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-1192951
8.628396
6.027831
-5.349651
other
Re2S4N2O18
26
2
444.79
mp-1216668
10.28089
12.195117
-3.85189
other
V6Zn4Fe2O22
34
2
432.43
mp-1175566
3.87483
22.995674
-1.33525
other
Li9Mn2Co5O16
32
2
288.66
mp-757512
13.808259
8.179659
-0.87625
other
Li4Cr8Si8O26
46
2
529.17
mp-1210156
7.231774
5.460924
-4.168408
other
Re2Pd1N4O8
15
2
232.89
mp-1175718
3.433776
23.558819
-1.48013
other
Li9Mn2Co5O16
32
2
287.32
mp-1224214
-0.179721
1.381911
-4.468151
other
K4Pb2Br8O1
15
2
528.76
mp-733522
8.68487
4.167392
-4.396202
other
Ni2H24N4O24
54
2
496.03
mp-542834
-4.589913
-7.102545
2.812688
other
Ba14Na17Ca1N6
38
2
1,566.54
mp-1291385
5.061002
21.402596
-0.919499
other
Li10Mn4Co2O16
32
2
282.91
mp-766967
13.525509
7.09471
-0.864471
other
Li4Mn6Si12O32
54
2
665.12
mp-780571
14.701781
5.318256
-2.611379
other
Li6Mn8B8O24
46
2
504.63
mp-705429
12.991223
7.609161
-7.233758
other
Li12Co10P16O56
94
2
1,069.92
mp-1266446
12.349258
7.725873
-1.096689
other
Li20Cu2Si4O20
46
2
471.5
mp-2226895
9.580243
13.994565
-0.152709
other
Mg1Mn4Zn2O8
15
2
171.92
mp-755682
8.805617
12.600197
-0.148341
other
Li8Fe2O6F2
18
2
193.76
mp-850209
6.99607
14.12521
-1.181523
other
Li5Mn1Ni4O10
20
2
176.47
mp-877888
7.825425
5.25579
-1.830625
other
Li6Cr6Co2O16
30
2
285.78
mp-663540
7.48164
5.205641
-1.984759
other
Li2U1Mo2O10
15
2
242.03
mp-1175125
6.359246
20.296495
-0.43833
other
Li14Mn8Co2O24
48
2
432.65
mp-1411449
7.582859
5.307939
-2.033673
other
Li3Ti2Cu3O10
18
2
188.36
mp-756144
14.368628
7.629649
-6.547476
other
Li8Fe2P4O16
30
2
316.33
mp-1190152
11.151015
7.634092
-3.702647
other
Sr2Hg2As4O14
22
2
326.91
mp-1223185
7.256025
11.086635
1.414676
other
La4Fe3Ni1O12
20
2
248.6
mp-765294
12.019482
4.928344
-5.291967
other
Sr2P4H8O12
26
2
318.3
mp-2218687
8.199838
12.750376
-1.648383
other
Mg1Co3Te1O8
13
2
152.97
mp-1303744
7.326536
13.795872
-0.972371
other
Li8Ti2Ni6O16
32
2
288.06
mp-616215
5.887707
3.468349
-4.673623
other
Fe4C12Se4O12
32
2
578.82
mp-1104832
7.605226
6.81825
-4.522055
other
K1Mg1C2O10
14
2
220.8
mp-807771
11.644824
12.613083
-0.49941
other
Li3V1Cr3O8
15
2
148.2
mp-1176940
13.1225
7.46769
-7.752894
other
Li14Mn8P16O56
94
2
1,083.35
mp-1200776
8.271145
3.367172
-4.780907
other
H14C4N14O12
44
2
510.05
mp-505396
6.794135
8.838107
-0.795096
other
Cs4Na12Pb4O16
36
2
682.09
mp-1177139
11.805212
7.592332
-7.74656
other
Li10Fe4P10O36
60
2
639.91
mp-754805
11.404892
12.197307
-0.048255
other
Li5Fe3Sb2O10
20
2
211.3
mp-1264671
12.136581
6.576464
0.002197
other
Pr4Y4Si8O28
44
2
666.19
mp-19985
-3.996544
-2.431172
-3.495066
other
Tl2In2P4Se12
20
2
596.83
mp-18216
12.596113
6.34873
-0.352902
other
Ba2Ca4Si6O18
30
2
413.94
mp-1096881
10.855077
12.166096
2.278991
other
Ba2Nb8Fe4O28
42
2
746.26
mp-1200574
10.886952
4.574291
-4.263492
other
Na8Pu2H14O18
42
2
486.59
mp-1201032
7.813768
0.276151
-4.498618
other
Sn8Ge2H72C24
106
2
1,480.72
mp-1323652
7.473566
5.126164
-2.083574
other
Na3P6Pb2O18
29
2
426.71
mp-1358135
12.158504
9.281895
-7.335874
other
V4Zn1P6O24
35
2
417.43
mp-560216
13.005418
6.199813
-6.718929
other
Cs4Ge2P8O26
40
2
644.41
mp-1103690
11.728954
11.304539
-2.608889
other
Lu2W2Cl2O8
14
2
243.86
mp-2232526
14.682673
12.219106
-1.390804
other
Mg1V4O6F4
15
2
200.2
mp-1223370
2.606578
2.067547
1.865449
other
La16Si10N28O2
56
2
827.37
mp-555078
9.298029
9.211993
1.494054
other
Ba6Sr2Sb4O18
30
2
510.2
mp-1407554
7.691503
5.239196
-2.372085
other
Ba2Bi1Sb1O6
10
2
204.29
mp-770763
14.481373
7.307477
-7.007913
other
Li4Mn4P4O16
28
2
367.33
mp-753767
15.181838
5.49055
-2.345973
other
Li4Mn4B4O12
24
2
256.31
mp-1041634
14.556435
7.87355
-3.967371
other
Ca2Ti2P4O14
22
2
279.52
mp-1042781
8.927146
11.249879
-1.087658
other
Ca3Fe4Sb6O24
37
2
530.96
mp-755766
10.834896
12.571188
-0.13004
other
Li10Mn6Sb4O20
40
2
435.1
mp-1191696
11.403717
11.245835
-3.712999
other
Li2Cr2Mo4O16
24
2
334.29
mp-1369300
7.723801
4.739934
-1.352985
other
Li4V4O2F12
22
2
274.49
mp-849737
10.458908
2.819784
1.813409
other
Li2V8O2F22
34
2
437.12
mp-1192790
10.890993
4.540012
-4.189668
other
Cs2Sb2H8O10
22
2
295.3
mp-1227569
7.731926
10.590881
1.437898
other
Ca4La2Ru2O12
20
2
272.61
mp-706386
9.994312
2.405617
-2.687257
other
Zr2H12O6F8
28
2
269.14
mp-26013
13.643971
8.82155
-5.730804
other
Li2Mo4P6O24
36
2
490.16
mp-978284
12.941721
6.027441
-6.43285
other
Na4P6H2O18
30
2
378.15
mp-777877
14.273281
7.373204
-6.387027
other
Li2Cr2P6O18
28
2
331.1
mp-863418
11.904601
7.606266
-7.018154
other
Li2Ni8P6O24
40
2
467.18
mp-768946
9.990124
14.049896
-0.481502
other
Li8Cr6Co2O16
32
2
288.78
mp-766403
10.522896
7.411638
-2.37102
other
Mg3Cu9Si16O48
76
2
872.4
mp-726927
5.624135
3.282017
-4.667395
other
B2Os6C20O20
48
2
874.78
mp-753117
12.752621
12.995515
0.013038
other
Li4Ti3V3O12
22
2
228.71
mp-2230612
10.665784
14.155947
-1.081241
other
Mg1Mn6O8F4
19
2
222.85
mp-863364
14.031081
6.975339
-5.745836
other
Li14Sn9P16O56
95
2
1,325.51
mp-752943
12.834096
7.087405
-7.443223
other
Li4Cu1P2O8
15
2
150.49
mp-1308103
12.242866
13.491305
-0.887724
other
Li6Mn2V6O16
30
2
301.35
mp-1174183
7.218436
18.719648
-0.370322
other
Li4Mn3Co1O8
16
2
152.98
mp-754927
7.439114
15.252116
-0.809539
other
Li5Mn2Ni3O10
20
2
177.68
mp-2231449
12.469749
11.554071
1.95622
other
Mg1Ti5Nb1O12
19
2
214.26
mp-662802
5.675272
3.326927
-4.716868
other
Os12C38S2O38
90
2
1,539.76
mp-1369942
12.828969
7.33825
-7.082258
other
Mg4Co4P8O28
44
2
521.8
mp-1194165
13.674336
4.447066
-2.076317
other
Ba3Ge2B6O16
27
2
323.47
mp-1191459
13.816292
4.243219
-2.224715
other
K2Zn2B6O12
22
2
282.27
mp-1193813
9.55513
7.747123
-5.593503
other
Ti3P4N1O18
26
2
366
mp-1200454
6.661262
6.153958
-3.946628
other
K4Re6Se8O14
32
2
767.51
mp-505307
12.863091
6.491992
-1.030641
other
Na4Si8Ni2O20
34
2
445.31
mp-1197072
5.974519
5.608197
-3.857671
other
Ta12Br24Cl2O30
68
2
1,872.88
mp-559350
4.211843
2.826738
-3.936366
other
Zr4S16N16Cl24
60
2
1,532.61
mp-559012
13.814514
6.898511
-6.749934
other
Na8Mn4P8O28
48
2
607.02
mp-1175735
3.790181
23.063894
-1.450603
other
Li9Mn2Co5O16
32
2
279.58
mp-1663238
13.680162
7.30075
-7.060556
other
Li2Mn2P6O18
28
2
337.77
mp-1194628
6.895066
6.118653
-3.891813
other
Ba2Re6Se8O14
30
2
613.9
mp-1190454
11.163321
7.637516
-3.596986
other
Ba2Hg2As4O14
22
2
351.44
mp-2229013
11.634409
9.331467
2.566985
other
Tm4Mg1Ti2O10
17
2
212.73
mp-656207
10.171433
4.492153
-5.387836
other
Sc4H20S6O34
64
2
925.61
mp-705336
12.91071
7.59225
-7.01886
other
Li4Co6P8O28
46
2
513.31
mp-1174545
4.018961
23.114347
-1.227212
other
Li7Mn2Co3O12
24
2
213.44
mp-1203328
8.662757
1.647536
0.020213
other
Ba4P3H1F24
32
2
481.26
mp-780574
14.397186
5.225336
-2.684703
other
Li4Mn6B6O18
34
2
374.22
mp-1174860
3.500921
23.39469
-1.358315
other
Li7Mn2Co3O12
24
2
216.82
mp-556074
9.346169
7.194425
-3.465816
other
K2Cu3Se4O12
21
2
331.51
mp-26435
13.243223
7.842785
-7.481558
other
Li2Cr2P4O14
22
2
249.57
mp-723406
8.962736
7.562293
-5.117625
other
La2P6H6O20
34
2
497.13
mp-1174561
3.374964
23.301664
-1.471485
other
Li8Mn2Co4O14
28
2
256.39