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-557903
8.174622
11.219314
1.126152
other
Lu4Ru4O14
22
227
256.81
mp-1001019
-4.244996
-4.095966
-3.800472
other
Mg2Sc4Se8
14
227
349.58
mp-16293
9.588652
9.695049
-0.782727
original
K4Sb4O12
20
227
300.18
mp-642823
11.249295
12.000087
0.157872
other
Dy4V4O14
22
227
250.12
mp-9071
-4.60823
-5.572396
0.450531
other
Na16Ti2As8
26
227
645.43
mp-19071
12.184887
7.520667
-2.075246
other
Co4Si2O8
14
227
138.39
mp-2908
12.457963
7.635726
0.486777
other
Al4Zn2O8
14
227
131.65
mp-1193073
-6.012007
-1.108518
3.74351
other
Ta16Fe8N4
28
227
392.36
mp-3930
-2.972327
-2.598472
-5.693348
other
Sc4Mn2S8
14
227
298.84
mp-1400462
12.670341
10.072268
1.814499
other
Y2Ti4O8
14
227
177.76
mp-1232231
-4.456394
-4.122265
-3.747309
other
Pm4Mg2Se8
14
227
425.6
mp-1190299
7.94406
10.976295
0.535627
other
Nd4Ir4O14
22
227
282.04
mp-12533
10.283464
9.513297
3.604729
other
La4Hf4O14
22
227
309.61
mp-1388111
-5.060175
-0.89128
-4.664228
other
Ca2Fe4S8
14
227
267.4
mp-753991
6.597174
10.927138
-1.699992
other
Mg8Co4O16
28
227
297.32
mp-7640
11.987921
7.517859
-0.033928
other
Sc4Si4O14
22
227
205.84
mp-756297
10.147223
9.075554
0.226451
other
Zn2In4O8
14
227
185.62
mp-581805
-6.648474
-0.054342
3.399632
other
Ni12Mo12N4
28
227
336.01
mp-734713
10.138137
10.404704
-3.902055
other
Mo24P2O80
106
227
3,432.86
mp-505574
-6.148976
-0.225582
3.366211
other
Co8Mo16C4
28
227
360.61
mp-1193698
-7.180616
-0.446177
4.929127
other
Zr12Fe12C4
28
227
414.66
mp-558096
12.463792
6.817848
-0.90499
other
Zn4Si2O8
14
227
140.57
mp-16836
-4.099725
-4.870246
5.677091
other
Rb2Na4Si34
40
227
813.71
mp-19394
12.632591
13.497549
-1.026463
other
Li2V4O8
14
227
138.79
mp-1190650
9.511913
10.687449
-1.19675
other
Ni4Sb4O14
22
227
264.87
mp-1258020
5.841596
11.729871
-1.969968
other
Al4Fe4O14
22
227
201.92
mp-1046883
9.733937
8.660136
-0.037096
other
Mg2Bi4O8
14
227
225.68
mp-1178365
8.313369
10.936826
-0.062391
other
Dy4Pt4O14
22
227
264.44
mp-559274
-4.861352
-6.988377
2.95777
other
Ba42Ge4O10
56
227
2,415.63
mp-756933
11.045358
11.506408
2.989945
other
Ta4Tl4O12
20
227
303.75
mp-4409
8.294148
11.768566
-0.908046
other
Cu2Rh4O8
14
227
160.35
mp-2959
-3.150446
-2.195431
-5.22913
other
Yb4Cd2S8
14
227
365.29
mp-560842
12.046605
6.729026
-1.315239
other
Cd4Si2O8
14
227
171.45
mp-1232313
8.566567
10.17392
0.466734
other
Ba2Co2O4
8
227
161.68
mp-33948
10.131786
10.582363
3.294886
other
Ho4Ti4O14
22
227
254.97
mp-20342
7.393423
8.412107
-2.262876
other
Yb4Sn4O14
22
227
292.49
mp-754093
9.548525
8.339358
2.707937
other
Gd4Cd2O8
14
227
231.18
mp-569179
-6.433466
-0.194926
3.342993
other
Ni12Mo12C4
28
227
338.92
mp-615746
8.218065
1.329499
1.082588
other
Rb4Bi4F16
24
227
439.81
mp-864841
-5.955308
-1.893702
3.414137
other
Nb16Ni8C4
28
227
401.22
mp-5639
12.699772
6.880713
-0.635721
other
Mg4Si2O8
14
227
135.5
mp-559200
-4.119669
-1.411054
-5.754273
other
Cd2In4S8
14
227
326.09
mp-778152
8.392298
10.977049
-0.345106
other
Sc4Pt4O14
22
227
241.27
mp-754120
11.965324
9.987343
2.414293
other
Dy4Nb4O14
22
227
278.76
mp-1103982
-4.350301
-4.133971
-3.817901
other
Lu4Cd2Se8
14
227
384.31
mp-1178397
10.649756
7.935953
-0.2728
other
Cs2Ga2O4
8
227
154
mp-557684
11.368574
12.070413
0.001161
other
Er4V4O14
22
227
245.5
mp-505623
10.316484
13.179685
-0.48721
other
Al2Fe4O8
14
227
146.79
mp-5050
8.148777
11.058362
-0.124982
other
Rb2Os4O12
18
227
261.57
mp-1210533
6.946163
5.551866
-3.50907
other
Na2Sb2O24
28
227
510.22
mp-1176715
-5.275722
-0.737181
-4.587512
other
Li4Fe4S8
16
227
231.11
mp-866847
-3.414872
-1.602376
-5.570491
other
Ca4Sn8S20
32
227
901.41
mp-3904
12.302439
7.241398
-0.62412
other
Mg4Ge2O8
14
227
140.37
mp-18828
8.673318
11.505053
-0.901119
other
Tl2Fe2O4
8
227
159.99
mp-567387
-6.559956
-3.236151
6.323749
other
Ce2Ti4Al40
46
227
773.5
mp-21536
-5.997463
-0.230671
3.244077
other
Ni8Mo16C4
28
227
354.96
mp-672297
-4.691959
-0.631439
-5.875494
other
Cr2Ga4S8
14
227
258.96
mp-10191
-4.356175
-4.225339
-3.824894
other
Lu4Mg2Se8
14
227
373.84
mp-1202337
-9.42713
-5.150156
3.566736
other
U2Zn40Co4
46
227
694.6
mp-28226
11.41241
13.150901
0.007543
other
Mn2Cr4O8
14
227
151.08
mp-14145
9.381289
9.866735
-0.131023
other
Ca4Sb4O14
22
227
280.3
mp-1196837
-6.418405
-2.881038
6.356949
other
Ca2Al40Cr4
46
227
753.55
mp-760340
8.497551
14.934394
-1.078352
other
Na2Mn4O8
14
227
151.36
mp-755635
8.292539
10.956991
0.037174
other
Ho4Pt4O14
22
227
262.3
mp-755558
9.404719
8.49658
2.87551
other
Ba2La4O8
14
227
289.43
mp-3370
10.121673
9.333335
1.65291
other
Y4Sn4O14
22
227
281.52
mp-1203677
-7.689044
-6.74555
2.637058
other
Ce2Cd40Ni4
46
227
990.1
mp-556497
9.373109
0.586087
-0.161268
other
Rb2Ni4F12
18
227
251.27
mp-18633
-4.911289
-6.23439
0.610094
other
K16Sn2Sb8
26
227
1,095.04
mp-769222
5.958143
8.78187
-0.960759
other
Dy4Pb4O14
22
227
302.74
mp-756175
10.638056
9.809479
2.15916
other
Zr4Bi4O14
22
227
317.24
mp-1104783
-4.688256
-1.03914
-5.93621
other
Mn2Al4S8
14
227
259.2
mp-1204974
-7.752954
-6.734764
2.489853
other
Sm2Cd40Pd4
46
227
970.06
mp-1195553
-9.593621
-5.133175
3.319921
other
Zr2Zn40Fe4
46
227
684.68
mp-1198503
-9.362118
-5.163515
3.586257
other
U2Zn40Rh4
46
227
726.16
mp-755108
6.244169
8.93914
-1.919863
other
Tl4Pb4O14
22
227
321.45
mp-568681
-8.413795
-9.576586
4.881866
other
Mg16B2Pt8
26
227
459.02
mp-1096878
10.17271
9.333187
3.661965
other
Ce4Zr4O16
24
227
300.16
mp-580113
-9.481323
-5.023386
3.472846
other
Dy2Zn40Ru4
46
227
696.43
mp-22052
-4.120677
-1.427503
-5.887488
other
Zn2In4S8
14
227
310.78
mp-1219287
11.755703
11.250312
-0.496451
other
Sm4Mo4O14
22
227
288.43
mp-1400865
7.308615
11.247157
-0.892459
other
Mg2Cu4O8
14
227
148.17
mp-15973
-5.500332
-0.183342
-5.982148
other
Cr4Hg2S8
14
227
273.22
mp-755159
8.371482
8.753369
-2.142198
other
Tl4Ge4O14
22
227
244.64
mp-756440
8.311173
10.944936
-0.016993
other
Er4Pt4O14
22
227
259.56
mp-22479
12.151162
8.726282
2.709978
other
Zr16Pd8O4
28
227
489.27
mp-1103893
-4.30591
-4.14253
-3.748633
other
Lu4Mn2Se8
14
227
368.82
mp-1271990
11.335656
12.911095
0.051911
other
Ca2Cr4O8
14
227
171.77
mp-738361
15.847049
5.562395
0.359751
other
Si34C2O68
104
227
2,004.22
mp-1192282
-6.229782
-3.619769
4.048247
other
Zr12Zn4Cu8
24
227
427.89
mp-769396
11.74159
7.536187
-0.183875
other
Y4Ge4O14
22
227
244.06
mp-1003486
11.154855
10.875216
0.603531
other
Ca4Mn4O8
16
227
203.5
mp-755450
9.612145
8.586817
3.070675
other
La4Ce4O14
22
227
349.11
mp-1775070
-5.469986
-0.868409
-4.491897
other
Mg2Ni4S8
14
227
239.74
mp-15813
-5.975944
-0.39482
3.351578
other
Mn12W12C4
28
227
358.48
mp-541021
-7.193372
-4.108074
1.017072
other
Sb4As4Pd20
28
227
478.88
mp-863404
9.60443
0.486153
-0.239056
other
Li4Cu4F14
22
227
252.4
mp-5950
8.001341
11.074807
0.090552
other
Cd4Os4O14
22
227
273.89
mp-1402814
9.710198
14.235223
-0.429676
other
Mn4Al2O8
14
227
153.51
mp-752679
9.57596
8.367388
2.981138
other
Ca2Gd4O8
14
227
234.55