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-1223276
-3.604035
1.840871
2.942384
other
La1Ce3B24
28
47
281.62
mp-1225583
-9.403401
-1.247149
4.201372
other
Er1B4Rh7
12
47
155.36
mp-2224453
8.378273
10.516247
-0.034093
other
Mg1Cu2O2
5
47
75.86
mp-1217050
-7.023101
-4.89114
3.737823
other
U2In3Sn3
8
47
201.2
mp-2488451
-7.133791
0.632897
3.744824
other
Fe11Mo1C4
16
47
166.27
mp-1216490
-6.131855
-1.034086
3.648048
other
V18Ga2Ge4
24
47
324.59
mp-1094087
5.404273
10.965937
-0.703116
other
Sr10Fe10O29
49
47
604.06
mp-1222838
-9.296627
-1.301596
2.871368
other
La1Y1Ni10
12
47
163.1
mp-1219946
-8.811265
-4.330716
4.889158
other
Pr2Al5Cu5
12
47
206.86
mp-1226973
-7.929392
-0.857541
4.007398
other
Ce2Mn5Ni5
12
47
179.7
mp-1225224
-7.187654
-0.560776
3.122843
other
Fe3Si2Ni3
8
47
88.44
mp-1229060
-6.076397
-1.028475
3.631152
other
Al1V12Ge3
16
47
214.55
mp-1206385
-3.170676
-2.182166
-3.605255
other
Tm2Se2I2
6
47
6,212.12
mp-1178665
-8.587424
-1.900444
4.01577
other
Zn6B6Ir11
23
47
288.04
mp-1215983
-8.713249
-0.214425
4.741563
other
Y1Th1Co10
12
47
168.5
mp-1216758
-8.161067
-3.174084
3.534699
other
U2Pd3Rh3
8
47
133.31
mp-1224927
-7.895495
-0.777347
3.149639
other
Fe3Ni3Pt2
8
47
97.11
mp-1220445
-8.622582
-0.286937
4.727946
other
Nd1U1Co10
12
47
156.84
mp-1229114
-6.243647
-1.17168
3.807263
other
Al1V12Sn3
16
47
235.87
mp-1223000
-8.767756
-0.268338
4.787538
other
La1Ce1Co10
12
47
168.63
mp-1219018
-8.762908
-0.155231
4.738532
other
Sm1Y1Co10
12
47
164.37
mp-1216496
-6.288742
-1.133126
3.801197
other
V18Ga4Sn2
24
47
341.59
mp-996971
7.690278
10.864432
-0.930854
other
Cu1Pd1O2
4
47
46.7
mp-1221715
8.67778
12.463127
-0.800413
other
Mn1Ni3O4
8
47
79.25
mp-1217463
-7.412294
-5.830765
3.993709
other
Th2In3Sn3
8
47
212.98
mp-1219955
-8.937794
-0.533226
3.976508
other
Pr2Co5Ni5
12
47
170.86
mp-1222997
-6.771621
-5.970231
4.564747
other
Li3La1Ga8
12
47
244.13
mp-1222862
-9.280762
-1.358616
2.839244
other
La1Pr1Ni10
12
47
166.6
mp-1226905
-7.172413
-6.412504
3.838032
other
Ce2Tl3Sn3
8
47
218.8
mp-1225703
-1.151757
2.622987
-3.476281
other
Cu4I3Cl1
8
47
176.25
mp-1225978
-7.402981
-5.875494
3.9326
other
La2In3Sn3
8
47
219.28
mp-1222865
-8.845306
-0.264121
4.824514
other
La1Nd1Co10
12
47
173.89
mp-1206240
-7.382054
-5.96054
3.612118
other
Sm2Cu3Sn3
8
47
207
mp-685445
11.068347
11.800383
2.533383
other
Nb20O39F21
80
47
1,289.84
mp-1216613
-5.153149
-3.350636
5.275879
other
U2Si3Ge3
8
47
139.43
mp-530998
7.690672
10.977218
-0.797951
other
Na12Pt48O64
124
47
1,519.71
mp-1219179
-2.946693
-3.799982
-3.412557
other
Sm3Tm1S4
8
47
176.01
mp-1220560
-7.435267
-5.8516
4.050897
other
Nd2In3Sn3
8
47
211.39
mp-1229062
-6.038482
-1.048895
3.733522
other
Al1V12Si3
16
47
208.66
mp-1225334
-9.43888
-1.226078
4.196325
other
Dy1B4Rh7
12
47
154.6
mp-1218875
-7.750899
-6.330635
3.645819
other
Sr2Al5Ag5
12
47
244.29
mp-1094095
8.129748
11.552599
-1.014268
other
Ni1Br1O1
3
47
48.62
mp-1220419
-9.065376
-0.953177
4.406078
other
Nd2Co5Cu5
12
47
179.02
mp-1218374
9.610856
8.690378
2.030261
other
Sr3Mg1O4
8
47
126.7
mp-29049
6.504396
10.666918
-0.145005
other
Sr3Cu3O9
15
47
178.4
mp-1218560
-3.153993
-2.041496
-5.607391
other
Sr3Pb1S4
8
47
219.53
mp-1223938
-9.415774
-1.257824
4.197747
other
Ho1B4Rh7
12
47
155.81
mp-1227810
-4.535553
-3.523101
-3.992981
other
Ca3Pb1Se4
8
47
217.99
mp-1223027
-9.425073
-1.235383
4.173449
other
La1B4Rh7
12
47
158.39
mp-1223251
-6.947908
-7.035976
3.772624
original
La2Tl3Pb3
8
47
235.77
mp-27418
7.880913
10.032375
-1.314587
other
K1Au1O2
4
47
68.4
mp-530850
10.777778
11.878203
2.589131
other
Ta16Cu8O48
72
47
875.14
mp-1225415
-7.367426
-5.992241
3.939033
other
Dy2In3Sn3
8
47
204.47
mp-1217768
-7.400266
-1.815315
4.20299
other
Ta2Pd3Ru3
8
47
121.37
mp-1226892
-8.981372
-0.881548
4.390181
other
Ce2Co5Cu5
12
47
169.28
mp-1225828
-7.892732
-6.498283
3.841697
other
Eu2Al5Ag5
12
47
237.79
mp-1206751
-3.272933
-2.286156
-3.585879
other
Dy2Se2I2
6
47
6,936.66
mp-2349989
11.093122
11.879704
2.735579
other
Nb2Ag2O6
10
47
137.03
mp-1219136
-2.943664
-3.780315
-3.449031
other
Sm3Dy1S4
8
47
177.96
mp-1229023
-5.919128
-0.965898
3.431634
original
Al3Si1Mo12
16
47
245.07
mp-1219221
-9.043453
-0.790363
4.422
other
Sm2Co5Cu5
12
47
174.79
mp-1220439
-8.95875
-0.555128
3.964967
other
Nd2Co5Ni5
12
47
169.06
mp-1219752
-8.825162
-0.251746
4.796565
other
Pr1Nd1Co10
12
47
174.34
mp-866493
-3.320714
-1.710058
-5.672966
other
Ca6Sn4S14
24
47
587.93
mp-1225966
-9.198319
-2.197116
3.212903
other
Eu2Cu5Ni5
12
47
171.41
mp-612175
-5.965433
-4.332234
0.629789
other
Eu3As4Pd4
11
47
230.03
mp-1217734
-7.570049
-4.814334
2.930145
other
Yb18Co26Sn76
120
47
2,626.71
mp-997084
7.168239
9.541672
-1.395471
other
Rb1Ag1O2
4
47
74.28
mp-1222558
-7.264812
-6.73708
2.822856
other
Li3Ag3Ge2
8
47
131.02
mp-1223249
-7.135321
-6.649259
3.963749
other
La2Tl3Sn3
8
47
226.42
mp-1227310
-7.392463
-5.674285
3.913395
other
Ce2In3Sn3
8
47
210.8
mp-1206203
-3.206346
-1.625132
-3.564441
other
Yb2Se2I2
6
47
6,418.75
mp-1224084
-8.945206
-0.46961
4.077653
other
Ho2Co5Ni5
12
47
163.72
mp-1219305
-5.96787
-0.925318
3.37949
other
Si3Ni1Mo12
16
47
238.94
mp-1220795
-5.56216
-2.837459
3.127825
other
Nb12Sn3Sb1
16
47
301.01
mp-1217728
-7.414231
-5.907727
3.93472
other
Tb2In3Sn3
8
47
205.68
mp-1216214
-9.015035
-0.902229
4.385981
other
Y2Co5Cu5
12
47
172.92
mp-1215586
-8.297916
-3.127116
3.269678
other
Zr2Pd3Rh3
8
47
128.68
mp-649419
-4.261258
-3.750952
0.728576
other
Sr8P12Pd12
32
47
623.83
mp-1227215
7.753557
10.954259
-0.730687
other
Cd2Pt18O24
44
47
566.21
mp-1218977
-8.083232
-3.541242
2.468139
other
Sn2Pd3Pt3
8
47
129.53
mp-1222814
-8.810652
-0.226092
4.822302
other
La1Y1Co10
12
47
171.2
mp-1215823
-7.568377
-4.599543
5.44312
other
Y1U1Ga4
6
47
126.02
mp-1219178
-2.952132
-3.821815
-3.402031
other
Sm3Er1S4
8
47
176.66
mp-628549
11.808803
11.287429
-2.187715
other
Pr1W5O15
21
47
293.96
mp-1207325
-3.101517
-0.846566
-4.115186
other
Yb2S2Br2
6
47
2,931.2
mp-997039
7.461614
10.446793
-0.908632
other
Ag1Pd1O2
4
47
54.54
mp-1220782
-5.516537
-2.577764
3.430138
other
Nb12Ga3Ge1
16
47
279.31
mp-1094111
5.599267
11.06795
-0.310132
other
Sr10Fe10O28
48
47
604.05
mp-1220226
-9.441544
-1.185628
4.204983
other
Nd1B4Rh7
12
47
157.27
mp-1216238
-7.361511
-5.933688
3.9432
other
Y2In3Sn3
8
47
206.77
mp-1216156
-9.236829
-1.836634
3.268877
other
Y2Cu5Ni5
12
47
165.27
mp-1227788
-6.242267
-7.369527
2.72517
other
Ca2Tl3Pb3
8
47
231.82
mp-1237811
7.237287
8.652952
-1.332862
other
Sr1Cu1O2
4
47
78.93
mp-1229051
-5.950868
-0.91036
3.446534
other
Al3Ni1Mo12
16
47
245.46
mp-996966
7.059383
9.563549
-1.424885
other
K1Ag1O2
4
47
67.38
mp-1207331
-3.414495
-2.410588
-3.571576
other
Tb2Se2I2
6
47
8,312.08
mp-1220758
-5.774909
-2.568778
3.67593
other
Nb12Ir1Au3
16
47
287.05
mp-1221007
-5.581951
-2.860656
3.308049
other
Nb12In1Sn3
16
47
303.01
mp-1223263
-8.95188
-0.589338
4.049649
other
La2Co5Ni5
12
47
171.5