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-38099
0.433224
2.247868
-4.778744
other
Rb8Cl4O2
14
122
449.94
mp-4870
13.706789
4.491147
-2.490645
other
Cu6B12O24
42
122
371.45
mp-1208652
7.757237
8.204004
-3.093895
other
Sr2Ge2O8
12
122
179.1
mp-1220193
-5.903053
-4.83532
1.152134
other
Nd4Ga4Sb8
16
122
435.48
mp-34185
-2.579453
-2.783271
-5.554913
other
Ca2Pr4S8
14
122
321.29
mp-1207548
-6.024501
-3.516043
1.536305
other
Zr10V12Sb36
58
122
1,297.57
mp-1029312
0.926832
2.678953
1.740234
other
Rb2V2N4
8
122
137.02
mp-12954
-3.780385
-1.023446
-5.542958
other
Cu2B2S4
8
122
112.26
mp-1232115
-2.708286
-2.697562
-5.810827
other
Lu4Mg2S8
14
122
273.81
mp-1016200
-4.739705
-4.731235
0.10735
other
Mg2Ge2As4
8
122
197.19
mp-38971
-2.658347
-2.751117
-5.52702
other
Eu2Y4S8
14
122
301.95
mp-35197
-5.662404
-3.671107
-1.854012
other
Sm2Sb4Te8
14
122
456.81
mp-4666
-3.155166
-3.890748
0.742926
other
Cd2Si2P4
8
122
169.76
mp-676424
-2.689203
-2.871213
-5.107303
other
Sm2Gd4S8
14
122
301.15
mp-5190
-4.827124
-4.955445
0.153777
other
Zn2Sn2As4
8
122
202.41
mp-971837
-6.121081
-3.368634
-2.363206
other
Zn2Cd2Te4
8
122
254.08
mp-675650
-3.108058
-2.327189
-5.286541
other
Ca2Yb4S8
14
122
301.04
mp-37070
-2.653803
-2.962423
-5.099387
other
Pr4Sm2S8
14
122
316.98
mp-17004
8.606973
2.06996
0.509913
other
U4O4F16
24
122
412.46
mp-1100853
-3.138223
-2.217981
-5.357201
other
Yb4Mg2S8
14
122
292.28
mp-1245562
2.71771
2.329081
1.633772
other
Cd2Si2N4
8
122
96.85
mp-1191340
5.447008
-0.432227
-3.033172
other
Ca2B4H16
22
122
231.7
mp-1095533
7.803947
7.79845
-3.882835
other
K2As2O8
12
122
202.73
mp-33320
-3.207789
-3.015083
-4.035641
other
Ca4U4S8
16
122
423.96
mp-675511
-2.741268
-2.634082
-5.661291
other
Sm4Pb2S8
14
122
320.58
mp-773116
-2.538694
-2.770157
-5.353363
other
La40S58O2
100
122
2,487.39
mp-1219768
-0.217086
1.23567
-4.31512
other
Rb4Ba2Br8
14
122
511.14
mp-5518
-4.8469
-2.62162
-4.120978
other
Ga2Ag2Se4
8
122
198.74
mp-38728
-2.48452
-2.770871
-5.551053
other
Sr2Er4S8
14
122
305.77
mp-1223115
-6.085585
-5.288436
2.337348
other
La8Sb4Pb2
14
122
468.82
mp-34309
-2.58834
-2.812541
-5.474413
original
Pr4Eu2S8
14
122
327.1
mp-676200
-2.614613
-2.783978
-5.501308
other
Eu2Er4S8
14
122
296.75
mp-20782
-6.08601
-3.42058
-2.212563
other
Li2In2Te4
8
122
266.1
mp-675767
-2.57762
-2.80426
-5.415637
other
La4Yb2S8
14
122
326.69
mp-37741
-4.027198
-4.181293
-3.685712
other
Ba2La4Se8
14
122
404.32
mp-35269
-4.939062
-5.743182
0.826242
other
Ca8Sb4S2
14
122
401.36
mp-505138
-4.358524
-1.983751
-3.2986
other
K8Pd4Se40
52
122
1,638.35
mp-675445
-3.053919
-2.339923
-5.284766
other
Sr2Yb4S8
14
122
315.66
mp-5048
-6.064101
-3.434057
-2.295818
other
Li2Ga2Te4
8
122
239.65
mp-36031
-5.784422
-3.855516
-1.485047
other
Ca2La4Te8
14
122
457.4
mp-1029407
0.771661
2.689458
1.830887
other
Na2Cr2N4
8
122
104.95
mp-37521
-3.615138
-4.192436
-3.23092
other
Nd4U2Se8
14
122
351.19
mp-1120779
-4.791794
-2.99621
-3.91994
other
K2In2Se4
8
122
277.12
mp-1232030
-2.725914
-2.643929
-5.777298
other
Y4Mg2S8
14
122
287.33
mp-38417
-2.850262
-2.655524
-4.913216
other
Ba2Ce4S8
14
122
347.64
mp-1096959
-5.26107
-2.068226
-3.820635
other
Fe2Ag2Se4
8
122
189.2
mp-1246145
0.724115
2.238672
1.94116
other
Li2Re2N4
8
122
102.31
mp-33560
-2.756573
-2.763397
-5.027745
other
Ca2Ce4S8
14
122
313.55
mp-36395
-2.681947
-2.600288
-5.578434
other
La4Cd2S8
14
122
332.51
mp-1013527
-3.317889
-3.747113
0.678052
other
Be2Ge2P4
8
122
139.68
mp-33406
-4.038684
-4.073845
-3.818532
other
La4Pb2Se8
14
122
383.65
mp-1009084
-4.713968
-4.971129
0.229161
other
Be2Sn2As4
8
122
178.11
mp-4953
-4.747913
-4.79531
0.155907
other
Cd2Ge2As4
8
122
202.41
mp-1238860
-5.398516
-0.279349
-5.720967
other
K2Cr4S8
14
122
292.13
mp-1232063
-4.209214
-4.171939
-3.805124
other
Dy4Mg2Se8
14
122
327.14
mp-1147704
2.171551
2.240533
1.860592
other
Co2Si2N4
8
122
77.27
mp-14092
-6.050354
-3.330126
-2.173585
other
Al2Ag2Te4
8
122
245.06
mp-1206503
-3.647959
-3.550354
0.599271
other
Mn2Ge2P4
8
122
160.27
mp-1173110
-2.599699
-2.778489
-5.462336
other
Tb4Eu2S8
14
122
303.13
mp-19833
-4.167753
-1.340393
-5.900333
other
In2Ag2S4
8
122
196.59
mp-1173299
-3.989132
-4.228244
-3.738371
other
Sm4Eu2Se8
14
122
355.34
mp-1247377
1.021076
2.345767
1.699367
other
Mg2Ir2N4
8
122
103.1
mp-677075
-2.784327
-2.600526
-5.715099
other
Gd4Cd2S8
14
122
303.45
mp-675143
-2.63047
-2.730225
-5.455712
other
Eu2Gd4S8
14
122
307.17
mp-1232258
-4.243433
-4.129764
-3.792098
other
Lu4Mg2Se8
14
122
318.86
mp-675668
-2.593093
-2.82932
-5.509443
other
Yb2Pr4S8
14
122
316.81
mp-1214865
7.181741
6.237006
-3.736707
other
As2N2O8
12
122
217.44
mp-4840
-5.262732
-2.747728
-4.257117
other
Ga2Cu2Se4
8
122
174.38
mp-3839
-6.170538
-3.040813
-2.29916
other
Ga2Cu2Te4
8
122
218.29
mp-1206152
-3.075538
-3.784751
0.631935
other
Si2Ag4P4
10
122
182.91
mp-22386
-6.06705
-3.335078
-2.291287
other
In2Ag2Te4
8
122
272.37
mp-5782
-4.115215
-1.453656
-6.088051
other
Al2Ag2S4
8
122
169.43
mp-676762
-2.821912
-2.835549
-4.899221
other
Yb2Ce4S8
14
122
309.78
mp-37693
-2.662237
-2.811806
-5.43841
other
Nd4Eu2S8
14
122
321.75
mp-34903
-3.43991
-3.898228
0.553376
other
Mg2Ge2P4
8
122
176.2
mp-22261
-6.150461
-3.140128
-2.267736
other
In2Cu2Te4
8
122
242.62
mp-550433
12.510848
6.211869
-1.52023
other
Be2Zn2O4
8
122
74.39
mp-20554
-4.856221
-2.713333
-4.110825
other
In2Ag2Se4
8
122
224.47
mp-674944
-2.974901
-2.901394
-4.314724
other
Sr4U4S8
16
122
460.34
mp-675100
-4.063693
-4.188737
-3.872932
other
Nd4Pb2Se8
14
122
370.91
mp-38771
-2.733681
-2.627329
-5.690978
other
Gd4Mg2S8
14
122
290.93
mp-758621
8.315811
4.236812
-6.942044
other
V4C8O24
36
122
465.71
mp-1245856
2.298763
2.127387
1.636353
other
Al2In2N4
8
122
104.48
mp-1232037
-4.128622
-4.0754
-3.775156
other
La4Mg2Se8
14
122
364.83
mp-33975
-4.716322
-2.716601
-3.847203
other
Cu2As2Se4
8
122
199.56
mp-37108
-2.570703
-2.793738
-5.498252
other
Sr2Nd4S8
14
122
328.56
mp-34141
-2.481376
-2.780962
-5.453465
other
Sr2La4S8
14
122
341.97
mp-38152
-4.006051
-4.259121
-3.748676
other
Sr2Sm4Se8
14
122
362.42
mp-1103987
12.502081
6.638333
-0.446493
other
Mg4Si2O8
14
122
156.75
mp-675645
-2.594721
-2.696488
-5.75624
other
Tb4Pb2S8
14
122
311.13
mp-14089
-4.429789
-1.463633
-5.669877
other
Tl2Cu2S4
8
122
177.94
mp-1232248
-2.703816
-2.66169
-5.751934
other
Ho4Mg2S8
14
122
282.63
mp-1232068
-2.722953
-2.715703
-5.673761
other
Nd4Mg2S8
14
122
307.4
mp-3595
-4.633929
-4.965625
0.233714
other
Zn2Si2As4
8
122
171.95
mp-1209569
7.22603
6.615755
-4.252689
other
P2N2O8
12
122
198.51
mp-39033
-3.961263
-4.283739
-3.773923
other
Sr2Nd4Se8
14
122
370.32
mp-37183
-2.552816
-2.735284
-5.534721
other
Sr2Gd4S8
14
122
315.83
mp-676083
-3.598947
-4.011007
-2.930475
other
Ce4U2Se8
14
122
361.03
mp-1245486
1.376391
2.510383
1.921324
other
Al2Co2N4
8
122
82.76
mp-1245526
0.828725
2.489673
1.761653
other
Li2Ru2N4
8
122
98.52