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-1103169
8.535792
9.380441
-0.3974
other
Na4Ag4O4
12
119
217.48
mp-1219024
-8.250424
-5.017329
4.51021
other
Sm1Ga3Pd1
5
119
93.1
mp-1218984
-7.911108
-5.496564
4.921755
other
Sm1Ga3Ag1
5
119
96.8
mp-754908
11.506967
12.302583
1.048826
other
Nb1Cr1O4
6
119
76.05
mp-1223477
-5.684183
-3.352686
0.643046
other
K1As2Rh1
4
119
105.61
mp-1224362
-5.684283
-3.511934
-2.063703
other
Ge1Sb2Te4
7
119
226.59
mp-1212052
-6.010439
-3.52085
-2.270327
other
In2Hg5Te8
15
119
536.14
mp-1222794
-8.07521
-4.71
4.587535
other
La1Ga3Pt1
5
119
98.05
mp-755412
8.925278
12.358073
-1.382884
other
Mn4Sb4O16
24
119
314.78
mp-38170
-4.793865
-2.792341
-4.035834
other
Cd1In2Se4
7
119
184.81
mp-1225152
-7.418014
-5.313738
4.525176
other
Eu1Ga3Cu1
5
119
93.8
mp-1225137
-6.561828
-6.263966
4.469847
other
Eu1Mg1Ga3
5
119
105.52
mp-551798
7.631293
5.201771
-2.357244
other
Al1P1O4
6
119
97.76
mp-1100974
11.760594
8.966831
1.99292
other
U3Bi2O9
14
119
204.23
mp-1215553
-9.423726
-4.666007
3.973371
other
Yb1Al1Cu5
7
119
98.52
mp-755748
11.773419
13.264741
-1.8016
other
Ti2V2O8
12
119
139.03
mp-10287
-5.880384
-3.532997
-1.95509
other
Rb1Mn1Te2
4
119
142.55
mp-1226613
-7.879838
-4.866497
4.712513
other
Ce1Ga3Cu1
5
119
92.42
mp-1215633
-5.147812
-2.917601
-4.1608
other
Zn5Te1Se4
10
119
248.3
mp-1224882
-4.67947
-2.686915
-4.094209
other
Ga2Hg1Se4
7
119
169.81
mp-10006
-6.087771
-3.453301
-2.358346
other
Tl1Ag1Te2
4
119
121.09
mp-1223859
-4.775174
-4.920041
0.082306
other
In2Ga1As3
6
119
165.99
mp-2218962
7.028616
9.959618
-1.548883
other
Mg1Cu4O8
13
119
207.22
mp-1207359
-4.890723
-2.845223
-3.769898
other
Cs1Mn1Se2
4
119
124.45
mp-2219156
8.450957
14.362775
-1.357957
other
Mg1Mn4O8
13
119
217.79
mp-2227057
8.835703
10.757841
-0.044461
other
Mg1Cu2O2
5
119
59.63
mp-1219023
-8.051963
-4.718866
5.180196
other
Sm1Ga3Ni1
5
119
89.15
mp-1215933
-7.154686
-5.093298
5.729186
other
Y1Al3Ag1
5
119
99.64
mp-1217144
-6.039451
-3.159525
4.433735
other
Ti4Al1Ge7
12
119
193.99
mp-1220010
-8.014126
-4.670765
5.176411
other
Pr1Ga3Ni1
5
119
90.44
mp-754809
9.636469
13.025122
0.820701
other
Mn2Nb2O8
12
119
155.69
mp-755390
10.368447
12.87282
1.087586
original
Nb2Fe2O8
12
119
154.55
mp-1219014
-7.858788
-4.911329
5.087437
other
Sm1Ga3Cu1
5
119
89.68
mp-1227055
-4.365609
-4.708036
5.851678
other
Ca1La1Si4
6
119
128.22
mp-673677
9.920385
8.667578
3.108498
other
La2Th3O9
14
119
226.59
mp-29744
-4.980668
-2.831035
-3.777079
other
Rb1Mn1Se2
4
119
115.55
mp-1220163
-8.043918
-4.701628
5.123768
other
Nd1Ga3Ni1
5
119
91.95
mp-1215508
-6.035607
-3.301213
-2.290016
other
Zn1Ga2Te4
7
119
190.97
mp-755493
10.314152
12.197964
-1.053353
other
Cr1Sb1O4
6
119
76.19
mp-1103118
8.357951
9.186119
-0.228576
other
Rb4Cu4O4
12
119
275.17
mp-1223581
-4.875674
-6.199724
0.63013
other
K8Sb2Te1
11
119
601.06
mp-1226654
-7.39788
-4.556533
5.586421
other
Ce1Al3Cu1
5
119
95.45
mp-1221595
-3.998034
-1.368449
-5.837605
other
Mn1Hg4S5
10
119
259.77
mp-676077
9.565736
8.707284
3.206402
other
Ce3Nd2O9
14
119
212.18
mp-1207101
-5.055767
-2.841499
-3.824152
other
K1Mn1Se2
4
119
106.75
mp-1215580
-4.887932
-1.799679
-6.611149
other
Zn5Se1S4
10
119
201.44
mp-1225144
-4.196052
-4.762985
5.800231
other
Eu1Cu1Si3
5
119
87.25
mp-1219973
-8.116494
-4.651155
4.607145
other
Pr1Ga3Pt1
5
119
95.69
mp-1226580
-7.905966
-4.635639
4.891841
other
Ce1Ga3Ni1
5
119
90.07
mp-12776
-4.680664
-0.987404
-5.099114
other
Tl1Fe1S2
4
119
85.41
mp-1221538
-7.08697
-1.16508
3.401999
other
Mn2Si1Ni1
4
119
45.63
mp-1221973
-5.932815
-3.467605
-2.408785
other
Mg1Hg4Te5
10
119
364.54
mp-1190680
5.424977
-0.459121
-3.014549
other
Mg2B4H16
22
119
341.64
mp-1216933
-7.598042
-4.365919
4.55722
other
U3Ga8Cu4
15
119
264.86
mp-33397
-4.806446
-2.828915
-4.104766
other
Cd1Ga2Se4
7
119
166.17
mp-698640
7.446628
11.979868
2.048898
other
La7Mn8O24
39
119
477.73
mp-1215535
-7.941733
-4.837962
4.454951
other
Yb1Ga3Cu1
5
119
91.78
mp-10286
-5.84001
-3.459327
-1.971664
other
K1Mn1Te2
4
119
134.7
mp-675813
10.007773
8.596199
3.136386
other
Sm2Th3O9
14
119
219.71
mp-1214245
7.047185
6.465728
-4.25756
other
Be2S2O16
20
120
233.25
mp-732207
7.429068
6.603618
-4.639677
other
Be2S2O16
20
120
402.2
mp-1217240
-2.542492
-0.53192
-5.088199
other
U6P8S32
46
120
1,128.72
mp-30402
-8.280616
-6.120469
2.284775
other
K2Sn4Au8
14
120
345.7
mp-1188897
7.257201
7.832946
-3.575252
other
Be2S2O16
20
120
313.32
mp-30510
-8.188686
-2.415242
2.656838
other
Ce2Ni8Sn4
14
120
191.26
mp-1202342
9.356787
0.249646
0.115524
other
Cs10Co10F40
60
120
1,045.62
mp-1224734
-2.534799
-2.771639
-5.35394
other
La40S58O2
100
120
2,485.59
mp-3667
13.668195
7.553362
-5.503849
other
P8S8O12
28
120
566.45
mp-1191396
-6.079951
-5.639325
0.879906
other
Mg8Ag8Sb8
24
120
555.45
mp-23353
-1.239121
2.561544
-3.131239
other
Cu2Hg1I4
7
121
233.49
mp-1229122
-1.183485
2.735531
-3.129999
other
Ag2Hg1I4
7
121
266.98
mp-1225338
-3.782893
-3.883879
0.797249
other
Dy4Cu5P7
16
121
268.11
mp-34467
-4.154251
-1.346417
-5.923169
other
Zn1Ga2S4
7
121
145.33
mp-19414
8.392637
10.512142
-2.911674
other
K6Cr2O8
16
121
321.22
mp-14175
7.544507
5.713995
-3.405778
other
K3Nb1O8
12
121
180.97
mp-531248
8.657188
14.904716
-0.982152
other
Li7Mn17O32
56
121
552.13
mp-647275
-5.147298
-7.162229
3.372895
other
Ba39Li80N9
128
121
3,953.39
mp-1206386
-7.466198
-1.46667
3.783423
other
Mg1Co4Ge6
11
121
159.94
mp-1222737
7.865348
9.661624
-0.041892
other
La1Ti2O6
9
121
117.28
mp-5461
7.547523
5.805121
-3.524723
other
Rb3Ta1O8
12
121
200.95
mp-1078002
-4.996129
-2.647045
-3.879904
other
Mn1Ga2Se4
7
121
174.38
mp-1223857
-6.08229
-3.458919
-2.158526
other
In3Ga1Te4
8
121
260.45
mp-1224839
-6.054281
-3.460501
-2.149847
other
Ga2Hg1Te4
7
121
226.83
mp-1223066
-6.044874
-4.71994
1.106645
other
La4Mn3Sb8
15
121
420.14
mp-22993
6.421072
5.902701
-3.526355
other
Ag1Cl1O4
6
121
81.39
mp-8311
-2.924258
-3.662502
0.86743
other
Si3Ni1P4
8
121
138.2
mp-675626
-5.200776
-2.677587
-4.10604
other
Cu3As1Se4
8
121
170.77
mp-546707
9.210957
3.797656
-7.479689
other
Na4C1O4
9
121
127.31
mp-18876
7.029925
5.974398
-3.688469
other
K3Cr1O8
12
121
181.96
mp-1224441
10.591884
11.175382
-3.162474
other
H1W4O12
17
121
232.16
mp-9808
7.527752
5.75825
-3.398698
other
Rb3Nb1O8
12
121
201.79
mp-1025337
-6.057353
-3.561444
-2.301971
other
Tl2Cd1Te4
7
121
267.39
mp-1224823
-7.946023
-2.95699
2.639714
other
Ga1Ge1Pt6
8
121
121.2
mp-531650
8.52753
14.815414
-1.135312
other
Li7Mn16O32
55
121
546.17
mp-1209909
6.806302
6.191993
-3.929924
other
Nb1N3O8
12
121
195.86
mp-645303
8.306746
4.513922
-6.507523
other
Cs4C1O4
9
121
284.23
mp-1207388
10.717957
10.395271
3.634075
other
Zr3Ti1O8
12
121
138.17
mp-4690
7.574592
5.755415
-3.52622
other
K3Ta1O8
12
121
180.22
mp-21869
-7.824535
-3.653985
3.062762
other
Gd1Sn6Ru4
11
121
232.44
mp-1227367
11.842124
7.2222
-0.604836
other
Be1Zn3O4
8
121
86.18