125
9.64915
8.169981
-0.020616
other
Y4Ge1O8F2
15
1
218.95
mp-1174885
6.345577
20.324163
-0.444545
other
Li7Mn4Co1O12
24
1
218.1
mp-2232414
10.316517
12.963372
-0.295203
other
Mg1Mn4Fe2O8
15
1
181.89
mp-780737
11.370191
10.328115
3.830188
other
Sr4Ta4N4O8
20
1
269.55
mp-2229153
10.169909
11.710528
-0.258498
other
Na4Mg1Fe4O8
17
1
232.4
mp-1247663
7.855144
11.958903
1.974545
other
Ca32Ti12Mn20O88
152
1
1,866.88
mp-2240903
11.576637
12.412361
-0.11802
other
Mg1Cr2Fe2O6
11
1
119.39
mp-753476
12.25206
8.092841
-8.176497
other
Li2Mn4P4O16
26
1
343.12
mp-1312304
8.448919
13.21211
-0.612266
other
Li10Ni6Sn4O20
40
1
391.11
mp-2230754
6.855031
12.93113
-1.8395
other
Mg1Co4Cu3O12
20
1
189.33
mp-1983135
12.893251
7.77355
-6.576455
other
Co4Sb4P8O32
48
1
627.47
mp-1234562
12.926832
12.304997
-0.445078
other
Mg1V12Zn6O24
43
1
484.96
mp-761849
10.746922
12.378325
1.974088
other
Na5Li3Ti5O14
27
1
292.51
mp-1222032
10.685238
11.843384
-0.10423
other
Mn4In2Sb2O12
20
1
259.19
mp-1219351
-7.674515
0.978967
4.753074
other
Sm4Fe31Co3C6
44
1
544.3
mp-768925
7.706934
15.064986
-0.781961
other
Li24Mn7Cr5O36
72
1
627.78
mp-2216105
10.759251
2.213443
0.024775
other
Mg1V6O5F19
31
1
442.53
mp-1174180
3.950007
23.138767
-1.176352
other
Li6Mn2Co2O10
20
1
180.12
mp-775182
14.677763
5.340849
-2.615081
other
Li6Mn8B8O24
46
1
499.58
mp-761008
10.792544
8.913744
-7.383346
other
Li6V6P16O58
86
1
1,180.1
mp-560699
10.874776
11.138509
-2.603919
original
V2Bi2Pb2O10
16
1
266.75
mp-849585
14.874165
5.445827
-2.521723
other
Li10Mn12B12O36
70
1
753.21
mp-2230269
6.217045
13.428676
-2.288987
other
Mg1Fe1Co5O12
19
1
213.92
mp-2230499
5.906928
12.30623
-1.974888
other
Mg1Fe6O10F2
19
1
220.93
mp-849617
14.774426
5.755804
-2.614476
other
Li4Fe8B8O24
44
1
484.47
mp-1175994
3.985615
22.868673
-1.31764
other
Li9Mn2Co5O16
32
1
285.99
mp-1228768
10.538762
11.568459
3.343603
other
Ba2Sr3Nb10O30
45
1
655.6
mp-764932
15.435166
6.127025
-2.237446
other
Li6Fe8B8O24
46
1
486.92
mp-1176196
3.630615
23.426048
-1.399702
other
Li9Mn2Co5O16
32
1
290.26
mp-772104
12.727069
8.695425
-7.937583
other
Li12V6P16O58
92
1
1,171.1
mp-2224827
12.147491
-0.438384
1.214485
other
Mg1Mn4O4F4
13
1
171.25
mp-556783
8.552504
3.692573
-7.272746
other
Na9Li9C9O27
54
1
609.91
mp-1182703
7.052125
6.729924
-4.31752
other
Mg12Fe4C2O47
65
1
1,013.2
mp-1569230
10.194804
7.97973
-6.746599
other
Li4Co4P8O28
44
1
633.39
mp-1411502
7.971374
4.776147
-1.303205
other
Li3Fe4O3F5
15
1
161.98
mp-2220286
10.790031
12.858906
0.321054
other
Mg1Ti8Ni8O24
41
1
426.68
mp-2228407
6.723242
13.060857
-2.357926
other
Mg1Co6O9F3
19
1
207.83
mp-666297
-4.720832
-2.835674
-3.708888
other
K4Ta2Cu2Se8
16
1
487.43
mp-2229120
14.600299
12.127853
-1.425156
other
Mg1V4O5F7
17
1
215.97
mp-2224823
14.394835
11.83219
-0.863899
other
Mg1V4O4F8
17
1
217.58
mp-752572
14.083189
12.296016
-0.486209
other
Li2V3O3F5
13
1
150.32
mp-1177205
11.357668
8.934957
-7.751136
other
Li8V6P16O58
88
1
1,173.48
mp-775280
15.23553
5.903812
-2.408183
other
Li5Fe8B8O24
45
1
485.11
mp-1221784
13.591191
4.126755
-2.527819
other
Na10B18H6O35
69
1
694.04
mp-761181
13.745526
13.070469
-0.821125
other
Li12V8O16F8
44
1
465.65
mp-1291670
11.597753
13.619932
-1.450746
other
Li4V6Co2O16
28
1
290.41
mp-1199236
8.749787
13.177944
-1.14987
other
Zn3Fe16Ni5O32
56
1
592.86
mp-1875676
11.734365
10.441091
0.486997
other
Ca2Sn1W1O6
10
1
130.92
mp-861533
6.841915
11.884633
-1.392778
other
Na8Li8Co4O16
36
1
438.15
mp-1175965
3.762989
23.176586
-1.388533
other
Li9Mn2Co5O16
32
1
286.09
mp-1176164
3.49239
23.367311
-1.446031
other
Li9Mn2Co5O16
32
1
290.14
mp-2230494
12.364302
-0.809969
0.916084
other
Mg1Mn6O6F6
19
1
247.95
mp-757166
9.973707
10.879776
-0.841259
other
Li6Mn2Sb8O24
40
1
456.06
mp-2239842
12.514421
11.093389
-1.755057
other
Mg1Mo2H1O6
10
1
123.79
mp-1176850
13.449203
8.539682
-7.797538
other
Li14V6P16O58
94
1
1,166.12
mp-2218329
12.69787
1.185274
1.95123
other
Mg1Fe4O4F4
13
1
166.34
mp-1229179
-5.262024
-2.802825
-4.208787
original
Al1In3Cu4Se8
16
1
394.13
mp-2230394
7.968106
10.587684
-0.311143
other
Na8Mg1Co2O8
19
1
266.61
mp-2219439
-5.477431
-1.230713
-3.595531
other
Mg1Fe4As4S4
13
1
197.65
mp-849633
10.224833
8.112381
-6.959826
other
Li4Mn8P16O56
84
1
1,035.73
mp-757882
12.710563
8.708386
-7.932511
other
Li12V6P16O58
92
1
1,167.34
mp-1177128
11.841527
7.802665
-8.029233
other
Li10Mn8P16O56
90
1
1,051.84
mp-753705
9.779589
14.680998
-0.890769
other
Li1Mn3O4F2
10
1
109.48
mp-764885
13.238259
5.692431
-3.05689
other
Li1Fe8B8O24
41
1
483.82
mp-768571
11.642344
8.142597
-8.263226
other
Li4Mn12P12O48
76
1
890.23
mp-1076184
7.59299
12.152714
1.646252
other
Sr8Ca24Mn32O80
144
1
1,895.07
mp-774672
10.602492
11.98168
-1.709216
other
Li4Mn1W3O12
20
1
220.37
mp-1234230
5.67669
12.092672
-2.096299
other
Mg1Fe8O14F2
25
1
304.57
mp-1233144
6.915437
9.065968
-1.300759
other
Mg1Ag14Pb6O18
39
1
622.81
mp-774273
12.706168
8.696174
-7.947702
other
Li12V6P16O58
92
1
1,161.69
mp-778177
10.437994
2.814917
1.82004
other
Li2V8O2F22
34
1
440.43
mp-1287634
14.910763
8.002848
-5.432039
other
Li2Cr2P2O8
14
1
155.74
mp-1176685
11.248492
8.005874
-7.913332
other
Li8Mn8P16O56
88
1
1,041.67
mp-2219286
12.134592
12.240462
-2.345834
other
Mg1Mn1V3O8
13
1
212.1
mp-1226351
12.69459
7.39602
-7.533495
other
Cs2Mn4P12O36
54
1
831.04
mp-705085
10.165809
7.900313
-6.518175
other
Li2Cr2P8O26
38
1
532.24
mp-767320
11.185884
7.598357
-2.48614
other
Li3Co2Si2O8
15
1
178.09
mp-1176207
3.445223
23.383474
-1.456357
other
Li9Mn2Co5O16
32
1
291.01
mp-1303460
8.023774
4.706358
-6.574221
other
Li4Co4C8O24
40
1
477.05
mp-1175999
3.828388
23.128695
-1.363493
other
Li9Mn2Co5O16
32
1
285.59
mp-1177824
8.894725
13.131501
0.156733
other
Li32Ti13Cr3O48
96
1
871.65
mp-1076165
7.207476
11.316544
0.905688
other
Sr32Fe28Co4O80
144
1
2,020.46
mp-1176215
3.678182
23.36017
-1.39517
other
Li9Mn2Co5O16
32
1
287.92
mp-1345578
-4.933698
-2.78302
-4.149431
other
Al1In3Cu4Se8
16
1
394.13
mp-2230338
5.967179
12.358079
-1.956493
other
Mg1Fe6O10F2
19
1
220.49
mp-1312705
12.612718
7.247716
-1.721857
other
Li6Mn4Si4O16
30
1
362.45
mp-764652
14.78089
5.751707
-2.607731
other
Li4Fe8B8O24
44
1
487.29
mp-2230681
11.603301
9.356423
1.724743
other
Ho5Mg1Mo2O12
20
1
271.2
mp-1235978
11.06419
7.99787
-1.476646
other
Li1Tl6Si2O7
16
1
372.41
mp-765238
10.195768
2.635234
1.82002
other
Li4V3O1F11
19
1
210.91
mp-776558
14.882101
5.446732
-2.522254
other
Li5Mn6B6O18
35
1
374.49
mp-1233730
14.44081
7.859532
-6.365161
other
Ca1Cr4P4O16
25
1
325.61
mp-1202092
8.170539
6.237895
-5.052612
other
Zr2P4N6O20
32
1
517.14
mp-1234611
5.659677
12.041327
-2.108793
other
Mg1Fe8O14F2
25
1
301.53
mp-759456
11.18888
6.361247
-3.296772
other
Li9Fe4B8O24
45
1
522.76
mp-1174940
3.961313
23.217806
-1.222798
other
Li7Mn2Co3O12
24
1
215.2
mp-764723
13.753685
5.624168
-2.966763
other
Li2Fe8B8O24
42
1
487.57
mp-1228751
6.822944
10.307184
1.113545
other
Ba12Pr4Co8O30
54
1
884.98
mp-583967
9.298573
7.779642
-5.69709
other
Li8Co4P8O32
52
1
717.11