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-649676
12.934709
6.151176
-0.371506
other
Ca12Si12O36
60
14
1,157.94
mp-1272846
5.481156
10.96029
-1.266173
other
Ca4Fe4O12
20
14
226.63
mp-1226040
-5.45599
-0.801102
-3.667563
other
Co2Ru2S8
12
14
175.13
mp-27531
11.097433
10.720998
-3.525227
other
Te4Mo20O64
88
14
1,250.5
mp-766434
12.969666
6.167583
-6.98772
other
Sn4P8O28
40
14
542.81
mp-779518
13.211341
6.379771
-6.333642
other
Ba4P16O44
64
14
1,122.97
mp-1190384
7.641807
7.43471
-4.032101
other
Ca4Se4O16
24
14
402.57
mp-26150
12.230636
7.199316
-7.025304
other
Sb4P16O48
68
14
881.03
mp-777742
-4.456376
-1.008784
-5.409613
other
Li12Fe4S12
28
14
477.01
mp-29833
9.376291
7.273099
-3.191927
other
Bi8Se12O36
56
14
856.63
mp-761025
9.16433
8.572232
0.09586
other
Rb12In4O12
28
14
630.26
mp-29467
13.70189
7.562429
-5.003962
other
P16Se12O24
52
14
1,213.21
mp-558116
9.616193
0.364695
0.586908
other
K4Mn4F16
24
14
337.6
mp-13229
8.158278
0.843003
1.645579
other
K6Gd2F12
20
14
375.29
mp-22074
11.487775
10.091868
2.774111
other
Ce4Ta4O16
24
14
322.32
mp-573390
-5.659377
-1.89579
4.280479
other
Np4Si8Mo6
18
14
305.2
mp-1179933
8.687577
7.120161
-3.824914
other
Pr4Se16O44
64
14
1,086.15
mp-760031
9.837745
2.220106
0.451236
other
Li8V8F40
56
14
715.29
mp-774259
11.828532
10.913955
-0.235913
other
Na12V4O12
28
14
415.31
mp-541997
-4.934412
-2.914855
-3.765776
other
K12Fe4Se12
28
14
873.39
mp-1194229
9.588145
8.092295
-5.900335
other
Fe6P4O20
30
14
358.24
mp-10798
9.579789
7.313512
-3.216241
other
Hg4Se4O12
20
14
316.24
mp-1205344
9.898944
9.488975
0.986342
other
Pr4Sb4O16
24
14
344.81
mp-1047945
8.990082
2.312049
0.922469
other
Ba4W4F28
36
14
549.31
mp-28399
5.20103
2.866306
-3.881692
other
H24C12S36
72
14
1,473.52
mp-1221025
11.90755
11.933729
2.088684
other
Na8Ti24O48
80
14
896.72
mp-3768
6.346031
4.984093
-4.549328
other
K4N12O16
32
14
474.58
mp-1197618
12.615593
10.693769
0.403666
other
La32Mo42O112
186
14
2,556.9
mp-21547
-5.323009
-6.07531
0.585722
other
Na24In8Sb16
48
14
1,369.03
mp-771090
11.474535
11.16903
-2.587862
other
Gd4W8O30
42
14
716.04
mp-27156
10.298574
12.023872
-3.832205
other
V8Co8O28
44
14
504.98
mp-29437
11.354829
7.28679
-4.119828
other
Zn16As8O36
60
14
754.84
mp-4445
10.856541
7.854604
-3.464802
other
Hg12As4O16
32
14
561.61
mp-8947
-2.851338
-1.006753
-5.400622
other
Sr4B8S16
28
14
532.01
mp-1197919
8.841439
7.714693
-5.08082
other
Zr4P8O36
48
14
735.21
mp-1211662
8.144304
0.833907
1.690597
other
K6Tb2F12
20
14
369.94
mp-766127
10.313924
9.021194
-6.244676
other
V8P8O40
56
14
818.97
mp-1202659
7.729087
8.047908
-3.826057
other
K4P8O32
44
14
843.64
mp-1207660
6.540195
6.150679
-3.841772
other
Zn4Cl4O32
40
14
749.65
mp-768512
8.317342
6.517345
-5.636548
other
Cu8S12O48
68
14
838.18
mp-1443382
10.706885
11.11321
-2.79376
other
Re2W2O12
16
14
217.45
mp-1200486
-4.529161
-3.132409
-3.678943
other
Ba8Sn4Se20
32
14
1,005.71
mp-568493
-1.171433
2.790505
-3.087734
other
In12Sn4I20
36
14
1,414.31
mp-779498
8.34447
9.067216
0.638105
other
Ba24Cl16O16
56
14
1,744.76
mp-676685
-5.65197
-1.079846
-3.998211
other
Li2Ni18S20
40
14
540.45
mp-29893
11.090927
10.774822
-3.272147
other
Hg8Mo4O16
28
14
506.08
mp-1208369
8.394225
1.639521
-0.168786
other
Tb4Pt4F28
36
14
505.22
mp-673017
9.021818
7.677624
-5.562972
other
Cu4P4O16
24
14
329.45
mp-1182023
3.42559
-0.733
-2.52806
other
Ca8Al8H40
56
14
720.21
mp-556031
14.093431
7.224798
-5.315163
other
Sn4P4O14
22
14
334.7
mp-15416
-4.641165
-5.378241
0.290672
other
Rb16Ga8As16
40
14
1,389.05
mp-768939
10.180336
4.575094
-7.131211
other
Sn8S12O48
68
14
1,023.53
mp-27346
1.41788
2.258018
-5.136959
other
Al8Hg12Cl32
52
14
1,540.4
mp-1210910
7.895486
5.840715
-5.4139
other
Mg10C8O36
54
14
708.56
mp-1196896
7.255671
4.647986
-5.306142
other
Ca8C16O40
64
14
1,026.02
mp-989614
0.889512
2.334112
1.780528
other
La4Re4N12
20
14
367.73
mp-1221310
-4.715135
-5.447361
0.563186
other
Na8Sr12As16
36
14
971.06
mp-1178450
9.985714
8.352411
-0.130808
other
Cs12Ge4O14
30
14
702.34
mp-781016
8.727535
12.318374
-0.229859
other
Li28Fe8O26
62
14
692.32
mp-561154
13.963668
4.166099
-2.244051
other
La4B12O24
40
14
363.67
mp-572441
8.356192
8.544951
-0.277817
other
Cs36Au12O24
72
14
2,211.03
mp-1182774
8.211618
6.264152
-5.341201
other
Cs4S4O16
24
14
469.73
mp-729513
5.236338
2.906947
-3.832715
other
C20N16O12
48
14
811.41
mp-18112
-4.457983
-3.179829
-3.718436
other
Sr8Ge8Se20
36
14
978.71
mp-8763
10.689039
7.580337
3.250805
other
Tm8S8O4
20
14
373.01
mp-768961
14.009373
4.239582
-2.251555
other
Y4B20O36
60
14
575.25
mp-1105457
1.457046
2.442509
-5.486077
other
Tl4Cu4Cl12
20
14
500.55
mp-771040
7.676059
6.665526
-3.098275
other
Mg4I8O24
36
14
548.95
mp-772959
13.630732
5.563698
-6.958301
other
Er8P16O52
76
14
1,145.61
mp-530875
7.687844
11.87326
2.115838
other
Pr24Mn22O72
118
14
1,464.4
mp-1359531
8.994229
7.934719
-5.592001
other
Co4P8O28
40
14
498.11
mp-776463
-1.240083
1.943232
-1.653183
other
Ba12Y8I48
68
14
3,069.52
mp-29550
1.154061
1.877341
-5.421469
other
Ba8Eu4Cl28
40
14
1,194.32
mp-31954
11.143423
8.189031
-8.114227
other
Mn10P12O44
66
14
890.72
mp-1211695
8.222164
0.914029
1.759716
other
K6Er2F12
20
14
362.76
mp-18217
-4.693013
-3.214334
-3.85123
other
K12Al4Se12
28
14
880.83
mp-772158
-1.251554
1.882789
-1.577406
other
Ba8La4I28
40
14
1,974.49
mp-735715
12.616469
13.118519
-1.107348
other
Yb4V16O32
52
14
581.79
mp-27353
7.536795
2.328228
-1.328795
other
Sb12Cl24F36
72
14
1,774.57
mp-1203291
8.182185
8.017136
-3.625025
other
U10Pb4O44
58
14
1,001.06
mp-1201186
10.53297
3.503797
-4.08394
other
Na4H60O32
96
14
897.83
mp-734425
4.521084
3.124989
-4.071794
other
Pt4S16N16
36
14
840.12
mp-759628
10.491616
0.967157
-1.399044
other
Co6O4F8
18
14
200.3
mp-1041770
11.854285
10.038434
-2.59077
other
As8W6O32
46
14
668.31
mp-1105578
2.350863
2.811275
-3.923177
other
Cu4N4Cl12
20
14
551.45
mp-767627
11.697793
-0.493873
0.308637
other
Mn6O4F12
22
14
265.83
mp-26802
12.806175
8.249725
-7.349715
other
V4P16O48
68
14
866.26
mp-1197023
8.31807
6.378892
-5.508224
other
Pt4S8O32
44
14
642.47
mp-772958
13.617838
5.561478
-6.939566
other
Er8P16O52
76
14
1,126.82
mp-644307
8.251352
1.050579
-3.901943
other
Ca4H16N8
28
14
270.67
mp-1203892
-5.871145
-3.138549
-1.619804
other
Cs12Ti12Te44
68
14
2,717.09
mp-1178458
8.33155
6.407933
-5.840341
other
Co8S12O48
68
14
845.26
mp-3219
9.972251
7.309202
-5.305439
other
Eu4P4O16
24
14
286.86
mp-779989
13.572453
5.643769
-6.797774
other
Gd8P16O52
76
14
1,199.39
mp-541114
8.543792
1.188228
0.608842
other
Sr8Rh4F28
40
14
554.95
mp-1188937
4.699513
2.855888
-3.655669
other
C4N12Cl4
20
14
415.39
mp-764875
14.482571
8.210265
-4.966992
other
Fe36P24O96
156
14
1,869.27
mp-559505
11.918662
10.331031
-2.374054
other
V4Te4O16
24
14
345.28
mp-571437
-0.400494
0.722454
-2.536279
other
La40C40Cl26
106
14
2,275.08
mp-1212706
-0.530413
1.277392
-4.371543
other
Fe4Ag4Br16
24
14
733.97