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-37480
-4.385309
-2.786944
-3.686836
other
Li2Sb2Se4
8
141
183.41
mp-1102486
13.932878
5.089304
-6.554111
other
Sm2P2O8
12
141
151.35
mp-1213464
12.313622
8.619925
0.081051
other
Er4P8O8
20
141
606.91
mp-1246502
1.251174
2.220063
1.580247
other
Li12Re4N8
24
141
291.3
mp-753741
-4.254803
-1.429284
-5.665335
other
Li12Cu4S8
24
141
373.85
mp-505130
10.275663
10.794216
-3.294621
other
Cs2Re2O8
12
141
257.07
mp-754027
9.716352
8.481355
3.048446
other
Na2Sm2O4
8
141
117.31
mp-1191853
-8.066597
-0.275229
4.357528
other
Nd2Co18Si4
24
141
293.21
mp-1247563
1.531163
2.225561
1.073703
other
Na12Co4N8
24
141
392.57
mp-675199
-2.630152
-2.647824
-5.709187
other
Na2Pr2S4
8
141
197.23
mp-1214075
8.765579
2.031364
1.963931
other
Ca4Zn4F8
16
141
289.22
mp-1247352
1.829847
2.320378
0.8168
other
Li12Sb4N8
24
141
440.56
mp-1209996
12.160972
9.882241
0.90868
other
Nd4Mo4O8
16
141
255.2
mp-1202088
5.438153
-0.486861
-3.011774
other
Mg4B8H32
44
141
374.44
mp-1274535
8.977225
14.847227
-0.987648
other
Mn4Cu2O8
14
141
152.98
mp-38695
-4.294685
-4.217876
-3.845961
other
Li2Tb2Se4
8
141
187.27
mp-1019898
14.19838
4.995643
-6.740395
other
La2P2O8
12
141
168.6
mp-1101408
11.834462
8.804043
1.718727
other
Pr2Sm2O4
8
141
127.62
mp-1103324
13.959558
4.968264
-6.813784
other
Gd2P2O8
12
141
148.44
mp-676247
8.147211
1.543117
-0.265714
other
Na2Yb2F8
12
141
158.63
mp-1208180
12.123957
8.176377
0.524286
other
Y4As8O8
20
141
805.21
mp-19126
8.411636
10.422552
-3.203043
other
Nd2Cr2O8
12
141
172.26
mp-1381564
8.837435
13.199655
-1.148293
other
Fe4Co2O8
14
141
146.88
mp-35205
-4.301984
-4.240427
-3.877574
other
Li2Er2Se4
8
141
180.69
mp-18782
8.128507
13.852125
-0.843986
other
Li2Fe2O4
8
141
74.39
mp-760395
12.55381
11.375717
0.168791
other
Cr4O2F4
10
141
198.63
mp-5132
13.895038
4.948857
-6.75309
other
Y2P2O8
12
141
142.97
mp-1212568
12.336563
9.281065
1.111919
other
Hf4Si8O8
20
141
602.72
mp-1393719
-5.053122
-0.885904
-4.64594
other
Ca2Fe4S8
14
141
264.58
mp-1212873
12.310995
9.656843
1.322406
other
Dy4Cr4O8
16
141
220.25
mp-1214200
11.148235
9.24202
-0.280905
other
Bi4As4O8
16
141
262.51
mp-568173
-4.719577
-4.31645
6.109801
other
La4Mg4Si8
16
141
345.89
mp-1100867
10.826676
8.914683
3.169927
other
Y2Pa2O8
12
141
154.21
mp-17474
-7.991918
-0.367583
4.32058
other
Th2Co18Si4
24
141
295.72
mp-754237
9.643554
8.803049
3.287156
other
Li2Tm2O4
8
141
95.64
mp-1208492
-9.048539
-0.787481
4.441596
other
Tb4B8Ir8
20
141
290.27
mp-1176622
10.674829
0.030991
0.162568
other
Li2Mn2F8
12
141
142.06
mp-1214235
12.381091
10.122602
0.379084
other
Bi4Mo4O8
16
141
269.61
mp-756341
6.892644
12.480646
-1.297908
other
Cd2Ni4O8
14
141
152.98
mp-1214372
11.724295
10.167696
1.114975
other
Ba4Os4O8
16
141
274.85
mp-1287570
8.656863
14.454165
-0.171286
other
Ca2Mn4O8
14
141
180.93
mp-1047148
7.123356
10.313972
-0.597292
other
Ca2Cu4O8
14
141
195.92
mp-1208601
12.424189
9.84853
0.951617
other
Tb4Cr8O8
20
141
378.33
mp-1101402
2.57359
2.585237
1.080756
other
Sn16N16O8
40
141
571.23
mp-756878
7.292594
8.665448
-1.589354
other
Na2Yb2O4
8
141
110.19
mp-9600
10.622582
7.952183
-2.052063
other
Cu4Ge2O8
14
141
163.5
mp-36539
-4.798013
-3.162889
-3.617281
other
K2Bi2Se4
8
141
245.42
mp-22796
9.809111
11.730848
-3.594328
other
Eu2V2O8
12
141
170.34
mp-754106
12.316323
7.964633
-7.964815
other
Mn4P2O10
16
141
191.64
mp-754501
8.385664
10.346289
0.130818
other
Ca2Cu4O4
10
141
134.91
mp-2221664
8.638109
13.143091
-0.971171
other
Cd2Fe4O8
14
141
169.04
mp-1410838
-5.199538
-0.786776
-5.405384
other
Mg2Mn4S8
14
141
275.32
mp-1208673
11.978869
10.406992
1.123165
other
Sr4Os4O8
16
141
240.74
mp-753768
6.889977
8.434654
-1.322395
other
Tb2Pr2O8
12
141
174.33
mp-4200
14.276691
5.274125
-6.724537
other
Sc2P2O8
12
141
125.88
mp-30089
11.098546
4.176347
-3.569941
other
Cs2H6O4
12
141
138.46
mp-759533
8.295337
16.05175
-0.172359
other
Na4Mn4O8
16
141
179.31
mp-1209913
12.303019
9.66977
1.06041
other
Nd4W4O8
16
141
257.55
mp-1208340
7.389112
4.887424
-2.277723
other
Tc4N4O8
16
141
166.9
mp-1317973
12.88612
12.258389
-0.27188
other
Ca2V4O8
14
141
176.87
mp-756722
11.282271
8.773846
2.361581
other
Yb2Pr2O4
8
141
120.32
mp-1209703
-8.674289
-0.550235
4.438281
other
Pr4B8Ir8
20
141
303.83
mp-1105540
-6.430021
-3.041057
5.361834
other
Ce4Si4Ir8
16
141
296.13
mp-675871
12.020482
9.036405
1.934409
other
Er2Pa2O8
12
141
110.7
mp-1209561
-8.884982
-0.655199
4.439745
other
Sm4B8Ir8
20
141
295.84
mp-8058
12.058478
7.073865
-4.037621
other
Y2As2O8
12
141
157.66
mp-1306369
6.745352
12.366517
-1.179748
other
Ca2Ni4O8
14
141
164.37
mp-37297
-4.561997
-3.467264
0.718939
original
U4P2S2
8
141
178.98
mp-676416
0.173175
2.187778
2.338975
other
V4C2N2
8
141
71.37
mp-1214931
7.309669
6.260991
-2.977113
other
Ag4I4O8
16
141
260.33
mp-568049
-4.622834
-4.3826
6.336949
other
Nd4Mg4Si8
16
141
332.54
mp-18993
10.737582
12.280379
-3.538278
other
Lu2V2O8
12
141
151
mp-773628
12.633618
13.257209
-0.945575
other
Na2V4O8
14
141
165.21
mp-1208117
12.034532
10.62804
0.2862
other
Tl4Re4O8
16
141
286.24
mp-37879
-4.310825
-4.126981
-3.86989
other
Li2Y2Se4
8
141
185.86
mp-1247005
1.328095
2.51158
1.399824
other
Li12V4N8
24
141
299.48
mp-569384
-4.675595
-4.358359
6.258619
other
Pr4Mg4Si8
16
141
337.24
mp-1214266
12.340803
9.755857
0.690497
other
Ba4W4O8
16
141
303.01
mp-772156
12.123981
7.038695
-4.029737
other
Er2As2O8
12
141
153.26
mp-1190679
-8.397911
-1.604468
2.81731
other
Pr2Si4Ni18
24
141
292.6
mp-2940
14.009846
5.109502
-6.766129
other
Lu2P2O8
12
141
134.09
mp-1387400
-3.907082
-0.569537
-4.708701
other
Ca2Ti4S8
14
141
308.21
mp-18751
8.892571
14.784408
-0.530371
other
Mn4Zn2O8
14
141
151.33
mp-1394893
-5.3909
-0.701659
-4.381246
other
Ca2Co4S8
14
141
259.57
mp-776200
11.820004
7.146287
-3.838103
other
Gd2As2O8
12
141
163.39
mp-5725
-4.228039
-1.534666
-5.494075
other
Cu4Ag12S8
24
141
455.43
mp-35717
-4.308008
-4.184662
-3.87579
other
Li2Dy2Se4
8
141
185.45
mp-673675
9.901464
13.928815
0.159341
other
Li6Mn4O8
18
141
167.67
mp-5914
2.020632
2.311271
1.318951
other
Li12B4N8
24
141
228.06
mp-19360
8.563944
10.706428
-3.259611
other
Lu2Cr2O8
12
141
148.8
mp-1245429
1.898537
1.831389
2.24754
other
Mg2Zr2N4
8
141
91.47
mp-1209615
12.503688
9.702157
1.095164
other
Sc4V8O8
20
141
341.54
mp-764021
8.461514
14.99065
-0.919735
other
Na2Mn4O8
14
141
165.17
mp-1173029
-2.652083
-2.665646
-5.731143
other
Li2Pr2S4
8
141
184.8
mp-1023125
8.019842
11.724583
-0.365297
other
Mg2Cu2O4
8
141
78.99
mp-1213093
12.486811
8.932973
0.474573
other
Ho4P8O8
20
141
690.39
mp-777466
10.376956
1.564821
2.139658
other
Li16Fe8F32
56
141
633.38
mp-1191958
-8.039126
-0.317492
4.334742
other
Er2Co18Si4
24
141
291.24
mp-755431
11.782215
8.776601
1.864441
other
Pr2Nd2O4
8
141
130.88
mp-4340
13.908243
5.133367
-6.712897
other
Tb2P2O8
12
141
144.16