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-2219734
-4.53236
-1.589723
-4.930544
other
Mg1Cu4As4S4
13
6
260.18
mp-775991
9.936204
8.290573
-6.772472
other
Cr1Co3P4O16
24
6
275.76
mp-1227161
6.895514
11.311982
0.974677
other
Ca1Pr3Fe4O12
20
6
241.81
mp-2228801
12.470409
-0.898329
0.910907
other
Mg1Mn6O6F6
19
6
237.52
mp-1218118
7.514524
12.038429
2.04423
other
Sr1Sm3Mn4O12
20
6
239.78
mp-26851
14.136467
7.126266
-5.992442
other
Li8Cu4P4O16
32
6
345.71
mp-1046359
11.009825
11.850187
-2.122926
other
Ba2Tl1V2O7
12
6
201.07
mp-1177808
13.441416
12.66424
-0.480945
other
Li8V4O8F4
24
6
230.21
mp-1221966
-6.700619
-1.706664
1.631013
other
Mn6Co3As6Rh3
18
6
251.05
mp-2231984
10.545
14.219234
-0.861249
other
Mg1Mn6O8F4
19
6
231.15
mp-1041135
12.594851
10.304358
0.432444
other
Ho2Mg2W4O12
20
6
246.06
mp-1100564
3.691823
23.277054
-1.38996
other
Li9Mn2Co5O16
32
6
291.96
mp-1223364
10.581408
11.616379
3.26608
other
K1Na1Nb2O6
10
6
133.42
mp-772046
11.068558
7.871941
-6.98058
other
Nb1Cu3P4O16
24
6
299.23
mp-2224308
13.177022
7.973543
-7.058287
other
Mg1Fe4P4O16
25
6
301.29
mp-1217056
10.72336
10.465231
-3.457548
other
U7V5Ag3O35
50
6
813.39
mp-1100585
3.604314
23.56184
-1.389703
other
Li9Mn2Co5O16
32
6
292.86
mp-755821
14.010307
7.10808
-6.371052
other
Li5Cu1P2O8
16
6
164.16
mp-2230478
7.643439
6.568303
-3.084891
other
Mg1Cu2I4O12
19
6
312.74
mp-1235538
7.276455
6.529412
-3.278042
other
Li1Pr2Br2O4
9
6
172.49
mp-1235216
1.176504
2.07887
-4.23806
other
Li1P4Br12O4
21
6
751.29
mp-1100568
3.359464
23.503942
-1.507546
other
Li9Mn2Co5O16
32
6
289.74
mp-1229136
8.010971
10.416474
1.323912
other
Ba20Ru11Pt1O48
80
6
1,328.11
mp-2230969
5.886076
12.397663
-2.006116
other
Mg1Fe6O10F2
19
6
215.88
mp-1234386
11.258514
9.386577
2.592814
other
Sm8Mg1Ti4O20
33
6
455.33
mp-765392
6.166375
12.911825
-1.529555
other
Li6Fe9Co1O20
36
6
375.65
mp-1235115
11.069757
4.265181
-3.494668
other
Sr2Li1H8O6
17
6
201.53
mp-1218454
10.004889
9.770779
3.920513
other
Sr1Ca3Hf4O12
20
6
264.42
mp-1234029
10.349193
9.148192
3.073709
other
La8Hf4Mg1O20
33
6
537.28
mp-1174400
5.171566
21.230249
-0.868553
other
Li5Mn2Co1O8
16
6
145.3
mp-1219205
8.425222
1.940891
2.549618
other
Sm6S2O2F10
20
6
305.21
mp-1175004
3.907005
23.317436
-1.246477
other
Li7Mn2Co3O12
24
6
215.44
mp-1227174
7.50176
12.042297
1.985575
other
Ca1Nd3Mn4O12
20
6
239.8
mp-1223410
8.690267
0.747908
1.611098
other
K1Na3Mg4F12
20
6
245.7
mp-2220213
13.409457
0.550261
1.322388
other
Mg1Fe12O12F12
37
6
447.38
mp-2228429
10.20323
1.372949
-1.503107
other
Mg1Co6O6F6
19
6
214.23
mp-1221009
7.176072
12.096094
1.773065
other
Na1Pr3Mn4O12
20
6
234.98
mp-1217159
10.869139
9.897189
-2.69819
other
V4Si2Pb10O24
40
6
674.16
mp-756349
10.230209
8.271882
-7.226954
other
Mn3Cu1P4O16
24
6
289.7
mp-1100590
3.824419
23.189579
-1.339601
other
Li9Mn2Co5O16
32
6
290.79
mp-775017
10.173527
8.238738
-6.77071
other
Fe3Ni1P4O16
24
6
285.7
mp-1247675
6.68248
12.25002
1.084262
other
Ca32Mn28Cr4O96
160
6
1,746.97
mp-2228933
12.448652
12.338351
-3.711463
other
Mg1V4O8F4
17
6
244.05
mp-753043
13.40974
12.676836
-0.483292
other
Li8V4O8F4
24
6
229.29
mp-1235668
11.430924
4.683525
-3.209331
other
Li1Nd2H6O6
15
6
195.7
mp-2218341
12.638186
1.243491
1.963738
other
Mg1Fe4O4F4
13
6
163.48
mp-1222360
-5.534769
-2.382742
5.850329
other
Lu1Sc3Mn4Si4
12
6
192.79
mp-1100609
3.92558
22.953077
-1.340772
other
Li9Mn2Co5O16
32
6
286.99
mp-2220234
13.390182
0.561139
1.336922
other
Mg1Fe12O12F12
37
6
461.66
mp-1233469
9.996531
8.670746
1.176953
other
Ca1Y4Bi4O12
21
6
357.05
mp-2230870
8.539574
14.794415
-1.219594
other
Mg1Mn6O11F1
19
6
215.7
mp-2220238
13.483681
0.514529
1.344151
other
Mg1Fe12O12F12
37
6
438.27
mp-2230455
12.41505
-0.852322
1.040826
other
Mg1Mn6O6F6
19
6
243.05
mp-1219311
-4.442332
-1.12507
-5.676062
other
Sc1Mn2Ga3S8
14
6
311.01
mp-1220019
7.62844
12.030301
1.860225
other
Pr3Mn4Pb1O12
20
6
246.15
mp-774656
10.281257
12.940218
1.285734
other
Li5Ti6Fe1O16
28
6
300.73
mp-2231706
5.503667
11.714924
-2.08147
other
Mg1Fe6O11F1
19
6
220.42
mp-1238892
-4.991503
-0.01533
-5.54285
other
Ti4Cr4Ag4S16
28
6
570.53
mp-2229337
12.419665
6.787186
-3.555288
other
Mg1Fe4H4O8
17
6
164.36
mp-1247671
8.057401
11.547999
1.930811
other
Ca8Mn4Al4O20
36
6
447.02
mp-755192
13.370374
7.417879
-5.933462
other
Fe1Sb3P4O16
24
6
353.17
mp-2220216
13.493933
0.542948
1.372527
other
Mg1Fe12O12F12
37
6
444.84
mp-1227761
6.863579
12.197824
1.448312
other
Ca3Sm1Mn4O12
20
6
224.3
mp-2226900
7.463995
12.224306
-1.160141
other
Mg1Zn2Ni4O8
15
6
167.92
mp-1217949
-4.732879
-1.190181
-3.050456
other
Ta1Nb2Fe1Se10
14
6
323.01
mp-863402
10.482392
8.237696
-7.088982
other
Ti1Co3P4O16
24
6
287.79
mp-2228414
13.22752
0.88989
1.790415
other
Mg1Fe6O6F6
19
6
224.4
mp-1217635
8.429382
1.725497
2.445633
other
Tb6S2O2F10
20
6
289.01
mp-1233602
10.583806
9.170262
2.970249
other
La8Hf4Mg1O20
33
6
540.43
mp-1221917
12.987638
6.515858
-1.046107
other
Na13Mn5Si12O36
66
6
811.95
mp-1233724
7.170087
8.959529
-0.522905
other
Ba4Mg1Tl8O16
29
6
492.59
mp-755182
11.642962
0.772576
0.580328
other
Li3Fe3O4F4
14
6
151.52
mp-1222757
10.586192
12.521158
2.087346
other
Li2Mg1Ti9O20
32
6
371.06
mp-2231444
5.600456
11.875518
-2.086354
other
Mg1Fe6O11F1
19
6
224.12
mp-775544
10.50684
8.073684
-6.908195
other
Ni3Sb1P4O16
24
6
284.3
mp-1215936
10.650694
10.525041
2.790612
other
Zr3Ti1Pb4O12
20
6
295.88
mp-2226702
10.222938
11.087459
-0.422209
other
Mg1Sb1Rh1O4
7
6
97.39
mp-2229402
11.273278
10.194978
2.701531
other
Sr4Mg1Ti3O10
18
6
255
mp-1218100
10.625142
11.648536
-4.007849
other
Ta3Nb1V4O20
28
6
480
mp-2231293
7.736011
11.411308
1.098004
other
Sr4Mg1Fe4O11
20
6
268.62
mp-1233314
-0.226436
2.467974
-4.180795
other
Rb12Mg1Cl4O4
21
6
709.6
mp-1228013
11.477023
11.009938
-3.350255
other
Co8Cu7Mo12O48
75
6
987.33
mp-2226428
8.457893
10.812922
-3.248971
other
Mg1Zn2Cr2O8
13
6
171.23
mp-2228412
9.195501
9.949557
1.938948
other
Nd4Mg1Cu4O10
19
6
241.38
mp-1234588
13.701763
9.76669
-0.42542
other
Mg1V12B4O20
37
6
401.65
mp-754190
13.907735
7.886032
-5.575343
other
V1Sb3P4O16
24
6
340.18
mp-557492
9.88866
11.031725
3.310797
other
Li1La5Ti8O24
38
6
480.41
mp-1100576
3.543785
23.561913
-1.432134
other
Li9Mn2Co5O16
32
6
288.55
mp-757412
10.274623
8.318472
-7.372912
other
Mn3Co1P4O16
24
6
289.65
mp-1100591
3.748962
23.381807
-1.353339
other
Li9Mn2Co5O16
32
6
291.21
mp-1100612
3.892122
23.020309
-1.338317
other
Li9Mn2Co5O16
32
6
288.06
mp-756463
11.556993
8.202896
-7.923493
other
Mn3Sb1P4O16
24
6
312.2
mp-1235085
10.764287
8.487889
2.762106
other
Li1Sm4Tm4O12
21
6
291.32
mp-1235272
8.767768
10.437385
1.150127
other
Li1Nd4Rh4O12
21
6
263.89
mp-1217012
10.811435
10.325065
-2.624874
other
V4Ge2Pb10O24
40
6
684.84
mp-2230319
13.291863
0.807455
1.71853
other
Mg1Fe6O6F6
19
6
223.73
mp-2228913
9.594661
13.338247
0.237361
other
Na4Mg1Mn4O8
17
6
224.85
mp-1220619
-4.907483
-1.307483
-2.992356
other
Nb4V3Fe1Se20
28
6
620.18
mp-1223137
7.634671
11.143103
1.561138
other
La3Sm1Fe4O12
20
6
249.24
mp-1175179
3.939726
23.385582
-1.211719
other
Li7Mn2Co3O12
24
6
219.94