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-1222350
10.838503
4.198555
-7.322704
other
Li2Mg2S2O8F2
16
1
182.78
mp-774692
9.382764
4.002603
-8.489039
other
Na15Mn6P6C6O42
75
1
953.8
mp-2220371
12.268214
11.095275
-1.250897
other
Lu2Mg1W2Cl2O8
15
1
252.82
mp-2716519
13.270429
5.230909
-7.353807
other
Na9In3Sn9P18O72
111
1
1,542.03
mp-1177577
13.253147
8.408228
-8.103208
other
Li12Mn4V4P12O48
80
1
908.15
mp-2713414
13.769839
5.117534
-7.310876
other
Na30Ca9Ti15P36O144
234
1
3,123.59
mp-695491
12.811309
6.999701
-1.261365
other
Na6Ca4Fe10Si20O60
100
1
1,136.51
mp-778220
10.142462
13.875826
-1.155364
other
Li4V3Cr2Fe3O16
28
1
290.91
mp-2712883
11.805243
4.268514
-8.218979
other
Ca3Ge9P6S12O72
102
1
1,394.44
mp-1233299
14.363949
8.22023
-5.556187
other
Mg1Cu1P4Ru2O14
22
1
276.02
mp-2232585
11.663265
10.942763
-1.98736
other
K4Mg1Mo2S2O6
15
1
333.55
mp-1221233
10.238276
11.533486
3.166224
other
Na3Tm1Ti2Nb2O12
20
1
233.81
mp-735580
12.428128
7.145878
-5.29896
other
K9Mg3Nb5P8O40
65
1
1,215.16
mp-1176696
8.399075
6.35661
-6.524315
other
Li4Fe4P4C4O28
44
1
562.75
mp-1233522
12.547007
11.5209
2.239725
other
Sr2Mg1Ti6N2O11
22
1
288.95
mp-694919
7.47096
10.736542
1.524202
other
Sr5Nd5Cu1Ni4O20
35
1
472.89
mp-849995
12.128627
6.81855
-0.866315
other
Li7Sc9Fe1Si20O60
97
1
1,145.31
mp-2716121
14.22375
5.007389
-7.710191
other
Na3Zr12P15S3O72
105
1
1,617.81
mp-861553
8.65436
14.64963
-0.611329
other
Li6Mn3Cr2Fe3O16
30
1
286.52
mp-777461
11.776327
13.093657
-0.418342
other
Li4V3Cr2Sn3O16
28
1
313.52
mp-765171
10.569528
13.377546
-1.196867
other
Li4V3Co3Sb2O16
28
1
302.64
mp-1046620
11.310873
10.494831
1.883812
other
Sr4Ta2Al2Cu4O14
26
1
362.94
mp-1077688
7.997507
12.05088
1.91348
other
Sr4Ca28Ti4Mn28O80
144
1
1,874.85
mp-686614
10.590142
11.74126
2.017082
other
Ta1Ti9Al3Zn23O48
84
1
935.98
mp-771187
10.851518
7.884367
-7.356157
other
Li6Fe3Ni1P6O24
40
1
467.78
mp-1234343
8.305646
10.055799
-3.622085
other
Mg1Cr4Hg4H4O18
31
1
450.77
mp-1234335
8.939159
10.20696
1.625825
other
Sr4Ca1Tb2Ru2O12
21
1
310.47
mp-2715286
14.932394
3.77336
-7.572704
other
Na18Nb9Al3Si18O72
120
1
1,566.89
mp-766410
9.537881
5.777514
-6.899981
other
Li3Ti3Cr3S3O24
36
1
497.27
mp-1077704
12.341436
10.54175
2.263832
other
K20Na12Ta12Nb20O80
144
1
2,095.89
mp-1046545
8.131454
10.703722
-0.261885
other
Ba2Tl2Zn2Ni3O10
19
1
277.86
mp-1226105
12.851524
7.398194
-1.208715
other
Cs1Al1Fe3Si3O12
20
1
271.72
mp-775101
10.264627
8.032601
-6.595737
other
Li8Ti1Fe7P12O48
76
1
931.57
mp-694977
10.0971
10.912613
2.222352
other
Sr4La16Ti4Cr16O60
100
1
1,221.28
mp-706258
9.977224
10.854902
2.68418
other
Sr8La12Ti8Cr12O60
100
1
1,221.68
mp-2219535
12.816849
10.598459
0.02932
other
Y1Mg1Mo1W2O8
13
1
183.86
mp-756177
10.166367
11.20983
-0.578205
other
Li4Zr1Nb1Te2O12
20
1
223.8
mp-2230035
11.119643
12.205337
1.987585
other
Mg1Ti2Nb2Cu3O12
20
1
229.99
mp-831237
10.138533
4.417079
-5.073485
other
Li4Mn4H32S8O48
96
1
1,038.27
mp-697308
14.953216
4.024757
-7.712695
other
Na17Zr12Si11P7O72
119
1
1,702.15
mp-1176981
14.206528
8.520655
-7.317202
other
Li12Mn2V6P12O48
80
1
940.7
mp-2716412
14.383447
4.866111
-7.310852
other
Na15Sc9Ti3P18O72
117
1
1,550.32
mp-766818
9.610669
3.73101
-8.389199
other
Li12Fe4P4C4O28
52
1
551.15
mp-2713169
12.191768
4.000303
-8.568763
other
Ti6Si6Ge6S12O72
102
1
1,400.01
mp-1046452
8.912542
10.044324
1.261688
other
Sr4Al2Cu4Sn2O14
26
1
346.18
mp-686232
12.914826
6.058061
-0.778134
other
Na7Al11Si13Ag4O48
83
1
1,881.88
mp-1222599
12.275679
6.597407
-7.239037
other
Li4Ga4P4O17F3
32
1
348.7
mp-1229214
9.99035
7.526164
-6.114228
other
Al4Co4P8N4O32
52
1
793.92
mp-730563
7.612022
5.104578
-2.030845
other
Na6Mg6In2S12O48
74
1
994.69
mp-1222511
7.812117
3.666119
-5.546507
other
Mn2H6C10N2O12
32
1
414.84
mp-1099889
11.851701
10.089392
2.354312
other
Sr28Ca4Ti28Mn4O80
144
1
2,014.63
mp-1177425
8.793356
13.108511
-1.10727
other
Li4Fe3Co3Te2O16
28
1
302.46
mp-2714135
13.867754
4.619884
-6.949347
other
Na21Ca3La9P18O72
123
1
1,941.57
mp-775705
9.710195
13.192145
-0.312988
other
Li4Ti2Fe3Sn3O16
28
1
316.98
mp-2714259
12.831286
3.771117
-8.333934
other
Na3Sc12P3S15O72
105
1
1,560.95
mp-1233195
10.753983
4.201776
-6.894416
other
K2Nd2Mg1S4O16
25
1
394.87
mp-1247643
7.17062
12.164831
1.554545
other
Sr4Ca28Mn28Al4O86
150
1
1,828.87
mp-699008
10.671144
11.924064
-3.346041
other
Rb4Mn2V4Cl4O12
26
1
585.7
mp-2228773
-2.801905
-1.205813
-5.435112
other
Rb4Mg1Mo2S4O4
15
1
404.82
mp-762164
7.251806
13.721452
-1.545498
other
Li4Nb2Co3Ni3O16
28
1
281.38
mp-1176836
15.533536
6.379055
-2.093596
other
Li8Mn1Fe7B8O24
48
1
489.4
mp-1234073
11.618041
11.232686
-1.577125
other
Cs2Tm2Mg1W4O16
25
1
358.71
mp-2713265
11.852323
3.752476
-7.951666
other
Na15Mg12P3S15O72
117
1
1,513.54
mp-2714768
13.917764
5.132071
-7.556177
other
Na9Mg5Nb7P18O72
111
1
1,523.24
mp-1076600
6.099355
11.083142
-0.055454
other
Ba3Sr5Co3Cu5O24
40
1
489.45
mp-2715465
13.524593
4.951107
-7.298866
other
Na18In6Ga6P18O72
120
1
1,528.53
mp-677223
12.950104
6.088501
-0.515329
other
Na4Ca4Al12Si12O48
80
1
1,937.76
mp-2716397
13.99683
4.652134
-7.263486
other
Na15La9Ge3P18O72
117
1
1,772.16
mp-1643680
10.417681
12.128638
-1.762003
other
Li8Fe2Te2W4O24
40
1
431.99
mp-532715
13.116665
7.045645
-7.07162
other
Na14Cr6Co2P12O48
82
1
992.74
mp-694928
7.321163
12.010092
1.913398
other
Ca3La5Mn7Fe1O24
40
1
476.41
mp-677618
11.345402
6.996344
-1.098572
other
Ca12Al12Si6H4O48
82
1
1,068.31
mp-777041
7.621572
15.329415
-1.259742
other
Li8Mn6Co6Sn4O32
56
1
579.08
mp-686371
9.901381
11.154599
3.252731
other
Na11La7Th2Ti20O60
100
1
1,178.56
mp-706341
7.348944
11.744388
1.944425
other
Sr3La7Mn7Fe3O30
50
1
609.72
mp-1173770
12.312073
6.382788
-0.079879
other
Na4Ca8Si4O16F4
36
1
529.5
mp-2713824
13.405943
3.373311
-8.91329
other
Ca2Nb10Si9S9O72
102
1
1,605.33
mp-759712
11.282665
7.968827
-8.097878
other
Li8Mn8P8O32F8
64
1
749.25
mp-25397
12.749014
7.28648
-7.444092
other
Li8Ni4P4O16F4
36
1
371.91
mp-1099946
7.222318
11.335259
0.905662
other
Sr28Ca4Fe28Co4O80
144
1
1,994.57
mp-1356093
7.123733
10.000261
-0.755857
other
Ba4Ca1Tl4Cu6O20
35
1
540.13
mp-1233313
10.690137
4.351806
-6.706773
other
K2Nd2Mg1S4O16
25
1
378.57
mp-2713957
14.221638
5.187144
-7.601102
other
Na6La9Ta15P36O144
210
1
3,281.31
mp-2713875
13.729054
3.732225
-8.095019
other
Na18Si15Sn12S3O72
120
1
1,609.42
mp-1233395
9.42433
6.208038
-3.868754
other
Rb4Mg1H12Se8O24
49
1
867.63
mp-779088
11.749794
8.716269
-8.135384
other
Li4Mn2V2P6O24
38
1
462.7
mp-1235972
13.267261
6.719437
-0.505599
other
Li1Ho2Cu1Si4O12
20
1
252.39
mp-1662637
14.366266
7.440217
-5.790643
other
Li8Co4Sn4P8O32
56
1
686.46
mp-2714059
13.784991
4.710603
-7.116321
other
Na21Ca9Ta3P18O72
123
1
1,714.27
mp-18984
13.00351
6.359329
-7.138518
other
Na2Zr1Ni1P4O14
22
1
276.24
mp-1133351
14.958366
3.959911
-7.652582
other
Na6Zr4Si4P2O24
40
1
563.03
mp-2716278
13.376947
4.943299
-7.427712
other
Na15In9Ge3P18O72
117
1
1,550.91
mp-2715460
13.824069
4.739616
-7.234088
other
Na54Ca24Ta12P54O216
360
1
4,984.46
mp-758579
9.328113
8.098433
-5.886935
other
Li8Mn1Co7P12O48
76
1
917.96
mp-2713797
13.357587
3.572907
-8.960612
other
Ta9In3Si9S9O72
102
1
1,581.61
mp-2713973
13.304473
3.449014
-8.9028
other
Nb10Zn2Si9S9O72
102
1
1,566.29
mp-1233326
10.948455
9.159438
2.11762
other
Ca1Tb4Al2Fe2O12
21
1
254.55
mp-1046781
12.357964
10.281606
0.632628
other
Sr4Al2Ga2W4O14
26
1
386.51
mp-726922
4.225816
2.965386
-4.046628
other
Sb4P4C12Cl20O4
44
1
1,399.43
mp-1235116
8.226037
10.289549
1.667403
other
Sr4Li1Tb2Ru2O12
21
1
290.43