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-1028855
-6.425535
2.319903
-5.487586
other
Mo1W3Se4S4
12
156
338.76
mp-1025816
-6.698922
2.229345
-5.318097
other
Mo1W2Se4S2
9
156
280.74
mp-1028710
-7.854768
3.319719
-5.855136
other
Te2W4Se2S4
12
156
356.79
mp-1028422
-9.395491
2.728021
-4.02721
other
Te4Mo3W1Se4
12
156
400.75
mp-1026909
-6.180568
2.185404
-4.884816
other
Mo3W1Se4S4
12
156
338.65
mp-1028635
-8.810279
2.601462
-4.851031
other
Te2Mo1W3Se6
12
156
380.88
mp-1026911
-6.358372
2.326728
-5.200294
other
Mo2W2Se4S4
12
156
337.95
mp-1027409
-6.156025
2.153881
-4.853874
other
Mo3W1Se4S4
12
156
338.91
mp-1027281
-6.059752
2.242838
-5.077897
other
Mo2W2Se2S6
12
156
326.8
mp-1224387
6.057006
4.921548
-4.46238
other
Hg1C1N2O3
7
156
138.73
mp-1030616
-9.375573
2.739145
-4.048982
other
Te4Mo3W1Se4
12
156
400.52
mp-1025583
-9.073153
2.729083
-4.8284
other
Te2Mo1W2Se4
9
156
315.12
mp-1030161
-10.064737
2.494482
-3.970837
other
Te6Mo2W2Se2
12
156
419.54
mp-1028999
-7.451566
3.298149
-5.68747
other
Te2Mo1W3S6
12
156
344.45
mp-1025948
-6.00326
2.135151
-4.944132
other
Mo2W1Se2S4
9
156
268.39
mp-1222704
-3.580519
-3.877817
0.9357
other
La1Zn1Ag1P2
5
156
106.35
mp-1030522
-6.796973
2.135674
-5.018764
other
Mo2W2Se6S2
12
156
349.56
mp-1028821
-8.358731
3.14275
-5.595847
other
Te2W4Se4S2
12
156
397.64
mp-1220693
-3.016157
0.336976
-0.142223
other
Nb2Cu1C1S2
6
156
89.28
mp-1029264
-9.958389
2.657134
-4.398944
other
Te4Mo1W3Se4
12
156
400.85
mp-1030524
-6.340977
2.308948
-5.182571
other
Mo2W2Se4S4
12
156
338.01
mp-1028595
-10.193396
2.545436
-4.218085
other
Te6Mo1W3Se2
12
156
421.36
mp-1027549
-6.59686
2.07785
-4.678148
other
Mo3W1Se6S2
12
156
350.94
mp-2217541
9.861562
10.270373
1.752452
other
Y2Mg1Co2O6
11
156
144.76
mp-1028622
-9.359949
3.155241
-4.880925
other
Te4Mo1W3S4
12
156
375.08
mp-1027132
-8.79269
2.809043
-4.337136
other
Te4Mo3W1S4
12
156
375.39
mp-1025824
-6.200166
2.34027
-5.368171
other
Mo1W2Se2S4
9
156
268.28
mp-1028542
-7.881524
3.360579
-5.862469
other
Te2W4Se2S4
12
156
369.98
mp-1028851
-10.020391
2.685805
-4.417846
other
Te4Mo1W3Se4
12
156
401.7
mp-1027395
-7.520696
3.421753
-5.761931
other
Te2Mo1W3S6
12
156
344.98
mp-1025919
-6.179785
2.29552
-5.31582
other
Mo1W2Se2S4
9
156
268.93
mp-1028539
-9.793207
2.667081
-4.185881
other
Te4Mo2W2Se4
12
156
400.6
mp-1236625
7.752611
10.201389
0.623206
other
Ba4Li1Rh4O12
21
156
302.48
mp-1030165
-9.836824
2.72501
-4.177771
other
Te4Mo2W2Se4
12
156
401.57
mp-1029179
-6.339368
2.306825
-5.181395
other
Mo2W2Se4S4
12
156
338.22
mp-1080152
-6.404037
2.306354
-5.473153
other
Mo1W3Se4S4
12
156
335.54
mp-1030459
-8.753993
2.653383
-4.066247
other
Te4Mo4Se2S2
12
156
386.21
mp-1080160
-7.270978
3.219094
-5.418112
other
Te2Mo2W2S6
12
156
346.2
mp-1027781
-6.585857
2.1042
-4.698875
other
Mo3W1Se6S2
12
156
349.36
mp-1030742
-6.362962
2.33047
-5.202845
other
Mo2W2Se4S4
12
156
338.62
mp-1030398
-9.189884
3.059302
-4.671823
other
Te4Mo2W2S4
12
156
373.58
mp-2240167
-4.834886
0.054639
-4.799831
other
Mg1V2Au2S4
9
156
154.63
mp-1236720
11.423294
8.237731
2.042308
other
Li1Lu2Al2O6
11
156
136.29
mp-1080150
-6.586701
2.095866
-4.702684
other
Mo3W1Se6S2
12
156
345.77
mp-1027274
-6.090232
2.290097
-5.106568
other
Mo2W2Se2S6
12
156
326.67
mp-1028592
-10.117621
2.553576
-4.005662
other
Te6Mo2W2Se2
12
156
420.17
mp-1030458
-6.954305
2.97526
-5.131561
other
Te2Mo3W1S6
12
156
344.47
mp-1027472
-5.844739
1.914632
-4.764735
other
Mo3W1Se2S6
12
156
326.63
mp-1025752
-10.05682
2.644568
-3.842131
other
Te4Mo2W1Se2
9
156
334.79
mp-2218938
-8.334434
2.405586
-4.105569
other
Mg1Te4Mo4S4
13
156
440.47
mp-1030164
-9.76482
2.638053
-4.204016
other
Te4Mo2W2Se4
12
156
400.28
mp-1025626
-10.076424
2.64904
-3.849137
other
Te4Mo2W1Se2
9
156
334.95
mp-1030247
-10.07449
2.503281
-4.133876
other
Te6Mo1W3S2
12
156
406.13
mp-1030617
-8.553545
2.475312
-4.597067
other
Te2Mo2W2Se6
12
156
381.26
mp-1028767
-10.110478
2.532496
-4.171716
other
Te6Mo1W3S2
12
156
408.27
mp-1027140
-6.406295
2.304087
-5.473011
other
Mo1W3Se4S4
12
156
339.39
mp-773072
11.449625
10.128229
2.687204
other
Ba8Li1Nb7O24
40
156
583.89
mp-1027714
-6.168331
2.204805
-4.877685
other
Mo3W1Se4S4
12
156
337.9
mp-1218115
-3.549221
0.209527
-3.190063
other
Ta2Re2Sn1Se8
13
156
332.07
mp-1224368
-4.919191
-3.419893
-3.252851
other
Ge1Te1Pb2Se2
6
156
175.14
mp-2226158
-4.933535
-1.021617
-5.647979
other
Mg1Fe1Cu1S2
5
156
77.83
mp-2218810
-5.888585
1.891075
-4.903337
other
Mg1Mo2W2S8
13
156
388.73
mp-1224207
6.016349
5.072353
-4.376104
other
Hg1C1N1O3
6
156
119.78
mp-1025716
-6.176084
2.292842
-5.316784
other
Mo1W2Se2S4
9
156
268.61
mp-1027278
-9.954398
2.52791
-4.000637
other
Te6Mo2W2S2
12
156
407.15
mp-1028642
-6.926153
2.157672
-5.331212
other
Mo1W3Se6S2
12
156
355.16
mp-1028771
-9.708056
2.596764
-4.594205
other
Te4W4Se2S2
12
156
388.17
mp-1217374
-9.757036
2.643502
-4.182411
other
Te2Mo1W1Se2
6
156
149.39
mp-1215705
-3.509639
-3.80202
0.808216
other
Y1Zn1Cu1P2
5
156
88.5
mp-1029327
-10.069965
2.500847
-4.137022
other
Te6Mo1W3S2
12
156
406.6
mp-1030373
-9.608953
2.431569
-3.813532
other
Te6Mo3W1S2
12
156
405.26
mp-1027408
-9.595288
2.429727
-3.817856
other
Te6Mo3W1S2
12
156
406.64
mp-1027051
-6.18031
2.210694
-4.892077
other
Mo3W1Se4S4
12
156
340.05
mp-764225
8.611166
12.487802
-1.180745
other
Li1Co5O5F1
12
156
147.14
mp-1217271
11.485617
8.521071
2.956482
other
Th2P1N1O1
5
156
96.89
mp-1030160
-9.818658
2.464043
-3.755859
original
Te6Mo3W1Se2
12
156
419.33
mp-1228557
9.855662
10.664083
3.3345
other
Ba8Ti3Nb4O24
39
156
570
mp-571093
-3.966154
-5.29856
5.183334
other
Ba1Al1Si1H1
4
156
85.62
mp-1030281
-9.605702
2.427862
-3.819489
other
Te6Mo3W1S2
12
156
406.27
mp-1030577
-9.896403
2.526998
-3.781971
other
Te6Mo3W1Se2
12
156
419.07
mp-1030163
-8.58146
2.547085
-4.613276
other
Te2Mo2W2Se6
12
156
381.56
mp-1028478
-6.420805
2.314214
-5.487115
other
Mo1W3Se4S4
12
156
339.41
mp-1018090
-4.027546
-5.213375
5.245135
other
Ca1Ga1Si1H1
4
156
69.04
mp-1030784
-8.583961
2.548266
-4.613626
other
Te2Mo2W2Se6
12
156
381.63
mp-2220114
-6.087048
2.215663
-5.202012
other
Mg1Mo1W3S8
13
156
386.58
mp-1029139
-9.31606
3.08995
-4.869352
other
Te4Mo1W3S4
12
156
374.36
mp-1030104
-10.131684
2.483454
-4.17148
other
Te6Mo1W3Se2
12
156
420.14
mp-1027078
-7.268762
3.220445
-5.421041
other
Te2Mo2W2S6
12
156
345.58
mp-2217467
7.830747
12.832287
-1.339437
other
Mg1Co2Ag2O4
9
156
117.29
mp-1029421
-8.834343
2.616071
-4.845768
other
Te2Mo1W3Se6
12
156
380.66
mp-1025702
-9.026825
2.702147
-4.847364
other
Te2Mo1W2Se4
9
156
314.2
mp-1233610
7.944334
10.160602
0.722723
other
Ba4Ca1Rh4O12
21
156
308.8
mp-1025664
-9.942763
2.553134
-3.814345
other
Te4Mo2W1Se2
9
156
335.4
mp-1027567
-6.935266
2.958122
-5.120657
other
Te2Mo3W1S6
12
156
350.99
mp-1026975
-6.087201
2.287437
-5.107718
other
Mo2W2Se2S6
12
156
326.64
mp-1222706
-5.256029
-4.484923
0.410545
other
La1Zn1Ag1As2
5
156
116.55
mp-1025710
-9.961893
2.618867
-4.186274
other
Te4Mo1W2S2
9
156
302.17
mp-1029248
-7.518984
3.422843
-5.770584
other
Te2Mo1W3S6
12
156
346.19
mp-1027911
-8.773462
2.810216
-4.327229
other
Te4Mo3W1S4
12
156
385.36
mp-1027627
-6.951614
2.691693
-4.878932
other
Te2Mo4Se2S4
12
156
356.42