mp_ID
stringlengths
8
14
x
float64
-9.59
15.2
y
float64
-10.97
15.1
z
float64
-7.56
7.54
type
stringclasses
1 value
generated_from
stringlengths
4
10
formula
stringlengths
2
24
n_atoms
int64
2
20
spacegroup
int64
1
229
volume
float64
28.2
1.03k
gen-mp-11019
11.000705
8.832661
-0.604941
generated
mp-11019
Cu6Ga3O9
18
8
207.61
gen-mp-1208210
8.465169
1.60063
0.478188
generated
mp-1208210
As1Tl2F5
8
1
213.62
gen-mp-973893
-7.645965
-7.223833
5.520577
generated
mp-973893
Tl5Lu6Hg1
12
1
322.68
gen-mp-1221669
-5.957452
-1.756867
5.010548
generated
mp-1221669
Mn1Si3U1Co2
7
8
95.46
gen-mp-1215682
8.755332
7.186859
-3.019374
generated
mp-1215682
Yb1B1O3
5
155
62.54
gen-mp-1104297
-6.673594
-5.019872
4.467655
generated
mp-1104297
He1U1Ga2
4
8
81.43
gen-mp-1098
-5.194953
-4.875286
0.813029
generated
mp-1098
Yb6As6
12
1
303.51
gen-mp-1071478
-8.104211
-3.384588
2.525002
generated
mp-1071478
Pt9Ce1In1Ac1
12
1
222.5
gen-mp-1225518
11.976031
8.427776
2.852781
generated
mp-1225518
Pu2Er2Th2Sb3O3
12
1
303.76
gen-mp-1219939
-7.124159
-6.353444
2.035954
generated
mp-1219939
Au2Pb5Pd1
8
8
221.26
gen-mp-1212534
-8.114815
-6.909394
5.581972
generated
mp-1212534
Gd2Zn2
4
1
92.9
gen-mp-1186305
-5.136654
-6.226512
3.413656
generated
mp-1186305
Th10Ac1
11
1
617.69
gen-mp-673245
-1.140681
2.617337
-3.524575
generated
mp-673245
Cu6I4
10
1
240.48
gen-mp-1416
8.433177
1.895583
0.184018
generated
mp-1416
Nb1F5
6
1
101.64
gen-mp-23966
10.256225
6.543149
-3.729872
generated
mp-23966
O5Mg2Se1H1
9
1
123.75
gen-mp-998366
-0.534491
1.544352
-3.903407
generated
mp-998366
Br14Se6
20
1
597.68
gen-mp-1272804
9.142681
15.043756
-0.677053
generated
mp-1272804
Mn6Li1O8F2
17
1
201.74
gen-mp-1223373
7.042937
8.429064
-2.024463
generated
mp-1223373
O8La3He1
12
6
183.82
gen-mp-569157
-0.913067
2.114337
-3.158686
generated
mp-569157
Bi2I8
10
1
485.7
gen-mp-11131
-3.388904
-1.278893
-5.422523
generated
mp-11131
S2Ge1
3
44
64.77
gen-mp-549671
-6.172695
-6.545078
4.749314
generated
mp-549671
Li6Mn1K3
10
1
122.01
gen-mp-1187098
-6.05555
-7.136053
3.057328
generated
mp-1187098
Sr3Pb3Zn3
9
1
267.14
gen-mp-4647
-5.393731
-3.012933
-4.480101
generated
mp-4647
K1Cu7Se4
12
1
215.52
gen-mp-25576
12.876717
10.482604
0.450423
generated
mp-25576
Mo2Li1Tc1O4
8
1
91.38
gen-mp-1184621
-8.587936
-6.410679
6.80236
generated
mp-1184621
Nd1Ag2Os2Ho5
10
1
254.63
gen-mp-1213975
-3.489042
1.426212
2.954916
generated
mp-1213975
B6Pm2
8
10
89.45
gen-mp-754183
12.327444
12.805369
-0.596716
generated
mp-754183
Li2O5Ni1V2
10
8
100.67
gen-mp-1215683
-6.001867
-5.439801
5.247591
generated
mp-1215683
Zr1Pa1Al1Th1
4
8
94.46
gen-mp-1057015
-3.20589
-2.194106
-5.591895
generated
mp-1057015
Pb2S2
4
6
108.58
gen-mp-864747
-7.498539
-7.159302
5.507263
generated
mp-864747
Mg3Tl4Ho5
12
6
347.69
gen-mp-13863
12.274047
8.234175
-0.141518
generated
mp-13863
Ba1Ge3O5
9
1
144.06
gen-mp-675589
-4.087441
-4.947999
1.163617
generated
mp-675589
Li6Cu4P2
12
8
151.51
gen-mp-1025340
-5.327009
-2.720134
-4.078431
generated
mp-1025340
Cu2Se2
4
5
80.01
gen-mp-12406
-5.475764
-4.200943
3.198192
generated
mp-12406
U8S1
9
1
410.75
gen-mp-13536
-9.204692
-5.234194
4.01439
generated
mp-13536
Tb2Zn6Ni3
11
1
186.3
gen-mp-4336
-4.065043
-3.699132
0.982296
generated
mp-4336
La3P5Pd2
10
8
221.14
gen-mp-1281
-7.118829
-1.295371
3.937772
generated
mp-1281
V5Tc1Ir4
10
99
141.47
gen-mp-15742
9.881405
9.112507
2.243916
generated
mp-15742
Cu1Nd1O2
4
123
54.35
gen-mp-1217142
1.224679
2.021444
2.410087
generated
mp-1217142
Ti2N2C1
5
8
50.52
gen-mp-27549
-5.073066
-6.454232
0.917682
generated
mp-27549
K3Bi1
4
44
169.29
gen-mp-1205920
-7.198589
-3.848017
5.048227
generated
mp-1205920
Er2Al3U2Co1Ge2
10
1
216.35
gen-mp-867238
-6.56697
-6.861116
3.148152
generated
mp-867238
Sm3Pb9
12
1
386.66
gen-mp-1178932
-5.857839
-3.268289
-1.629671
generated
mp-1178932
Te15Th1
16
1
528.38
gen-mp-1207268
-5.967278
-4.600925
2.825242
generated
mp-1207268
Pu4Pb3Np1Ce1O2
11
8
256.66
gen-mp-1187618
-8.391482
-5.657556
3.924943
generated
mp-1187618
Yb2Nd6Pd8
16
6
446.32
gen-mp-1104605
-8.505877
-6.374439
6.632981
generated
mp-1104605
Nd6Ir3
9
1
242.69
gen-mp-1183455
-5.5987
-7.378649
4.966071
generated
mp-1183455
Pm3Ca3
6
8
221.77
gen-mp-865195
-8.141227
-3.445206
4.460209
generated
mp-865195
Tm2Al2Ga3Rh4Sn1
12
1
209.09
gen-mp-1222863
12.285702
9.486999
1.89172
generated
mp-1222863
Pa1O7Ti2Th2
12
6
174.1
gen-mp-1221345
13.660352
8.205258
-2.492912
generated
mp-1221345
Na1P1O2
4
6
52.19
gen-mp-1207674
-5.332329
-3.388033
1.043818
generated
mp-1207674
Tm2P2Pd2
6
8
110.05
gen-mp-975176
-4.535649
-6.648157
1.427753
generated
mp-975176
Rb2Au2
4
5
153.02
gen-mp-27957
10.640065
8.891053
1.591749
generated
mp-27957
Ba8O8Pa1Ni1
18
6
386.71
gen-mp-865921
-7.935605
-2.231827
4.149772
generated
mp-865921
Al2Ir2
4
221
54.99
gen-mp-1212090
-7.523585
-4.190595
2.588117
generated
mp-1212090
Sn2Ni1
3
225
62.37
gen-mp-30840
-8.220432
-4.340544
2.31637
generated
mp-30840
Pd6Ti1Pu1
8
187
131.95
gen-mp-1068244
-7.924276
-6.22522
6.3764
generated
mp-1068244
Er5Ni2Pu1
8
1
198.57
gen-mp-22937
-1.090838
2.600054
-2.70394
generated
mp-22937
I6Na6
12
8
427.55
gen-mp-775774
6.205023
9.082342
-1.343947
generated
mp-775774
Bi2O4
6
1
93.96
gen-mp-974634
-7.98621
-6.226428
1.955227
generated
mp-974634
Ag3Pd1
4
44
68.08
gen-mp-1216545
-6.613957
-6.958583
3.608818
generated
mp-1216545
Pa3Th1Bi3Tl11
18
1
491.97
gen-mp-1079427
8.188031
10.490275
-0.305333
generated
mp-1079427
Cu6O4Na2
12
8
148.68
gen-mp-1106144
-6.079618
-6.018105
5.914815
generated
mp-1106144
Ce3Th1
4
160
96.94
gen-mp-1189623
-8.956166
-1.550522
3.994497
generated
mp-1189623
Ir3Mg1B2
6
99
72.91
gen-mp-1207424
-8.971978
-6.560205
2.784855
generated
mp-1207424
Pa1In1Au2
4
160
89.14
gen-mp-866104
-7.96826
-7.63285
3.576825
generated
mp-866104
La2Cd8Ca1Pm1Hg4
16
1
419.37
gen-mp-1078518
9.422547
9.818131
0.45726
generated
mp-1078518
Ir3O6Sr3
12
99
183.21
gen-mp-1215183
-6.073307
-4.021531
4.239568
generated
mp-1215183
Al8U8
16
1
386.5
gen-mp-1065609
-5.981321
-3.826491
-1.796482
generated
mp-1065609
Te4Tl2Gd2
8
8
291.87
gen-mp-1080771
2.501346
2.817773
-4.476782
generated
mp-1080771
Cl5
5
121
147.01
gen-mp-21037
-3.250685
-3.924451
-1.8836
generated
mp-21037
S5U7Fe1
13
8
269.7
gen-mp-1222020
-5.186264
-3.06265
-4.125365
generated
mp-1222020
Cu4Lu1Mn1Ge1Se3
10
8
181.22
gen-mp-998749
-0.031636
0.705775
-3.275088
generated
mp-998749
K2Br9Ca1Th5N1
18
1
586.2
gen-mp-21050
-5.194072
-3.539733
3.518069
generated
mp-21050
U8
8
28
140.96
gen-mp-1206381
-4.954722
-4.045851
5.932415
generated
mp-1206381
Nd2Ni2Si2
6
8
117.67
gen-mp-8267
-2.44828
-0.472377
-5.258554
generated
mp-8267
K2P3S7
12
1
317.65
gen-mp-1186427
-8.335544
-4.210519
2.191679
generated
mp-1186427
Pd9
9
2
148.36
gen-mp-20263
-7.083105
-7.222922
5.845317
generated
mp-20263
Pm6Ca2Tc1In5
14
1
460.17
gen-mp-1104276
-9.36398
-1.440429
2.989071
generated
mp-1104276
Er1Th1Ni6
8
6
138.85
gen-mp-1001787
-8.62933
-2.863749
3.756725
generated
mp-1001787
Tc1Li3Rh6
10
8
149.39
gen-mp-1184089
-8.720073
-6.455964
5.398232
generated
mp-1184089
Dy6Au4
10
6
255.02
gen-mp-1227124
-3.998429
-2.555785
-3.617618
generated
mp-1227124
P1Se2Mg1
4
1
103.76
gen-mp-21138
10.76543
10.410496
-2.951638
generated
mp-21138
O5Pb2Mo1
8
1
161.25
gen-mp-1079582
-6.456303
-0.995567
3.955199
generated
mp-1079582
Tc2V1Ir1
4
8
57.68
gen-mp-761128
12.483285
8.906332
2.77576
generated
mp-761128
Nb4Pu2O2
8
1
153.12
gen-mp-1106100
-6.061028
-6.174888
3.87396
generated
mp-1106100
Ge2Li1Eu1
4
160
87.35
gen-mp-1084759
-7.803093
-4.349059
3.20476
generated
mp-1084759
Rh2Sn4Tb2
8
6
176.47
gen-mp-1176629
8.344824
1.561012
-0.31194
generated
mp-1176629
F3Li2
5
8
69.78
gen-mp-849292
15.158214
12.271367
-1.028206
generated
mp-849292
V6F8O6
20
1
238.76
gen-mp-1553
-9.25121
-1.293035
2.800048
generated
mp-1553
Ni5Ho1
6
8
76.76
gen-mp-1113404
-0.360121
0.956144
-3.777668
generated
mp-1113404
Rb1Br3Ac1
5
8
193.96
gen-mp-1027687
-5.38748
1.193935
-4.44101
generated
mp-1027687
S3Mo3Se4
10
156
291.29
gen-mp-560558
-3.670037
-1.542858
-5.310721
generated
mp-560558
Cs6S9Cd2Pd1Au2
20
1
652.53
gen-mp-1208832
-4.010081
-4.264961
-3.64322
generated
mp-1208832
Se10Sm4Lu1Pm1Ca1Mg1
18
8
434.07
gen-mp-557320
1.315596
2.28127
-4.474628
generated
mp-557320
Re1K2Cl6Tc1
10
1
242.85
gen-mp-1115
-4.592828
-2.288648
-3.398186
generated
mp-1115
Se5Pt4Zn1
10
8
202.35
gen-mp-11753
-7.522415
-6.466616
6.483746
generated
mp-11753
Lu3Te1
4
225
112.74
gen-mp-1078878
-8.334991
-6.036904
5.576599
generated
mp-1078878
Ho5In6Eu1Ni4
16
1
341.21
gen-mp-1207079
3.409401
-0.770043
-2.34397
generated
mp-1207079
Sr1H7Pd2
10
6
93.57
gen-mp-979041
-1.291983
0.839754
1.518991
generated
mp-979041
Al3C3
6
8
70.36