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-761137
11.145057
12.967859
0.419303
other
Li10Ti3Mn5O16
34
1
332.44
mp-805574
7.652495
5.12855
-1.780793
other
Li16Cr16P16O64
112
1
1,479.26
mp-2220699
5.565186
12.018755
-2.095797
other
Mg1Fe8O14F2
25
1
275.84
mp-2229645
13.610794
12.443784
-3.293408
other
Mg1V4O7F5
17
1
212.48
mp-2228985
9.680331
8.879082
0.275187
other
K6Mg1Sb2O8
17
1
325.44
mp-1174745
3.865361
23.22229
-1.304766
other
Li8Mn2Co4O14
28
1
252.24
mp-1376805
9.95755
2.718681
1.658207
other
Li3Fe5O1F11
20
1
234.34
mp-1177204
11.375009
8.951078
-7.741718
other
Li8V6P16O58
88
1
1,170.96
mp-1233711
11.258723
12.3442
-3.373989
other
Ca1V4Ni2O12
19
1
256.02
mp-758649
13.673056
7.236251
-6.734994
other
Li4Fe1P6O18
29
1
351.21
mp-1216315
10.053679
8.173083
0.306171
other
Y14Ge4O29F5
52
1
747.62
mp-2231854
11.449162
10.631904
0.165806
other
Na8Mg1V2O8
19
1
277.43
mp-1234115
10.016527
0.896872
0.085339
other
Ca1Co6O2F10
19
1
262.48
mp-1234598
12.702942
12.423039
-1.437578
other
Ca1V6O11F1
19
1
251.64
mp-759661
7.621624
12.08903
-0.752183
other
Li28Fe4O20F4
56
1
583.29
mp-2220726
13.31318
0.665735
1.464768
other
Mg1Fe8O8F8
25
1
310.49
mp-1225480
7.813401
4.668443
-6.062423
other
K8Ti4C16O45
73
1
1,187.92
mp-780509
14.676026
5.295722
-2.623873
other
Li6Mn8B8O24
46
1
503.78
mp-849712
11.18526
3.195849
1.673872
other
Li6V8O6F18
38
1
436.76
mp-1234886
6.911158
11.481438
-1.249959
other
Ca1Tl4Ni4O12
21
1
267.43
mp-25948
11.246931
8.601813
-7.652568
other
Li2V2P8O26
38
1
562.21
mp-849589
15.229092
5.914561
-2.404686
other
Li5Fe8B8O24
45
1
485.82
mp-768842
8.045957
14.063293
-0.877739
other
Li24Mn5Cr7O36
72
1
631.85
mp-2228408
13.223029
0.875317
1.788488
other
Mg1Fe6O6F6
19
1
228.09
mp-1293011
10.790472
2.882443
1.880046
other
Li8V4O4F12
28
1
296.82
mp-1235887
7.80115
9.176521
-1.500627
other
Li1Al4Tl4O12
21
1
227.16
mp-1235074
7.06143
11.45847
1.261053
other
Li1Lu4Co4O12
21
1
224.53
mp-861689
10.913065
13.297771
-0.202917
other
Li15Cr15Si1O32
63
1
579.92
mp-1301550
13.296366
12.608141
-0.545104
other
Li8V4O8F4
24
1
216.24
mp-2230936
6.531755
13.399915
-2.193736
other
Mg1Ti1Co5O12
19
1
211.85
mp-2228342
8.791069
14.928659
-1.180706
other
Mg1Mn6O10F2
19
1
218
mp-757904
10.797746
8.915668
-7.389159
other
Li6V6P16O58
86
1
1,177.59
mp-831192
7.491558
4.888541
-1.646981
other
Li6Cr4P6O24
40
1
460.93
mp-1176237
3.905858
23.038506
-1.335476
other
Li9Mn2Co5O16
32
1
288.24
mp-1239212
-5.445553
-0.238665
-5.717978
other
Nb2Cr6Cu4S16
28
1
563.38
mp-2210677
11.706937
10.377012
0.857654
other
Na1Mg1Mn1O2
5
1
85.11
mp-2217620
14.339931
8.200569
-4.437885
other
Mg1Mo1P2O7
11
1
150.68
mp-2220857
10.547948
11.074295
1.280369
other
Mg1Sc4Fe4O12
21
1
243.52
mp-1176826
14.018421
8.37359
-7.487343
other
Li16V6P16O58
96
1
1,171.3
mp-776318
5.914274
13.010939
-1.596838
other
Li8Fe4Ni12O32
56
1
547.86
mp-849717
10.936293
8.114514
-7.66075
other
Li6Mn8P16O56
86
1
1,019.04
mp-1176290
3.917322
23.00881
-1.327549
other
Li9Mn2Co5O16
32
1
287.62
mp-1181028
9.747586
7.099165
-2.562632
other
K6Al6Si6O32
50
1
806.16
mp-1217216
12.722809
6.129342
-6.19767
other
Zn28Cd8P24O96
156
1
1,896.73
mp-2228844
13.133384
0.846324
1.658165
other
Mg1Fe6O6F6
19
1
246.02
mp-772139
12.728595
8.703112
-7.935096
other
Li12V6P16O58
92
1
1,160.13
mp-1177074
13.096472
7.44027
-7.781054
other
Li14Mn8P16O56
94
1
1,089.71
mp-1175194
6.363719
20.325136
-0.44329
other
Li7Mn4Co1O12
24
1
217.73
mp-1215775
-4.510665
-1.458496
-6.220378
other
Zn6In2Cu2S10
20
1
414.8
mp-863397
10.780784
8.899981
-7.377474
other
Li6V6P16O58
86
1
1,170.97
mp-758949
11.405749
8.211727
-2.49473
other
Li2V1Ga3O8
14
1
190.32
mp-663963
-3.578233
-1.147004
-5.368578
other
Rb4Ta2Cu2S8
16
1
472.47
mp-2230599
12.757526
-0.621062
0.396779
other
Mg1Mn6O7F5
19
1
227.47
mp-2228418
6.327353
8.847286
-0.647008
other
Ho2Mg1Bi4O12
19
1
289.98
mp-1233959
13.283373
0.699447
1.681376
other
Mg1Fe10O9F11
31
1
366.53
mp-2233588
6.820213
13.761497
-1.992645
other
Mg1Mn1Co3O8
13
1
152.46
mp-761212
13.748716
5.621216
-2.972016
other
Li2Fe8B8O24
42
1
483.8
mp-761007
10.797324
8.916344
-7.386162
other
Li6V6P16O58
86
1
1,176.02
mp-1220983
14.095449
8.501817
-5.449699
other
Na1Mo2P4O14
21
1
286.84
mp-1176174
3.691938
23.318087
-1.371811
other
Li9Mn2Co5O16
32
1
291.41
mp-1233047
10.377424
8.634133
2.99054
other
Y1Th9Mg1O20
31
1
451.61
mp-772524
13.516376
5.990531
-7.544054
other
Li2Ti4P6O24
36
1
462.73
mp-643561
8.32516
5.065812
-3.791873
other
V1H6O3F3
13
1
191.3
mp-2228824
8.833159
14.981387
-1.044846
other
Mg1Mn6O9F3
19
1
234.36
mp-1239132
-4.988776
-0.486412
-5.5688
other
Hf8Cr8Cu8S32
56
1
1,016.41
mp-1177184
11.369226
8.934099
-7.744778
other
Li8V6P16O58
88
1
1,184.45
mp-849620
13.762127
5.624948
-2.970801
other
Li2Fe8B8O24
42
1
485.95
mp-764506
14.291507
5.693933
-2.812598
other
Li3Fe8B8O24
43
1
485.45
mp-1233138
11.5485
9.687469
1.612825
other
Ca1Y5Mo2O12
20
1
276.1
mp-1174406
4.485122
22.342699
-1.002677
other
Li5Mn2Co1O8
16
1
143.98
mp-1233170
5.701469
12.176054
-2.118227
other
Mg1Fe8O14F2
25
1
299.97
mp-2228337
8.75701
14.976953
-1.119388
other
Mg1Mn6O10F2
19
1
217.71
mp-849667
6.852453
14.532347
-1.698172
other
Li4Co5O9F1
19
1
182.29
mp-1176150
3.396434
23.424753
-1.486136
other
Li9Mn2Co5O16
32
1
291.26
mp-1233999
9.067601
8.714048
-1.123972
other
Mg1Ag20Bi4O16
41
1
733
mp-882580
13.741724
5.624852
-2.973178
other
Li2Fe8B8O24
42
1
486.19
mp-2228763
8.890953
14.91688
-0.337721
other
Na2Mg1Mn4O8
15
1
167.16
mp-882858
13.73057
5.61263
-2.964889
other
Li2Fe8B8O24
42
1
484.08
mp-1372590
7.957371
5.702646
-1.625911
other
Li6Cr6Ga2O16
30
1
295.24
mp-1046464
6.840648
10.964738
-0.544276
other
Ba2Mn4Tl2O12
20
1
332.61
mp-1303576
8.010126
4.696709
-6.5491
other
Li4Co4C8O24
40
1
476.96
mp-767162
10.25743
6.288054
-0.015455
other
Li4Mn6O8F6
24
1
280.11
mp-1047347
12.304943
10.882439
-1.156351
other
Y1Sb1W2O8
12
1
171.17
mp-1225755
13.405085
6.799567
-2.956925
other
Fe7Si3H8O18
36
1
387.38
mp-1232366
7.379395
10.323511
-1.690867
other
Cu2Au2Cl2O4
10
1
171.34
mp-1233488
13.020986
6.784
-5.489478
other
Ca1Ag4P4O12
21
1
338.27
mp-1175923
3.927347
22.942295
-1.328047
other
Li9Mn2Co5O16
32
1
287.85
mp-1224499
12.073496
5.512749
-5.716049
other
Li6P6H8O23
43
1
534.08
mp-1233691
1.169714
2.125873
-4.230276
other
Ca1P4Br12O4
21
1
802.52
mp-2230193
10.631035
13.032549
-3.073553
other
Mg1V4Zn2O12
19
1
200.5
mp-759644
10.792736
8.909098
-7.385353
other
Li6V6P16O58
86
1
1,173.92
mp-1176910
13.110849
7.448419
-7.763053
other
Li14Mn8P16O56
94
1
1,086.23
mp-2218194
12.306261
12.539096
-1.429071
other
Mg1Mn2V2O7
12
1
157.63
mp-2232686
11.618635
8.187232
-7.222529
other
Mg1Cr2P2O10
15
1
206.81
mp-2232235
11.836148
10.890961
-2.335606
other
K4Mg1Mo2O8
15
1
307.27
mp-2233000
14.619059
12.284281
-1.467476
other
Mg1V4O5F7
17
1
212.82
mp-1227618
5.936623
10.554932
-0.335437
other
Ca9Y3Co4O24
40
1
504.63
mp-760224
11.352884
8.945033
-7.73592
other
Li8V6P16O58
88
1
1,178.78
mp-779534
11.668451
8.914681
-7.859755
other
Li9V6P16O58
89
1
1,167.29
mp-1175289
5.870651
21.035137
-0.49932
other
Li7Mn4Co1O12
24
1
222.1