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-1205181
11.154171
3.484837
-4.732641
other
In2P4H18N4O16
44
43
405.36
mp-541093
8.675685
2.064177
-0.042979
other
Nb4Hg6S2O8F20
40
43
711.17
mp-779754
8.221325
4.902761
-6.801189
other
Na10Ni4As2C8O32
56
43
696.33
mp-769570
8.204709
5.182435
-6.770072
other
Na6Fe4P2C8O32
52
43
685.88
mp-1224808
8.691128
1.715657
-0.039694
other
K8Sn4H4O4F24
44
43
779.88
mp-1203916
7.6969
5.209936
-5.579553
other
Li4Fe4C8Cl4O26
46
43
721.48
mp-779752
8.896896
3.654653
-7.631245
other
Na10V4P2C8O32
56
43
696.46
mp-776638
8.317907
4.456881
-7.209038
other
Na10Mn4As2C8O32
56
43
722.17
mp-774309
13.159291
8.361659
-8.012356
other
Li4Mn2V2P8O28
44
4
539.02
mp-634418
12.631595
5.840693
-1.636741
other
Na2Ca2Si2H2O8
16
4
185.46
mp-1192566
9.345536
7.2119
-3.80621
other
V2Pb4Se4Cl2O16
28
4
467.46
mp-1215045
13.067641
8.825119
-0.371622
other
Ca4Al8Si8W16O32
68
4
1,156.67
mp-735777
4.757819
2.715899
-3.534225
other
Pr2C38S12N18O4
74
4
1,782.51
mp-1101670
8.208999
6.504118
-6.075884
other
Na2Co2P2C2O14
22
4
295.38
mp-1256464
13.024045
5.040573
-1.450361
other
Ba14Si2B6N2O26
50
4
837.36
mp-25464
8.147234
6.475934
-6.297985
other
Li2Co2P2C2O14
22
4
262.01
mp-20156
11.0073
11.178376
0.21672
other
Na2Nd2Mn2W2O12
20
4
257.19
mp-1204476
8.096716
0.511484
-4.407919
other
B2H34C12N2Cl2
52
4
523.87
mp-709885
10.209764
4.241822
-6.592642
other
Rb16Li4H12S16O64
112
4
1,817.59
mp-684816
8.737435
1.443174
1.334895
other
K4Na2Nb2O4F8
20
4
319.45
mp-772750
9.332491
3.725887
-8.279537
other
Li6Mg2P2C2O14
26
4
270.53
mp-743671
13.645881
6.061935
-7.094788
other
K8Ti6Mn2P12O48
76
4
1,013.38
mp-1203255
8.358136
6.963907
-5.018598
other
U2P2H6C4O20
34
4
486.19
mp-779883
11.058781
8.575023
-7.34049
other
Li2V4P8H4O32
50
4
550.06
mp-1221104
12.748782
6.426093
-0.341761
other
Na2Ca2Al2Si4O14
24
4
304.37
mp-756880
9.545975
3.83864
-7.694162
other
K2Ce2P2C2O14
22
4
420.66
mp-1198516
6.504693
6.147865
-3.78208
other
Ag6C2N2Cl4O20
34
4
553.76
mp-769488
9.577171
3.806037
-8.51308
other
Na10Fe4P4C4O28
50
4
626.33
mp-756333
14.491964
7.69612
-5.563907
other
Li2Fe4P4H2O16
28
4
326.63
mp-1204319
8.506605
1.231266
-4.373614
other
H44Pt4C12S2O12
74
4
744.96
mp-771343
9.134168
4.464627
-7.838181
other
Na6Tl2P2C2O14
26
4
357.58
mp-768737
8.498119
5.290944
-7.896286
other
Li6Mn4P4C4O28
46
4
543.92
mp-560059
10.105076
4.356668
-4.838146
other
K2V2H12S2O18
36
4
395.72
mp-1176358
8.221526
6.334176
-6.129008
other
Na6Ni4P4C4O28
46
4
606.04
mp-995194
12.142434
6.264319
-1.060391
other
K2Ba2Si2H2O8
16
4
254.53
mp-1219153
12.137833
4.927059
-5.170743
other
Rb2Tl2P4H8O16
32
4
438.65
mp-754175
10.002083
4.132626
-7.850354
other
K2Ge2P2C2O14
22
4
333.86
mp-772595
9.747222
4.216212
-7.547268
other
Na2Si2Sb2C2O14
22
4
325.04
mp-774458
14.05614
8.440555
-7.451971
other
Li8Mn2V6P16O56
88
4
1,077.42
mp-775930
12.273832
8.222018
-7.557032
other
Li2V2P4H2O16
26
4
282.19
mp-1201219
10.178416
4.296936
-4.387321
other
V2H20Se2N2O18
44
4
433.5
mp-772183
9.257011
3.90102
-7.404116
other
Na2V2C2S2O14
22
4
335.08
mp-770938
10.252201
4.352954
-7.517138
other
Li6V2P2C2O14
26
4
291
mp-995192
11.928914
6.488846
-1.040275
other
Rb2Ba2Si2H2O8
16
4
263.36
mp-1225269
11.410363
4.206243
-3.959248
other
Ge16H24C4N4O34
82
4
1,024.21
mp-995216
12.244733
6.137726
-1.397669
other
Rb2Sr2Si2H2O8
16
4
238.79
mp-705932
13.422955
5.535796
-6.00879
other
Sr20P12Cl2O48F2
84
4
1,249.41
mp-768656
9.352003
3.892961
-7.197943
other
Na2Sb2C2S2O14
22
4
357.97
mp-767535
9.809293
3.820749
-7.682492
other
Na2Hf2P2C2O14
22
4
343.86
mp-1228787
11.142636
7.157358
-6.711675
other
Ba2Fe4P8H8O34
56
4
649.68
mp-773138
8.603851
5.090796
-7.003014
other
Na2Cr2As2C2O14
22
4
321.84
mp-768198
9.567555
3.81571
-7.699882
other
Li2Ce2P2C2O14
22
4
333.81
mp-686708
10.254273
7.257297
-5.886734
other
Rb16Yb8Ti8P24O96
152
4
2,244.62
mp-777835
14.222591
8.485762
-7.436154
other
Li12Mn2V6P12O48
80
4
938.28
mp-1229176
8.291887
2.380917
-1.371228
other
As4S4Cl4O4F32
48
4
806.09
mp-1192807
10.180032
9.318504
-2.005544
other
Cu4Te4Pb2Cl4O12
26
4
449.54
mp-769579
8.577841
6.019347
-6.772746
other
K2Fe2P2C2O14
22
4
351.68
mp-771331
9.605693
3.630527
-7.89288
other
Ba2Na6P2C2O14
26
4
377.29
mp-1173790
12.937431
6.438547
-0.771357
other
Na8Mg2Al4Si18O48
80
4
836.61
mp-779485
11.054052
8.578943
-7.335312
other
Li2V4P8H4O32
50
4
548.9
mp-6858
8.080678
3.604264
-3.827008
other
Rb2C2S2O6F6
18
4
318.62
mp-771340
9.566381
3.664359
-8.770956
other
Li12Mn4P4C4O28
52
4
577.16
mp-766086
10.05029
10.885318
3.128473
other
Li4La8Ti8Cr4O36
60
4
712.16
mp-690929
13.901317
5.098331
-7.021692
other
Cs8Mg2Zr6P12O48
76
4
1,141.53
mp-1214127
12.787792
5.593677
-1.872476
other
Ca2Al4Si12H20O42
80
4
938.63
mp-772753
9.334214
3.587197
-8.279139
other
Li6Zn2P2C2O14
26
4
278.72
mp-1228528
13.778975
5.430338
-6.540084
other
Ba4Nb2P4O18F2
30
4
480.1
mp-1221476
13.051212
6.559522
-7.242934
other
Na4Al2Cr2P8O28
44
4
511.17
mp-22748
10.8922
11.170725
0.396414
other
Na2La2Mn2W2O12
20
4
261.09
mp-756494
9.770227
3.739204
-7.858423
other
Na6Ge2P2C2O14
26
4
348.14
mp-768599
8.297584
5.400822
-6.282639
other
Li2Cu2C2S2O14
22
4
285.25
mp-774224
10.444104
3.997099
-4.821148
other
In4H48S8N4O48
112
4
1,063.67
mp-1214418
12.525307
7.42496
-3.834326
other
Ca4Co2As4H4O16
30
4
397.61
mp-1222855
8.721313
7.902557
-4.767118
other
Li2Ga6P4O22F6
40
4
518.21
mp-780005
14.081171
8.44383
-7.423313
other
Li8Mn2V6P16O56
88
4
1,073.45
mp-1220150
6.524042
4.934035
-4.547934
other
Rb8Sb4N8O24F12
56
4
1,008.52
mp-757203
10.880946
4.530025
-5.476264
other
Na2P2H8S2O16
30
4
328.98
mp-757002
9.923099
3.924418
-7.682451
other
K2Zr2P2C2O14
22
4
395.57
mp-1199569
8.51135
7.745529
-4.48666
other
Zn4P6C2N6O24
42
4
706.19
mp-774611
8.577261
5.3455
-7.763583
other
Na6Mn4P4C4O28
46
4
613.79
mp-768103
9.005837
4.65643
-7.899139
other
Na4V4P4C4O28
44
4
625.77
mp-769599
8.72252
5.45979
-7.401615
other
Na2Cr2P2C2O14
22
4
301.44
mp-755603
14.093862
8.096441
-4.955037
other
K2P2W2C2O14
22
4
369.24
mp-774241
9.020283
4.703734
-7.54744
other
Na2V2As2C2O14
22
4
338.63
mp-1205426
12.080646
6.987867
-0.306197
other
K2Na6Al8Ge8O32
56
4
804.01
mp-755819
8.995203
4.71818
-8.451596
other
Li8Fe4P4C4O28
48
4
548.2
mp-652274
4.958507
3.227698
-4.240095
other
Ge8Ru4C16Cl24O16
68
4
1,662.11
mp-560592
9.879623
3.311324
-4.427823
other
V6H16C4N2O14
42
4
462.41
mp-733454
4.865333
3.03862
-3.673175
other
Pb2C4S4Br4N8
22
4
588.75
mp-773160
8.997113
4.278917
-7.338688
other
Li2Cr2C2S2O14
22
4
308.95
mp-995225
11.713738
6.692245
-0.904932
other
Cs2Ba2Si2H2O8
16
4
275.47
mp-726116
11.883215
7.258755
-7.33701
other
K8Nb2Fe6P12O48
76
4
1,018.34
mp-770650
8.369104
5.41531
-7.243449
other
Li2V2Si2C2O14
22
4
293.88
mp-778200
13.183045
8.360462
-8.010103
other
Li4Mn2V2P8O28
44
4
536.36
mp-754990
14.310891
7.955857
-6.855198
other
Li8V4P8H4O32
56
4
587.09
mp-768667
9.399425
3.863135
-8.631452
other
Li10Fe4P4C4O28
50
4
551.83
mp-772152
7.992525
6.275191
-5.874822
other
Na2Co2As2C2O14
22
4
306.9
mp-1177542
13.256685
8.405352
-8.100428
other
Li12Mn4V4P12O48
80
4
906.81
mp-1192716
4.514345
2.870669
-3.616252
other
Pb2C4S4Br4N8
22
4
615.96
mp-770829
9.167642
4.177536
-7.348695
other
Na2Cr2C2S2O14
22
4
308.55