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-1217963
10.229022
8.642469
2.751453
other
Sr1Pr1Al1O4
7
107
89.4
mp-1226630
-7.752829
-0.1381
4.647121
other
Ce1Co2Si1B1
5
107
67.4
mp-1227937
9.18526
8.263783
-0.442929
other
Ba1Bi1Br1O2
5
107
118.8
mp-1218421
9.718815
11.237079
0.933031
other
Sr3Fe1Mo1O7
12
107
168.7
mp-1218434
9.336489
8.051384
-0.586211
other
Sr1Bi3I3O4
11
107
270.6
mp-1218232
7.040966
11.062474
1.424336
other
Sr1Gd1Co1O4
7
107
86.78
mp-1219502
10.550622
8.746966
-1.144149
other
Sb1Pb1Br1O2
5
107
100.51
mp-1227044
10.633298
8.444896
2.535952
other
Ca1Y1Al1O4
7
107
80.6
mp-1227839
7.691638
10.684237
1.73457
other
Ba1La1Fe1O4
7
107
104.41
mp-1227068
7.831734
10.907083
1.719262
other
Ca1La1Fe1O4
7
107
93.75
mp-1223374
8.692342
10.047691
-0.058289
other
K4Na8Ni4O8
24
107
417.66
mp-1218325
11.668853
10.283957
1.464626
other
Sr1Ce1V1O4
7
107
96.59
mp-1217982
8.050279
11.315763
2.298512
other
Sr1Nd1Mn1O4
7
107
95.21
mp-1218828
7.770764
11.052864
1.419435
other
Sr8Fe4O12F4
28
107
402.54
mp-1228023
9.688525
8.299504
-0.391584
other
Ba1Bi2I2O2
7
107
294.49
mp-1224281
12.873715
10.460718
2.424974
other
K5Nb16O20F8
49
107
775.06
mp-1216832
10.453677
9.894606
0.855694
other
Ti1Nb1Bi3O9
14
107
189.23
mp-1223196
-7.537268
-4.471317
5.70231
other
La5Al15Cu4Au1
25
107
503.72
mp-1225642
-4.726617
-4.635282
5.856645
other
Eu2Al6Si3Au2
13
107
256.33
mp-1218243
8.079868
11.416228
2.256995
other
Sr2La4Mn4O14
24
107
318.55
mp-1226412
1.240174
2.608546
-5.907164
other
Cs2Cu1Br1Cl3
7
107
225.04
mp-1223077
7.784729
10.792558
1.886648
other
La4Fe1Ni2O10
17
107
216.05
mp-557950
10.324954
9.676517
0.455005
other
Ti1Zn1Bi2O6
10
107
138.92
mp-1209100
5.744927
5.155128
-4.258317
other
Ru1N7Cl1O6
15
107
263.13
mp-1025206
7.65448
8.62846
0.026115
other
Eu2Al1N1O3
7
107
86.87
mp-1227061
9.840422
8.853533
2.199235
other
Ca1La1Ga1O4
7
107
91.69
mp-1218471
8.669368
10.649465
1.926713
other
Sr3Ti1Ru1O7
12
107
160.63
mp-1218485
6.956846
11.031738
0.849663
other
Sr3Co1Ru1O7
12
107
161.37
mp-1218323
10.893496
8.828435
2.617112
other
Sr1Ce1Al1O4
7
107
88.52
mp-1223525
7.992846
9.930504
2.082346
other
K1La7Cu4O16
28
107
384.23
mp-1218098
7.869113
10.945594
1.635631
other
Sr1Nd1Fe1O4
7
107
95.73
mp-1180015
3.693117
3.600243
-3.935709
other
Os1Br3N5O1
10
107
199.59
mp-1227389
9.427592
8.127455
-0.933487
other
Bi1Pb1I1O2
5
107
115.18
mp-1222802
8.625257
9.412244
2.271276
other
La1Nd1Cu1O4
7
107
99.59
mp-1217972
8.035542
11.363159
2.297916
other
Sr1Pr1Mn1O4
7
107
96.09
mp-545359
8.612679
9.197591
-0.05383
other
K1Na2Cu1O2
6
107
105.48
mp-1223012
-5.904785
-1.842281
1.005125
other
La1Ni2Ge1P1
5
107
83
mp-1223506
6.004841
8.640651
-0.452799
other
K1Ba2Bi2O7
12
107
213.28
mp-1223499
-6.08136
-3.440632
-2.032348
other
K1Ba1Ag2Te4
8
107
260.92
mp-1218180
7.87514
11.031213
1.561369
other
Sr1Nd2Fe2O7
12
107
157.33
mp-1224899
10.966387
11.022698
0.245379
other
Fe1Re1Pb2O6
10
107
130.1
mp-1218152
9.627482
8.958652
2.410042
other
Sr1La1Ga1O4
7
107
95.74
mp-1209176
5.746287
5.126731
-4.237121
other
Rh1N7Cl1O6
15
107
250.42
mp-1227817
9.342355
8.679626
1.855937
other
Ba1Sr2In2O6
11
107
184.6
mp-1226758
9.313449
8.24148
-0.550389
other
Cd1Bi1Br1O2
5
107
100.13
mp-546679
10.528872
8.636403
3.117584
other
Nd2Al1N1O3
7
107
87.85
mp-1025276
10.703116
8.67208
3.013165
other
Sm2Al1N1O3
7
107
84.89
mp-1224442
10.721011
10.814721
2.637514
other
Hf1Ti1Pb2O6
10
107
137.28
mp-1218521
8.99157
10.904902
2.376128
other
Sr3Ta1Fe1O7
12
107
169.58
mp-1218291
6.222004
10.981833
0.445603
other
Sr1Eu1Co1O4
7
107
89.65
mp-1217761
6.954383
11.030408
1.424356
other
Sr1Sm1Co1O4
7
107
90.26
mp-1227229
7.41354
11.642467
-0.092831
other
Ca1Fe2Bi1O6
10
107
114.04
mp-1218281
6.292932
10.917742
0.308802
other
Sr1Eu1Ni1O4
7
107
90.09
mp-1218202
7.261553
10.256787
1.560886
other
Sr1La1Cu1O4
7
107
94.1
mp-1226753
9.251058
8.144915
-0.570234
other
Cd1Bi1I1O2
5
107
106.98
mp-1217978
9.8227
8.49406
3.306979
other
Sr1Pr1Sc1O4
7
107
103.13
mp-1218184
10.173344
8.639969
2.742619
other
Sr1La1Al1O4
7
107
90.86
mp-2222855
11.049973
9.133804
2.106352
other
Pr2Mg1Cu1O4
8
107
121.75
mp-1217766
7.014486
11.067038
1.431846
other
Sr1Y1Co1O4
7
107
87.92
mp-1216974
10.236216
9.832121
0.538271
other
Ti1Nb1Bi3O9
14
107
198.79
mp-1227444
9.513225
8.223761
-0.799943
other
Bi1Pb1Br1O2
5
107
106.07
mp-1219447
10.695001
8.841289
-1.048968
other
Sb1Pb1I1O2
5
107
109.4
mp-1218235
7.124594
11.000773
1.287824
other
Sr1Gd1Ni1O4
7
107
88.88
mp-1225911
-7.576762
-4.591555
5.580224
other
La5Al15Cu2Au3
25
107
515.34
mp-1218142
9.722079
8.500525
3.264503
other
Sr1La1Sc1O4
7
107
104.46
mp-1227238
9.480988
8.151792
-0.384977
other
Ca1Bi1I1O2
5
107
110.66
mp-1222801
8.772971
9.665273
2.303227
other
La1Nd1Cu1O4
7
107
93.72
mp-1227067
9.817223
10.786153
2.116469
other
Ca1Nd1Cr1O4
7
107
90.42
mp-1236192
11.704082
8.787148
2.348888
other
Li1Pu2Te1O2
6
107
109.78
mp-1025275
11.41512
8.917051
2.447738
other
Ce2Al1N1O3
7
107
87.17
mp-1218285
7.831817
8.454626
0.915661
other
Sr1Eu1Sc1O4
7
107
103.19
mp-1223108
11.31838
7.946132
-4.140422
other
Li2U8As6O40
56
109
918.91
mp-669555
6.495815
4.763485
-4.454814
other
K4C4N12O24
44
109
706.86
mp-1205224
8.617323
1.308918
-4.222506
other
Ge8H80Se24N32
144
110
1,848.68
mp-1274114
6.915965
10.918126
1.362889
other
Sr4La4Co4O16
28
110
379.81
mp-1194563
11.547724
12.328298
-2.978784
other
Sr4Mn8V8O32
52
110
705.62
mp-1274989
8.258121
10.900573
2.231478
other
Sr12Ta4Co4O28
48
110
673.11
mp-1294077
7.018067
11.059708
1.425275
other
Sr4Y4Co4O16
28
110
356.22
mp-707540
13.195
5.545244
-6.357202
other
Zr4P8H8O32
52
110
721.9
mp-1284693
8.014396
10.777315
2.118419
other
Sr12Nb4Co4O28
48
110
680.29
mp-1203643
10.573013
11.848788
-3.48317
other
V8Co8Pb4O32
52
110
677.56
mp-1197716
12.57517
6.414779
-0.968165
other
Ba8Cu8Si16O48
80
110
1,159.43
mp-1207918
10.53796
11.807531
-3.335682
other
V8Ni8Pb4O32
52
110
654.81
mp-541734
10.530452
11.997041
-3.443409
other
Sr4V8Ni8O32
52
110
645.1
mp-1195702
10.697446
12.039931
-3.52214
other
Sr4V8Co8O32
52
110
659.7
mp-2217227
-5.141846
-0.907427
-5.566017
other
Mg1Fe2Cu2S4
9
111
148.14
mp-2223679
-4.505744
-1.229015
-5.68517
other
Mg1Nb1Cu3S4
9
111
186.35
mp-699554
7.085815
11.960898
1.962016
other
Sr6La6Mn12O36
60
111
714.15
mp-2217390
-4.649592
-1.410426
-5.583162
other
Mg1Cu3As1S4
9
111
172.52
mp-2227108
-4.584895
-0.642208
-5.458921
other
Mg1Cu2W1S4
8
111
185.06
mp-2226887
-4.61293
-0.626466
-5.451754
other
Mg1Cu2W1S4
8
111
167.83
mp-1220816
-4.546494
-1.125859
-5.545017
other
Nb2V3Cu15S20
40
111
811.02
mp-1190102
5.383547
-0.467436
-3.014
other
Li1Y1B4H16
22
111
249.71
mp-1222874
10.613588
8.685016
2.50751
other
La1Pr3Al4O12
20
111
219.64
mp-2222913
-4.653253
-1.136639
-5.670618
other
Mg1V1Cu3S4
9
111
174.84
mp-628568
-4.856399
-1.038496
-5.760779
other
Fe1Cu2Sn1S4
8
111
160.92
mp-2217276
-5.057761
-0.969949
-5.57162
other
Mg1Fe2Cu2S4
9
111
150.02
mp-1221388
5.16792
-0.305308
-2.702572
other
Na2B1H4N1
8
111
103.7
mp-1220497
-5.339938
-2.609862
-3.936347
other
Nb1V1Cu6Se8
16
111
360.43
mp-1194609
5.378874
-0.469417
-3.007389
other
Li2Y2B8H32
44
112
458.51