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-27719
12.067426
7.920524
-0.374002
other
Al4Cu2O8
14
227
131.01
mp-505600
-5.943169
-1.873036
3.650616
other
Ta12Si4Ni8
24
227
350.26
mp-1388705
8.926196
14.772672
-0.661487
other
Mn4Zn2O8
14
227
158.8
mp-1214924
6.883952
5.761917
-2.988482
other
Ag2Sb2O24
28
227
291
mp-756724
11.952051
9.957607
2.453899
other
Lu4Nb4O14
22
227
268.56
mp-1147521
7.078781
10.214304
-0.913156
other
Cs2Co2O4
8
227
151.37
mp-1103852
-5.435591
-0.862588
-3.744071
other
Co2Rh4S8
14
227
227.09
mp-722913
1.212387
1.113799
2.625928
other
Hf12Zn12N4
28
227
423.5
mp-505627
-6.171288
-1.62247
3.799347
other
Nb12Co8Si4
24
227
350.36
mp-1003856
11.861794
11.737008
0.162902
other
Mg4Mn4O8
16
227
160.91
mp-753489
7.189529
13.711396
-1.80441
other
Zn2Co4O8
14
227
131.26
mp-1042046
12.859842
10.502903
0.238527
other
Ca2Mo4O8
14
227
192.3
mp-754069
7.244086
13.139167
-1.782973
other
Co4Hg2O8
14
227
168.48
mp-25385
7.0235
11.689221
-1.012905
other
Li2Cu4O8
14
227
142.98
mp-1213591
7.146456
5.734764
-2.922687
other
Eu2Ti2O28
32
227
302.16
mp-21299
-5.641036
-0.30499
-5.354472
other
Cr4Co2S8
14
227
233.86
mp-1401503
7.664817
11.240145
-0.752641
other
Al2Cu4O8
14
227
140.22
mp-1247043
-4.508214
-1.118657
-6.014089
other
Mg2Al4S8
14
227
263.49
mp-1104014
-6.170059
-2.991316
-1.962836
other
Mn4Zn2Te8
14
227
383.19
mp-7322
11.398825
9.023828
1.548001
other
Cs2U4O12
18
227
343.46
mp-28710
-3.333867
-1.474403
-5.51228
other
Ba4Ge8S20
32
227
859.37
mp-1410970
-4.089561
-0.342639
-4.718212
other
Ti4Zn2S8
14
227
262.04
mp-754207
7.386826
12.520618
1.514775
other
Tb4Mn4O14
22
227
244.7
mp-1195833
-7.716643
-6.788437
2.522653
other
Y2Cd40Ni4
46
227
983.04
mp-1191806
-8.102473
-10.287878
5.313131
other
Mg12Ti4Ni8
24
227
384.79
mp-4194
-5.439946
-0.320654
-5.803139
other
Zn2Cr4S8
14
227
250.22
mp-3200
10.157239
10.650888
3.240529
other
Lu4Ti4O14
22
227
253.25
mp-505306
7.138387
9.275202
0.007706
other
Eu4Sn4O14
22
227
291.96
mp-756347
8.284304
10.962072
-0.077521
other
Y4Pt4O14
22
227
264.93
mp-1193527
-6.208295
-2.805734
4.006291
other
Zr16Os8C4
28
227
491.11
mp-17114
9.957167
9.341549
1.617648
other
Nd4Sn4O14
22
227
299.33
mp-560329
11.229328
9.269651
3.168336
other
Ce4Zr4O14
22
227
310.01
mp-1046890
11.177168
9.391745
0.27785
other
Zn2Sn4O8
14
227
201.17
mp-19200
12.391665
10.624855
0.464896
other
Tb4Mo4O14
22
227
272.13
mp-19202
11.443077
13.157571
-0.021547
other
Mg2Cr4O8
14
227
146.08
mp-637431
7.537002
11.221741
0.428707
other
Eu4Ru4O14
22
227
274.76
mp-753905
10.423147
9.30656
3.797671
other
Tm4Zr4O14
22
227
289.89
mp-35785
-2.768566
-2.565288
-5.799985
other
Y4Cd2S8
14
227
356.41
mp-756362
10.857274
13.606242
-0.132833
other
Li4Cr4O8
16
227
140.09
mp-1203280
-9.418171
-4.962427
3.651233
other
U2Zn40Ir4
46
227
702.94
mp-1246286
-4.303756
-1.172783
-5.865143
other
Mg2Ga4S8
14
227
273.22
mp-672681
-5.467623
-1.710386
3.305144
other
Nb16Zn8C6
30
227
433.25
mp-640321
-5.563717
-5.316445
3.342619
other
Cs2Na4Ge34
40
227
939.9
mp-1390164
-4.89495
0.042099
-5.169268
other
V4Zn2S8
14
227
255.7
mp-505361
12.301109
9.251619
2.485161
other
Ti16Fe8O4
28
227
366.37
mp-22089
8.225308
11.178883
-0.350554
other
Hg4Os4O14
22
227
281.27
mp-1204650
-6.534101
-2.756221
6.447181
other
Y2Al40Cr4
46
227
751.54
mp-1384218
7.440255
10.70371
-0.215936
other
Y2Cu4O8
14
227
170.48
mp-1191878
12.170185
10.916439
-0.121137
other
Eu4Mo4O14
22
227
286.83
mp-1238805
-5.348547
-0.21603
-5.845879
other
Na2Cr4S8
14
227
280.67
mp-504735
12.150977
8.942226
2.352746
other
Ti12Ni12O4
28
227
331.73
mp-1394188
-3.917696
-0.564147
-4.715611
other
Ca2Ti4S8
14
227
309.55
mp-38685
11.266096
9.12307
1.866479
other
Ce4Sb4O12
20
227
331.44
mp-1118911
1.055051
2.392394
1.67325
other
Cs20Ru20N40
80
227
1,611.64
mp-558411
10.399362
9.434137
3.833316
other
Y4Zr4O14
22
227
298.45
mp-1195710
-9.582148
-5.196982
3.516774
other
Zr2Zn40Cu4
46
227
692.08
mp-15613
-5.35525
-0.960183
-4.137536
other
Cu2Rh4S8
14
227
235.3
mp-754818
10.83414
11.691656
3.181143
other
Na4Ta4O12
20
227
289.21
mp-753397
10.865534
8.601312
-0.794717
other
Ga4Cu2O8
14
227
149.48
mp-770107
8.440142
13.272255
-1.202893
other
Fe4Cu2O8
14
227
146.94
mp-20758
11.109683
13.039482
-0.225486
other
Cr4Co2O8
14
227
145.39
mp-5472
10.706369
11.369057
2.508178
other
Nb4Cd4O14
22
227
286.47
mp-19153
7.546598
12.489141
1.416202
other
Lu4Mn4O14
22
227
231.78
mp-18803
11.495695
11.133138
-2.106378
other
Na4W2O8
14
227
186.84
mp-1046867
11.323697
9.312249
0.479336
other
Mg2Sn4O8
14
227
202.33
mp-581987
-9.423181
-5.343718
3.453519
other
Dy2Zn40Rh4
46
227
759.08
mp-1400944
10.761654
9.236755
0.535614
other
Ca2Sn4O8
14
227
226.43
mp-1232131
-2.707615
-2.647501
-5.77302
other
Dy4Mg2S8
14
227
344.53
mp-1262076
7.124961
8.857926
-1.465805
other
Al4Bi4O14
22
227
262.24
mp-33658
10.664865
11.362506
2.45073
other
Nb4Tl4O14
22
227
312.66
mp-1191821
11.185369
10.596115
1.656209
other
Nd4Tc4O14
22
227
285.45
mp-1096954
-4.940199
-0.813159
-4.927696
other
Fe4Si2S8
14
227
240.88
mp-11151
-5.95948
-3.790549
-1.770832
other
Na4Pr4Te8
16
227
542.51
mp-19930
8.148799
11.035651
1.176172
other
Nd4Ru4O14
22
227
279.56
mp-34322
10.16314
10.684127
3.300171
other
Dy4Ti4O14
22
227
257.15
mp-18879
12.935716
12.635918
-0.5833
other
V4Zn2O8
14
227
157.27
mp-1202830
5.417296
-0.442001
-3.001971
other
Mg4B8H32
44
227
478.29
mp-1442788
7.566149
13.076436
-1.601969
other
Al2Co4O8
14
227
141.4
mp-761284
6.734471
13.674989
0.349252
other
Eu4Mn4O14
22
227
251.58
mp-1207896
7.182807
5.405235
-3.155206
other
Y2Zr2O28
32
227
418.32
mp-36866
12.44001
7.667974
0.39249
other
Al4Cd2O8
14
227
152.31
mp-1205144
-6.490845
-2.391141
6.614096
other
Mg6Al36W4
46
227
772.17
mp-625920
11.696678
5.064662
-3.634697
other
Ta4H8O14
26
227
281.03
mp-19784
12.009343
7.528584
-1.216505
other
In4Si4O14
22
227
217.53
mp-1232112
-2.683882
-2.677818
-5.749774
other
Tb4Mg2S8
14
227
348.59
mp-1200116
-6.525516
-2.775054
6.454836
other
Pr2Al40Cr4
46
227
766.13
mp-22432
12.309601
9.098379
2.511807
other
Ti16Cu8O4
28
227
370.23
mp-558131
11.22952
10.611424
1.639387
other
Sm4Tc4O14
22
227
278.47
mp-754234
13.674815
9.699809
-0.745388
other
V4Si2O8
14
227
146.21
mp-14928
-4.230903
-3.970779
-3.679842
other
Sc4Mn2Se8
14
227
344.39
mp-1193097
0.749525
1.009647
2.828428
other
Zr16Fe8N4
28
227
454.68
mp-30052
-6.424872
-0.30193
3.329662
other
Ni12Mo12C2
26
227
317.75
mp-1001034
-4.805728
-2.984541
-3.951034
other
Mg2In4Se8
14
227
376.15
mp-505573
-6.052921
-2.443278
3.790171
other
Zr12V12C4
28
227
459.86
mp-9765
8.225201
10.846488
0.079256
other
Nd4Pt4O14
22
227
283.83
mp-1198942
-6.28479
-3.466026
6.146244
other
Mg6Ta4Al36
46
227
796.3
mp-27872
12.76969
10.790096
1.737422
other
Mg2Ti4O8
14
227
153.17
mp-1195753
-6.465978
-2.797737
6.421703
other
Yb2Al40Cr4
46
227
753.56
mp-561442
10.461844
9.56882
3.718394
other
Y4Hf4O14
22
227
283.6
mp-1194387
-5.917152
-0.161658
3.388425
other
Ni12W12C4
28
227
340.71