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-1340630
7.838789
5.201141
-2.006312
other
Li4Mn2P4O14
24
2
283.04
mp-1219052
-5.793811
1.596338
-4.85688
other
Sn1Mo12Pb1S16
30
2
569.61
mp-1650315
14.92201
5.790231
-2.132092
other
Li16Fe4B8O24
52
2
495.77
mp-757049
7.269456
13.542008
-1.178353
other
Li6Ni6Sn3O18
33
2
342.39
mp-1543276
9.645828
5.081579
-6.902355
other
K1Fe1S2O8
12
2
165.88
mp-504151
9.774426
7.693231
-5.733455
other
Li2Bi4P6O24
36
2
552.47
mp-505004
10.484951
4.092332
-4.56201
other
Mn2H20S2O18
42
2
389.4
mp-1175835
3.438778
23.393749
-1.455433
other
Li9Mn2Co5O16
32
2
292.07
mp-759205
8.431276
16.538624
-0.046304
other
Li9Ti3Mn9O24
45
2
464.06
mp-19110
14.262375
7.131974
-5.794202
other
Ba2Cr2P4O14
22
2
306.71
mp-570829
2.110982
2.777696
-4.37231
other
V2I2N2Cl6
12
2
342.35
mp-730154
11.43876
7.269435
-4.310633
other
Na2As6H4O18
30
2
366.98
mp-1214383
5.49607
3.236816
-4.651818
other
Bi2Ru6C18O18
44
2
867.47
mp-557871
11.491762
7.314875
-3.851035
other
Cu2As2Pb2O8
14
2
225.27
mp-2232868
9.012859
10.189113
0.15702
other
Na6Mg1Co2O6
15
2
200.06
mp-1314136
6.619812
13.916401
-2.055469
other
Li2Mn2Co6O16
26
2
286.7
mp-1666320
6.440387
20.222694
-0.435072
other
Li14Mn8Co2O24
48
2
434.81
mp-1197637
8.810429
4.059649
-4.402519
other
Sm12H88N16O102
218
2
2,182.17
mp-1227253
11.46197
11.594733
2.04633
other
Ca1U3Ti8O24
36
2
452.87
mp-1174215
7.243136
18.646854
-0.368988
other
Li4Mn3Co1O8
16
2
152.56
mp-781767
6.56712
13.069364
-1.350332
other
Li3Fe2Cu2O8
15
2
154.29
mp-754953
10.128174
0.745972
-1.298293
other
Li2Co6O4F12
24
2
263.55
mp-1175720
3.600195
23.348263
-1.471854
other
Li9Mn2Co5O16
32
2
284.07
mp-556402
10.824233
7.942824
-3.381397
other
Cu2Ag10As6O22
40
2
572.95
mp-1304584
12.601913
13.432128
-0.716517
other
Li4Ti2V6O16
28
2
304.33
mp-1174437
4.051486
22.935175
-1.274625
other
Li8Mn2Co4O14
28
2
249.01
mp-861128
8.121211
16.592686
-0.352448
other
Li6Mn5Co1O12
24
2
243.76
mp-1193700
9.19713
6.257773
-4.046255
other
Na3H5Se4O16
28
2
378.22
mp-1305171
8.095365
4.437328
-6.993269
other
Li4Mn4C8O24
40
2
392.45
mp-1311067
9.85365
14.044005
0.360556
other
Li10Ti4Mn6O20
40
2
391.03
mp-1282783
11.554053
13.392373
-1.8978
other
Na2Mn6V8O24
40
2
421.62
mp-696497
12.926632
6.273713
-0.907039
other
Mg3Si4H2O12
21
2
233.75
mp-540447
12.497083
7.418699
-7.25735
other
Li2Ni2P6O18
28
2
317.11
mp-1200129
7.816173
7.821671
-4.153867
other
K6Te2P4O28
40
2
708.95
mp-1371261
7.944687
5.610772
-1.653934
other
Li5V3Co2O10
20
2
189.17
mp-756561
6.049227
11.321018
-1.619807
other
K2Li8Fe2O10
22
2
229.51
mp-1195282
10.103944
3.032857
-3.86218
other
Zn4H24Cl8O12
48
2
636.91
mp-560549
8.269914
7.121789
-3.500038
other
Au4Se4Cl4O12
24
2
484.49
mp-2218603
8.597476
11.374907
-2.590414
other
Mg1Cr2Ni2O8
13
2
150.72
mp-757413
12.391934
7.316005
-1.593227
other
Li4Si8Ni8O26
46
2
483.24
mp-1369722
7.54384
5.875687
-1.827297
other
Li5Fe3Cu2O10
20
2
185.41
mp-1192853
-3.408436
-1.150587
-5.225395
other
Cs8Mn2As4S16
30
2
1,010.26
mp-1202664
6.654291
5.705707
-3.553085
other
Er2H4Cl6O26
38
2
506.04
mp-1196076
9.518151
5.040635
-6.805533
other
K8V4S8O38
58
2
947.26
mp-1198068
10.283986
6.718137
-5.286421
other
Cu8As4H8O24
44
2
460.15
mp-554763
9.417439
6.847394
-3.918562
other
Np4Ag4Se4O20
32
2
490.11
mp-553962
-3.422098
-1.177686
-5.479842
other
Rb8Li4Nb4S16
32
2
946.27
mp-1139957
1.312989
2.158581
-5.599274
other
Li4Y4Tl8Cl24
40
2
1,113.65
mp-2218045
6.998084
12.622553
-1.335658
other
Mg1Zn2Co2O6
11
2
122.26
mp-556630
11.651769
7.195572
-4.328379
other
Rb2Al2As4O14
22
2
306.32
mp-2227396
9.190475
14.782743
-0.841624
other
Mg1Mn4O6F2
13
2
162.68
mp-557209
11.325041
7.71449
-3.884834
other
Ni4Bi4As4O20
32
2
415.42
mp-2218325
6.873729
11.615071
-0.977802
other
Na4Mg1Ni2O6
13
2
151.03
mp-758340
9.191902
14.453203
-0.278179
other
Li8Mn6Sn4O20
38
2
418.92
mp-1175550
3.810839
23.179253
-1.347295
other
Li9Mn2Co5O16
32
2
285.54
mp-1238354
10.203848
3.241546
-4.467148
other
H28Se4N6O16
54
2
537.29
mp-1196542
7.576464
6.531597
-4.666782
other
Ni2P8N4O38
52
2
876.86
mp-1400697
7.529452
5.007176
-1.773732
other
Bi2Pd3Pt1O8
14
2
188.64
mp-1189013
6.308732
5.27359
-4.428634
other
K2Pt1N4O10
17
2
296.13
mp-1191856
11.281928
7.894721
-2.911947
other
In4As4Cl4O10
22
2
416.67
mp-1218614
7.241357
10.993652
0.80229
other
Sr4Li1Ru3O12
20
2
248.46
mp-1201225
7.672047
8.745172
-3.907479
other
Np4Cr6N8O32
50
2
966.81
mp-1666380
7.41273
10.752234
0.827875
other
Ca6Co2Rh2O12
22
2
269.86
mp-1045238
11.596194
11.004707
0.441538
other
Ca4Cr2W2O12
20
2
240.91
mp-770876
11.380313
6.232253
-3.44683
other
Li6Ni2B4O12
24
2
243.94
mp-1047301
12.5158
11.553346
-1.375537
other
Al1V1W2O8
12
2
135.58
mp-721193
5.581688
3.277343
-4.642613
other
H8Ru16C52O52
128
2
2,086.55
mp-26063
14.331315
7.345872
-6.183722
other
Li4Cr4P12O36
56
2
695.63
mp-669309
-0.987143
1.331082
-1.774234
other
Cs1Y10C4I18
33
2
1,168.77
mp-1978995
12.404602
7.871678
-8.248227
other
Li2Mn4P4O16
26
2
304.49
mp-1175681
3.81197
23.028942
-1.44883
other
Li9Mn2Co5O16
32
2
280.1
mp-1244564
8.07677
8.707653
-3.373326
other
Cu13Si2Sb2O28
45
2
509.32
mp-1337071
7.373614
4.773544
-1.675847
other
Al2Si6Ag2O16
26
2
350.77
mp-804062
9.6071
14.751817
-0.334417
other
Li4Mn3V1O8
16
2
153.77
mp-1313407
10.001009
14.098507
0.187433
other
Li8Mn6Nb2O16
32
2
330.05
mp-757778
12.931499
6.82856
-1.197143
other
Li4V2Si12O30
48
2
606.08
mp-1234344
14.432058
12.103635
-0.821832
other
Mg1V8O8F8
25
2
292.83
mp-1643291
14.370107
8.317484
-5.157026
other
Fe8P4Cl4O16
32
2
452.63
mp-753071
10.133599
2.812482
1.853537
other
Li4V4O2F12
22
2
292.21
mp-1203729
7.050797
4.170701
-4.823156
other
Ba2Cu1C12O18
33
2
523.15
mp-1236963
12.433232
5.5778
-1.903546
other
Ba4Si4H8O16
32
2
409.9
mp-1193284
11.737638
11.337355
-3.741309
other
Nd4Mo4Br4O16
28
2
548.23
mp-1388529
7.692778
5.178236
-1.881335
other
V2P2H2O10
16
2
175.12
mp-18182
9.895578
9.101068
0.468301
other
Cs4Na12Ti4O16
36
2
621.59
mp-755837
7.994887
15.449327
-0.575596
other
Li5Mn3Ni2O10
20
2
184.51
mp-1367959
14.756859
8.30801
-4.967175
other
V4Zn4P8O28
44
2
517
mp-1175759
4.003595
22.894703
-1.31983
other
Li9Mn2Co5O16
32
2
286.98
mp-1178027
5.953649
13.191986
-1.674854
other
Li2Co1Ni3O8
14
2
136.93
mp-849243
13.38771
5.499714
-2.958359
other
Li2Mn6B6O18
32
2
371.64
mp-705525
7.096359
5.384095
-4.672066
other
Yb6H20N8O49
83
2
1,042.8
mp-758237
13.71364
7.303504
-0.821694
other
Li4Cr4Si10O26
44
2
522.06
mp-2240030
12.758311
11.132323
0.905818
other
Mg1Ti2Fe2O6
11
2
118.62
mp-726714
9.134521
7.61399
-5.324472
other
Ca2Mn1P2O10
15
2
197.38
mp-778756
14.331403
8.377109
-1.518302
other
Li4V4B4O12
24
2
244
mp-698001
10.645948
10.440989
1.418122
other
La10Re6Ni2O32
50
2
658.3
mp-1219930
13.530653
4.906928
-1.330491
other
Pr8B6O20F2
36
2
443.23
mp-1201180
7.407149
6.788083
-4.62901
other
Mn2Fe4P4O32
42
2
682.96
mp-1238863
-4.892078
-0.140071
-5.542368
other
Ti4Cr4Ag4S16
28
2
625.07
mp-1175614
3.565506
23.287569
-1.422489
other
Li9Mn2Co5O16
32
2
289.42
mp-2228560
6.772826
13.304565
-1.773726
other
Mg1Co4Ni1O8
14
2
143.09