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-1105142
-4.051656
-2.529714
-3.459477
other
Tl2Sb2P4Se12
20
4
580.45
mp-558917
8.688605
8.219494
-3.827531
other
Li2Mo2I2O12
18
4
260.23
mp-559043
-3.430086
-1.556785
-5.48715
other
K2La2Ge2S8
14
4
376.86
mp-850397
9.735366
13.593456
-0.557269
other
Li8Cr4Fe10O24
46
4
449.82
mp-560899
12.692755
4.219878
-3.058954
other
Ca4B12H20O32
68
4
575.34
mp-680446
-2.916708
-0.914872
-4.227345
other
Cu36P48Se48Br36
168
4
4,275.14
mp-1217000
8.113488
0.816859
-4.440413
other
V2H52C24O8
86
4
1,002.78
mp-763217
12.709162
7.322049
-7.271606
other
Li4Ni4P4O16
28
4
284.43
mp-1259114
3.351038
-0.631541
-2.47253
other
K2Na4Al2H12
20
4
361.57
mp-1220410
0.261109
1.586757
-4.475934
other
Os8Se2S22Cl16
48
4
1,293.58
mp-1079461
7.247542
8.666284
-2.074513
other
Ag4I2O2F2
10
4
225.92
mp-1214400
6.793277
6.100679
-3.998483
other
Ca2As2N2O22
28
4
454.41
mp-753427
13.322411
8.602137
-6.23664
other
Li2P4W2O16
24
4
311.91
mp-1197189
7.700087
6.607361
-3.253994
other
Gd2H4I6O20
32
4
470.49
mp-1044771
12.412483
10.210114
0.530318
other
Ca2Pr2W4O12
20
4
267.98
mp-1177919
8.164555
14.459718
-1.20353
other
Li8Mn12Ni4O32
56
4
570.89
mp-1199077
13.408195
4.337184
-2.478707
other
Ba4B12H8O26
50
4
497.35
mp-1196910
11.878286
6.925253
-3.886131
other
Ba12As12H12O48
84
4
1,278.89
mp-1198055
3.28324
2.836289
-4.231672
other
P12C4N8Cl52
76
4
2,369.68
mp-1663809
14.345315
7.418489
-7.097202
other
Li4Mn4P4O16
28
4
330.97
mp-752517
13.364139
8.988312
-6.28796
other
Li2V4P2O14
22
4
258.79
mp-18911
14.525142
8.451219
-6.834171
other
Li2V2P4O14
22
4
272.71
mp-757743
13.582136
7.005322
-0.832982
other
Li8Mn4Si12O32
56
4
680.6
mp-1237314
8.006882
1.851276
-4.43256
other
H20C8S8N12
48
4
587.25
mp-21903
-3.395421
-1.54013
-5.530284
other
K2Eu2Ge2S8
14
4
383.72
mp-554107
10.962982
7.76791
-0.400679
other
K8Na16Ge8O28
60
4
950.95
mp-759849
10.697878
12.452358
1.954488
other
Li4Ti12Zn6O32
54
4
606.87
mp-1176818
12.556567
6.57319
-6.556164
other
Li2Bi2P8O24
36
4
561.68
mp-643123
8.637398
8.987886
-0.031423
other
K10Ag2N4O4
20
4
504.97
mp-765230
10.988982
2.502426
0.910975
other
Li2V2O2F6
12
4
150.97
mp-773082
12.245255
13.575978
-0.876816
other
Li8V12Cr4O32
56
4
599.52
mp-1227767
12.145061
6.476383
-0.033313
other
Ca18Si8O34F2
62
4
895.37
mp-772493
12.361073
7.915527
-1.018646
other
Li6Co6Ge12O32
56
4
596.31
mp-850889
9.78956
7.98589
-6.037036
other
Li12Cr4P8O36
60
4
704.71
mp-849343
11.947423
7.673165
-7.701628
other
Li2Mn2P8O24
36
4
451.93
mp-1188569
7.933491
5.283563
-5.076643
other
S4N2O8F4
18
4
319.41
mp-561303
-2.480527
-0.518976
-5.305037
other
Na2Sb2P4S12
20
4
490.56
mp-773081
11.218717
12.457552
1.834036
other
Li6Ti12Zn6O32
56
4
608.1
mp-558102
12.78058
6.377331
-0.76827
other
K2Li2Si4O10
18
4
245.84
mp-766382
9.290085
11.126711
2.642448
other
La8Ti8Cr4O36
56
4
706.15
mp-1222223
7.944099
8.306545
-2.393887
other
Mg4Al4Si2O18
28
4
366.2
mp-1176699
14.794582
7.784568
-5.44689
other
Li4Fe4P4O16
28
4
359.73
mp-1180454
7.380814
8.072425
-3.63439
other
Na4Te2P2O22
30
4
478.72
mp-779070
12.428443
7.302206
-7.513787
other
Li8Ni4P8O28
48
4
556.01
mp-773055
11.369308
12.492842
1.82188
other
Li6Mg6Ti12O32
56
4
608.67
mp-1224884
-6.338741
0.008662
3.380518
other
Fe6Mo12Pt2N4
24
4
302.02
mp-32017
11.111249
8.114795
-7.830509
other
Li6Mn6P8O32
52
4
597.04
mp-754669
15.058106
8.143701
-5.163069
other
Li8V4P8O28
48
4
585.99
mp-1180252
3.960864
2.615773
-3.556944
other
Ni2C8Br6N2
18
4
515.24
mp-752971
10.508443
12.758364
-2.758093
other
Li8V2O8F2
20
4
239.53
mp-697774
10.525377
8.004908
-6.795304
other
Li8Cr4P8O32
52
4
560.05
mp-26263
9.433868
8.118531
-5.953503
other
Li6Ni6P8O32
52
4
596.74
mp-557836
13.024788
5.071333
-6.065949
other
Na10B4P6O26
46
4
561.95
mp-1664598
8.343413
14.83117
-1.002036
other
Li4Mn6Fe2O16
28
4
284.54
mp-1193565
8.547049
7.767973
-4.275957
other
Zn4As4N4O16
28
4
483.73
mp-1212028
9.234889
6.699417
-3.924121
other
La4H4Se8O28
44
4
627.92
mp-759667
13.437335
4.815299
-2.752421
other
Li8Sn4B8O24
44
4
491.16
mp-690866
14.269261
7.413246
-7.135627
other
Li4Mn4P4O16
28
4
333.71
mp-1223528
-3.594105
-1.350596
-5.596242
other
K4Ga4Ge4S16
28
4
771.13
mp-1177116
7.103236
12.234618
-1.086795
other
Li20Fe4O16F4
44
4
450.28
mp-568802
-4.126015
-2.50942
-3.350018
other
K2Bi2P4Se12
20
4
561.84
mp-1192659
8.638037
1.246233
-3.875931
other
Li2Ga2H16N8
28
4
316.45
mp-6433
13.155703
5.976944
-6.589917
other
K2Nd2P8O24
36
4
492.38
mp-1374254
7.052567
9.547409
-2.691848
other
Ca2V2Bi2O12
18
4
284.16
mp-1221374
10.98243
8.645477
-4.170249
other
Na8Mo4As8O36
56
4
873.03
mp-777310
13.138821
7.529245
-7.176506
other
Li2Cr2P8O24
36
4
465.56
mp-705031
8.928727
7.805053
-5.144683
other
Li8Ni4P8O32
52
4
686.85
mp-755488
11.366521
10.290866
3.823365
other
Sr4Ta4N4O8
20
4
269.97
mp-1105141
-4.152359
-2.506592
-3.283329
other
Tb2Tl2P4Se12
20
4
536.79
mp-1196303
7.575775
9.604532
-3.823781
other
Cr8Fe4N4O32
48
4
766.29
mp-12012
-4.717095
-3.188798
-3.549561
other
K2Pr2Ge2Se8
14
4
437.58
mp-673098
12.556039
6.625273
-6.699836
other
Li2Bi2P8O24
36
4
492.57
mp-557180
8.124377
2.032668
-0.681938
other
Ca2As4Xe8F40
54
4
1,099.14
mp-18661
13.223676
5.995242
-6.76795
other
K2Y2P8O24
36
4
494.16
mp-556806
12.455583
6.269842
-0.451682
other
Ba2Na4Si4O12
22
4
322.37
mp-1101525
13.512354
6.87785
-6.619655
other
Li4Sn4P16O48
72
4
960.63
mp-721075
11.727741
4.619861
-5.002806
other
Ga4P6H22O26
58
4
601.31
mp-1221159
12.732122
6.463097
-0.788875
other
Na4Mg12Si16O48
80
4
938.23
mp-1202111
9.769475
7.118858
-2.490304
other
Ca2Al4Si12O40
58
4
899.89
mp-1191190
10.154999
7.079983
-2.595157
other
Na2Si4B2O14
22
4
292.05
mp-1289779
11.54933
12.34831
-0.345495
other
Mn4Fe2Re2O12
20
4
225.93
mp-1218618
7.943295
11.549663
2.11645
other
Sr12Ca2Mn8O26
48
4
695.93
mp-1224145
13.050878
8.750381
-5.687487
other
K8Mo8P8O44
68
4
1,029.63
mp-1203968
9.667898
7.04158
-2.728907
other
Ca2Al4Si12O42
60
4
923.03
mp-612946
8.445491
1.805328
-0.506495
other
K2Te2O2F6
12
4
249.54
mp-758608
10.82994
13.391788
-0.780495
other
Li8V4Fe10O24
46
4
453.56
mp-1101557
10.385171
8.164718
-6.93834
other
Li8Mn4P8O32
52
4
568.01
mp-1229258
4.50669
2.646534
-3.531074
other
Al2C8N2Cl4
16
4
473.55
mp-18168
12.751266
6.099918
-5.792498
other
Tl4Zn4P4O16
28
4
420.16
mp-555284
9.541541
8.542042
2.880015
other
Ba4Nd2Al2O10
18
4
311.79
mp-557301
13.030935
6.306075
-0.775423
other
K4Ti2Si12O30
48
4
649.09
mp-17894
-2.523725
-0.556373
-5.339798
other
Rb6Sm2P4S16
28
4
806.68
mp-757811
14.600713
8.630372
-6.452148
other
Li6V6P8O32
52
4
598.49
mp-759685
8.24884
3.851117
-7.26306
other
Li8Co4C8O24
44
4
539.61
mp-773039
10.698108
12.457624
1.951344
other
Li4Ti12Zn6O32
54
4
605.53
mp-758312
12.940528
12.76647
-0.364903
other
Li4Ti4V10O24
42
4
456.18
mp-1202821
13.686462
4.19215
-2.123863
other
Sr6B12O22F4
44
4
500.81
mp-757506
12.825648
7.44256
-7.335384
other
Li16Co8P16O56
96
4
1,180.37
mp-758569
12.973461
7.467762
-1.318218
other
Li6Fe4Si4O16
30
4
347.51
mp-1218879
12.373743
6.726163
0.40062
other
Sr4Al4Si2O14
24
4
334.19