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-555508
12.253284
6.734336
0.142062
other
Ca11Si4S1O18
34
119
494.83
mp-1218101
-6.177689
-1.479008
3.584673
other
Ta8Ti8Co8C4
28
119
384.05
mp-1227957
-6.072426
-2.631976
0.920132
other
Ba1Fe1As2Ru1
5
119
106.03
mp-1216266
-5.263056
-3.02753
5.377836
other
U1Cr1Cu1Si2
5
119
80.47
mp-1226642
-5.432722
-3.205334
5.649038
other
Ce1Cu1Si2Ru1
5
119
83.12
mp-1216038
-5.400365
-1.819982
-3.848252
other
Zn4Cr20Ga4Se40
68
119
1,457.63
mp-1218963
10.790274
12.02744
-3.378433
other
Sm1V2Bi1O8
12
119
176.62
mp-2229185
11.629027
9.859038
2.449428
other
Sr4Mg1Ti3O10
18
119
244.62
mp-1229127
-4.004967
-1.585416
-5.569757
other
Ag2Sn1Bi1S4
8
119
175.81
mp-2227886
10.481344
9.234221
0.239507
other
Mg1Sn1Bi1O4
7
119
102.12
mp-2227557
12.823371
11.836209
0.432689
other
Mg1Ti1V1O4
7
119
73.49
mp-2227355
11.759305
9.839205
1.267702
other
Eu2Mg1V1O4
8
119
113.76
mp-1228841
-4.60692
-1.319375
-5.49121
other
Cs1Co1Cu1S2
5
119
109.84
mp-1147552
10.439534
11.68945
3.081152
other
Sr1Nb2Cu1O7
11
119
145.76
mp-1223485
-5.310106
-2.480961
-3.84456
other
K1Fe1Cu1Se2
5
119
105.56
mp-1227116
-5.597845
-2.387009
5.819145
other
Ca1Fe1Si2Rh1
5
119
81.26
mp-2223135
12.808409
11.792706
0.543173
other
Mg1Ti1V1O4
7
119
74.47
mp-1223472
-4.802094
-1.175889
-5.328293
other
K1Fe1Cu1S2
5
119
92.73
mp-1215791
8.64928
9.996372
-0.966979
other
Yb2W1N2O3
8
119
104.25
mp-1225286
-5.63375
-2.972385
5.825429
other
Dy1Co1Si2Rh1
5
119
78.43
mp-2232232
7.414047
11.805688
-1.135403
other
Mg1Cd2Ni4O8
15
119
200.19
mp-1226751
-7.927705
-2.543835
5.225902
other
Ce1Co1Ge2Ru1
5
119
87.8
mp-1272303
5.904117
10.938537
0.137398
other
Ba2La2Fe4O12
20
119
252.8
mp-1225887
-3.700489
-1.529209
-5.673186
other
Cs1Li1Zn1S2
5
119
119.21
mp-2225882
12.851337
10.825324
0.848707
other
Mg1Nb1V1O4
7
119
77.37
mp-1216615
-5.353407
-0.94295
-4.493367
other
Tl1Co1Ni1S2
5
119
92.95
mp-1216599
-5.235515
-3.455426
5.417954
other
U1Cu1Si2Ni1
5
119
76.01
mp-2225595
10.91257
10.101242
1.591656
other
Sr2Mg1Cr1O4
8
119
121.02
mp-754641
9.506677
14.292343
-0.346981
other
Li2Mn1Cr1O4
8
119
74.07
mp-2232736
7.373004
12.237233
-1.337657
other
Mg1Cd2Co4O8
15
119
210.87
mp-754851
9.614143
12.899721
-0.315041
other
Li8Co4Sn4O16
32
119
323.28
mp-1226165
-5.605424
-0.223325
-5.617297
other
Cr12Ga2Co3S24
41
119
726.98
mp-1226532
-5.59525
-2.237372
5.625855
other
Ce1Mn1Cr1Si2
5
119
82.99
mp-1177955
7.258938
14.144364
-1.030321
other
Li2Fe1Co1O4
8
119
71.73
mp-1216306
-7.68695
-3.455322
4.643447
other
U1Co1Cu1Ge2
5
119
83.62
mp-2232401
11.339761
12.326492
-0.180683
other
Mg1Cr4Cu2O8
15
119
192.38
mp-1177839
11.096705
12.932231
0.382023
other
Li8Ti4Fe4O16
32
119
302.89
mp-1177950
6.917848
13.632761
-1.003922
other
Li4Fe2Cu2O8
16
119
143.74
mp-754547
10.467703
13.488703
0.46132
other
Li8Ti4Mn4O16
32
119
316.68
mp-1227251
-6.961864
-1.127491
5.295478
other
Ca1Mn1Fe1Ge2
5
119
85.9
mp-1229120
-4.585567
-2.7389
-3.777536
other
Ag2Bi1Sb1Se4
8
119
199.44
mp-2226697
11.894231
10.092739
0.923208
other
Sr2Mg1Mo1O4
8
119
137.83
mp-1224411
10.74594
12.235481
-3.501558
other
Gd1Y1V2O8
12
119
168.45
mp-755002
8.303429
12.524245
-0.692885
other
Li4Ni2Bi2O8
16
119
175.25
mp-1223987
-4.648872
-2.623749
-3.933436
other
In1Ag2Sb1Se4
8
119
189.1
mp-1223991
13.229745
6.559256
-5.89036
other
Ho2V1P1O8
12
119
154.96
mp-2227558
10.996038
9.101915
2.024287
other
La2Mg1Cu1O4
8
119
124.4
mp-2224825
-5.523013
-0.283511
-5.829946
other
Mg1Cr4Cu2S8
15
119
283.91
mp-1216774
-7.698807
-3.565868
4.332398
other
U1Cu1Ni1Ge2
5
119
82.13
mp-2228046
8.803863
14.57047
-0.648967
other
Na2Mg1Mn4O8
15
119
219.46
mp-755278
11.984123
13.100589
-0.397975
other
Li4V2Cr2O8
16
119
146.9
mp-1220731
10.495311
11.109121
3.214079
other
Na1La1Nb2O7
11
119
167.41
mp-1222747
10.859414
10.998463
3.213431
other
La1Ta2Ag1O7
11
119
167.32
mp-1222299
2.060998
2.424014
1.514979
other
Li1Mg1B1N2
5
119
64.82
mp-1215939
-5.104174
-3.627299
5.675137
other
Y1Cu1Si2Ni1
5
119
77.74
mp-1222926
-5.100494
-3.695044
5.654886
other
La1Cu1Si2Ni1
5
119
83.61
mp-2227561
10.746394
10.12957
1.639447
other
Sr2Mg1Mn1O4
8
119
120.83
mp-755365
10.107435
12.797595
-0.136854
other
Li8Mn4Sn4O16
32
119
345.79
mp-1226624
-5.275911
-3.362077
5.497051
other
Ce1Co1Cu1Si2
5
119
79.75
mp-1177995
8.78099
12.673576
-0.471088
other
Li2Cu1Sn1O4
8
119
80.08
mp-1216316
-7.578943
-2.884716
4.82546
other
U1Co1Ni1Ge2
5
119
80.52
mp-753050
6.918638
13.726905
-1.022129
other
Li4Fe2Ni2O8
16
119
143.14
mp-2227107
12.431223
11.862179
1.055662
other
Mg1Ti1Cr1O4
7
119
74.01
mp-754901
9.663392
13.773793
-0.502741
other
Li2Cr1Fe1O4
8
119
73.63
mp-1218517
12.262226
7.215556
0.636765
other
Sr4Al6Mo1O16
27
119
438.23
mp-2219096
11.658934
10.496441
1.129456
other
Sr3Mg1V2O7
13
119
181.52
mp-1216637
-5.820674
-2.306028
5.32235
other
U1Re1Si2Ru1
5
119
83.61
mp-1227081
10.817682
12.224936
-3.521105
other
Ca1Th1V2O8
12
119
176
mp-2227419
12.421216
11.836954
1.083243
other
Mg1Ti1Cr1O4
7
119
74.79
mp-1177941
6.222402
19.066742
-0.761866
other
Li2Mn1Co1O4
8
119
74.22
mp-1217380
10.960908
11.990309
-3.40162
other
Th1V2Pb1O8
12
119
186.8
mp-1216642
-5.348741
-2.396466
-3.873723
other
Tl1Fe1Cu1Se2
5
119
105.46
mp-774479
10.716744
11.260278
3.296873
other
Li1Ca2Ta3O10
16
119
215.82
mp-2218909
8.283582
11.24972
2.01082
other
Sr3Mg1Mn2O7
13
119
181.85
mp-1222890
-5.434991
-2.417889
6.007805
other
La1Fe1Si2Rh1
5
119
85.76
mp-754910
8.399606
13.876006
-0.672974
other
Li2Cr1Ni1O4
8
119
70.61
mp-757583
8.780102
13.239725
0.24455
other
Li2Ti1Cu1O4
8
119
74.36
mp-1216780
-5.722733
-1.903272
5.364021
other
U1Mn1Fe1Si2
5
119
73.03
mp-1216552
-5.709022
-2.875382
5.781471
other
U1Si2Ru1Rh1
5
119
82.85
mp-1225492
-7.13161
-3.391224
1.736003
other
Eu2Mn1P3Pt7
13
119
228.63
mp-761608
6.687595
14.115094
-1.439941
other
Li4Co2Ni2O8
16
119
140.31
mp-557147
12.728579
9.16882
-4.605084
other
Ba1Mo4P2O16
23
121
330.58
mp-1218366
6.517858
12.16773
1.138096
other
Sr2Ca2Mn4O12
20
121
224.74
mp-22611
-5.471943
-2.17935
-3.81442
other
In1Fe2Cu1Se4
8
121
192
mp-1078909
-6.131324
-3.064415
-2.295762
other
Cd1Cu2Ge1Te4
8
121
236.14
mp-22648
-4.872039
-1.03552
-5.762706
other
Fe1Cu2Sn1S4
8
121
160.23
mp-1080131
-6.125969
-3.174813
-2.207548
other
Cu2Si1Hg1Te4
8
121
230.1
mp-22400
-5.28678
-2.626087
-4.074832
original
Mn1Cu2Sn1Se4
8
121
192.79
mp-1227269
-4.680229
-3.213852
-3.685128
other
Ce1Tl2In1Se4
8
121
231.36
mp-1093995
-4.805954
-2.701804
-4.090656
other
Zn1Ag2Sn1Se4
8
121
219.47
mp-1217194
10.7514
11.206464
2.112673
other
Ti2Ag1Bi1O6
10
121
118.62
mp-1226959
-6.077023
-3.420069
-2.345483
other
Cd2In1Ag1Te4
8
121
286.87
mp-758070
14.308539
7.413227
-5.11491
other
Li1Cu2P1O4
8
121
87.93
mp-1224745
-4.717058
-1.22778
-5.657997
other
Fe2Cu10Sb4S13
29
121
561.65
mp-638590
-5.981046
-3.448395
-2.215155
other
Mn1Tl2Ge1Te4
8
121
259.25
mp-1222021
-4.784605
-1.27125
-5.69082
other
Mn2Cu10Sb4S13
29
121
570.5
mp-1191071
9.518028
2.988523
-4.275254
other
Nb1H12N3O8
24
121
211.26
mp-1221353
-4.574009
-3.186212
-3.789188
other
Na2Eu1Ge1Se4
8
121
204.52
mp-1220498
-5.74583
-2.687154
2.615565
other
Nb8Co2Sb4Pd1
15
121
276.32
mp-1219751
-4.768343
-3.179717
-3.804781
other
Pr1Tl2In1Se4
8
121
239.51