data_dataset_pos
int64 0
1.96M
| mace_mp_energy
float64 -2,613.03
16k
| mace_omat_energy
float64 -2,613.03
16k
| orb_energy
float64 -2,562.33
1.93k
| uma_energy
float64 -2,615.15
1.19k
| immutable_id
stringlengths 4
13
| true_energy
float64 -2,617.15
5.19k
| nsites
int64 1
444
| species_at_sites
stringlengths 5
1.85k
| formation_energy
float64 -904.18
5.21k
| formation_energy_per_atom
float64 -5.46
651
|
|---|---|---|---|---|---|---|---|---|---|---|
1,963,185
| -59.14056
| -59.140556
| -59.14821
| -59.15473
|
agm004632294
| -59.693907
| 12
|
['Ce' 'Ce' 'Nd' 'Nd' 'Nd' 'Dy' 'Dy' 'Dy' 'Dy' 'Dy' 'Dy' 'Y']
| 0.584546
| 0.048712
|
1,963,186
| -84.640686
| -84.64069
| -84.09766
| -84.57354
|
agm004630446
| -84.679259
| 12
|
['Ce' 'Ce' 'Ce' 'Dy' 'Dy' 'Y' 'P' 'P' 'P' 'P' 'P' 'P']
| -18.728938
| -1.560745
|
1,963,187
| -27.647736
| -27.647736
| -26.134247
| -28.331217
|
agm001412850
| -28.765466
| 4
|
['Dy' 'Pm' 'Ce' 'Pu']
| 0.860441
| 0.21511
|
1,963,188
| -95.34247
| -95.34246
| -95.10892
| -95.41136
|
agm004725476
| -95.695067
| 16
|
['Ce' 'Pr' 'Pr' 'Pr' 'Pr' 'Dy' 'Dy' 'Dy' 'Se' 'Se' 'Se' 'Se' 'Se' 'Se'
'Se' 'Se']
| -28.89243
| -1.805777
|
1,963,189
| -78.64798
| -78.64798
| -78.47045
| -78.614655
|
agm004918861
| -78.777511
| 14
|
['Sr' 'Ce' 'Dy' 'Dy' 'Dy' 'Dy' 'Se' 'Se' 'Se' 'Se' 'Se' 'Se' 'Se' 'Se']
| -24.818374
| -1.772741
|
1,963,190
| -130.52759
| -130.52757
| -129.4398
| -130.7306
|
agm005141296
| -132.839278
| 20
|
['Ce' 'Ce' 'Er' 'Er' 'Er' 'Er' 'Ga' 'Ga' 'Ga' 'Ga' 'Rh' 'Rh' 'Rh' 'Rh'
'Rh' 'Rh' 'Rh' 'Rh' 'Rh' 'Rh']
| -17.062597
| -0.85313
|
1,963,191
| -57.15833
| -57.15833
| -57.091663
| -57.099808
|
agm004658956
| -57.809476
| 12
|
['Ce' 'Ce' 'Sm' 'Sm' 'Sm' 'Sm' 'Sm' 'Sm' 'Ho' 'Er' 'Er' 'Er']
| 0.652868
| 0.054406
|
1,963,192
| -25.112362
| -25.112362
| -25.079613
| -25.12558
|
agm005195553
| -25.356795
| 4
|
['Ce' 'Er' 'Tl' 'Os']
| -1.258346
| -0.314587
|
1,963,193
| -52.784363
| -52.784363
| -52.769043
| -52.83919
|
agm004645980
| -53.27854
| 12
|
['Ce' 'Er' 'Er' 'Tl' 'Tl' 'Tl' 'Te' 'Te' 'Te' 'Te' 'Te' 'Te']
| -12.250926
| -1.02091
|
1,963,194
| -24.705647
| -24.705648
| -24.650354
| -24.677372
|
agm001411964
| -24.747121
| 4
|
['Eu' 'Ce' 'Sm' 'Pm']
| 0.934985
| 0.233746
|
1,963,195
| -68.86998
| -68.86998
| -67.73682
| -68.81813
|
agm004911044
| -69.300858
| 12
|
['Li' 'Li' 'Ce' 'Mo' 'F' 'F' 'F' 'F' 'F' 'F' 'F' 'F']
| -33.368258
| -2.780688
|
1,963,196
| -22.644402
| -22.644402
| -22.491713
| -22.675665
|
agm001361279
| -22.80073
| 4
|
['Os' 'Ga' 'Ce' 'Li']
| -0.687154
| -0.171788
|
1,963,197
| -29.084011
| -29.084011
| -29.151154
| -29.184753
|
agm005180085
| -29.584764
| 4
|
['Ce' 'Pu' 'Ga' 'Pd']
| -1.089998
| -0.2725
|
1,963,198
| -32.965096
| -32.965096
| -32.946087
| -33.008537
|
agm001310713
| -33.490639
| 4
|
['Ru' 'Ga' 'Ce' 'Pu']
| -0.912865
| -0.228216
|
1,963,199
| -22.920662
| -22.920662
| -22.890911
| -22.891659
|
agm001364106
| -23.188159
| 4
|
['Tm' 'Rh' 'Ga' 'Ce']
| -2.390963
| -0.597741
|
1,963,200
| -19.653675
| -19.653677
| -19.633707
| -19.590885
|
agm001290656
| -19.775463
| 4
|
['Ge' 'Ce' 'Hg' 'Th']
| -1.489364
| -0.372341
|
1,963,201
| -71.9823
| -71.9823
| -71.622055
| -71.99535
|
agm004512168
| -72.37832
| 10
|
['Ce' 'Ce' 'Ge' 'Ge' 'Ge' 'Sb' 'Ir' 'Ir' 'Ir' 'Ir']
| -7.062374
| -0.706237
|
1,963,202
| -121.40964
| -121.40964
| -120.0962
| -121.37816
|
agm004774978
| -121.79993
| 16
|
['Ce' 'Ce' 'Sm' 'Sm' 'Sm' 'Sm' 'Ge' 'Ge' 'N' 'N' 'N' 'N' 'N' 'N' 'N' 'N']
| -15.060195
| -0.941262
|
1,963,203
| -162.01407
| -162.01407
| -160.71538
| -162.2781
|
agm005129711
| -163.716239
| 20
|
['Ce' 'Ce' 'Ce' 'Ce' 'Pa' 'Pa' 'Ge' 'Ge' 'Ge' 'Ge' 'Ru' 'Ru' 'Ru' 'Ru'
'Ru' 'Ru' 'Ru' 'Ru' 'Ru' 'Ru']
| -9.719423
| -0.485971
|
1,963,204
| -57.72776
| -57.72776
| -57.60234
| -57.826553
|
agm004546721
| -58.633287
| 7
|
['Ce' 'Pu' 'Pu' 'Ge' 'Ge' 'Pd' 'Pd']
| -4.399993
| -0.62857
|
1,963,205
| -34.545033
| -34.545033
| -34.522224
| -34.568443
|
agm001385081
| -34.757465
| 4
|
['Rh' 'Ir' 'Hf' 'Ce']
| -2.650699
| -0.662675
|
1,963,206
| -31.53329
| -31.53329
| -31.372107
| -31.257336
|
agm001408051
| -31.432449
| 4
|
['Pa' 'Hf' 'Ce' 'Th']
| 1.379225
| 0.344806
|
1,963,207
| -157.5579
| -157.55789
| -155.20836
| -157.64716
|
agm005164151
| -158.020817
| 18
|
['Ce' 'Ce' 'Ce' 'Ce' 'Ho' 'Ho' 'V' 'V' 'N' 'N' 'N' 'N' 'N' 'N' 'N' 'N' 'N'
'N']
| -23.448942
| -1.302719
|
1,963,208
| -49.001263
| -49.001263
| -48.862503
| -49.036816
|
agm004860828
| -49.113331
| 8
|
['K' 'Ce' 'Ce' 'Nd' 'S' 'S' 'S' 'S']
| -14.84782
| -1.855977
|
1,963,209
| -81.19675
| -81.19675
| -80.85079
| -81.18626
|
agm004643774
| -81.411723
| 12
|
['La' 'La' 'La' 'Ce' 'Ce' 'Pm' 'S' 'S' 'S' 'S' 'S' 'S']
| -25.23129
| -2.102607
|
1,963,210
| -21.037666
| -21.037666
| -20.926397
| -20.930212
|
agm001390395
| -21.148192
| 4
|
['Sc' 'La' 'Ce' 'Pm']
| 0.802297
| 0.200574
|
1,963,211
| -45.968796
| -45.968803
| -45.914303
| -45.963276
|
agm004987740
| -46.519035
| 10
|
['La' 'Ce' 'Pm' 'Pm' 'Pm' 'Pm' 'Pm' 'Pm' 'Sm' 'Sm']
| 2.289791
| 0.228979
|
1,963,212
| -45.27086
| -45.270863
| -45.191586
| -45.33
|
agm004778105
| -45.337251
| 8
|
['Li' 'Ce' 'Nd' 'Nd' 'Se' 'Se' 'Se' 'Se']
| -13.991849
| -1.748981
|
1,963,213
| -17.747213
| -17.747215
| -17.748476
| -17.732704
|
agm001335886
| -17.919393
| 4
|
['Nd' 'Sn' 'Ce' 'Li']
| -1.291666
| -0.322917
|
1,963,214
| -10.315048
| -10.315049
| -10.324577
| -10.314996
|
agm001918349
| -10.504614
| 4
|
['Sr' 'Zn' 'Ce' 'Li']
| 0.304536
| 0.076134
|
1,963,215
| -226.87181
| -226.87181
| -221.39954
| -226.34998
|
agm005229245
| -224.851635
| 25
|
['Ce' 'Mg' 'Zr' 'Zr' 'Zr' 'Zr' 'Zr' 'Zr' 'Zr' 'O' 'O' 'O' 'O' 'O' 'O' 'O'
'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O']
| -78.141085
| -3.125643
|
1,963,216
| -20.322805
| -20.322805
| -20.316315
| -20.281017
|
agm001399240
| -20.600738
| 4
|
['Mg' 'Rh' 'Ce' 'Sm']
| -0.987896
| -0.246974
|
1,963,217
| -37.112053
| -37.112053
| -36.78903
| -37.10185
|
agm001295228
| -37.280755
| 4
|
['Np' 'O' 'Ce' 'N']
| -5.0927
| -1.273175
|
1,963,218
| -57.269722
| -57.269722
| -56.98443
| -57.268112
|
agm004545336
| -57.388962
| 7
|
['Ce' 'Ce' 'Np' 'Te' 'Te' 'N' 'N']
| -9.59123
| -1.370176
|
1,963,219
| -246.56004
| -246.56004
| -241.93222
| -246.64714
|
agm005289648
| -246.108041
| 30
|
['Ce' 'Ce' 'Ce' 'Ce' 'Ce' 'Ce' 'Si' 'Si' 'Si' 'Si' 'Si' 'Si' 'N' 'N' 'N'
'N' 'N' 'N' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O']
| -68.375785
| -2.279193
|
1,963,220
| -64.05791
| -64.05791
| -62.94756
| -64.10004
|
agm005100822
| -63.937886
| 9
|
['Na' 'Ce' 'W' 'O' 'O' 'O' 'O' 'O' 'O']
| -13.948024
| -1.54978
|
1,963,221
| -54.801456
| -54.801456
| -54.222645
| -54.67117
|
agm004540372
| -54.651508
| 7
|
['Ce' 'Ce' 'Sc' 'S' 'S' 'O' 'O']
| -18.27046
| -2.610066
|
1,963,222
| -50.630234
| -50.630234
| -50.34949
| -50.503143
|
agm004844491
| -50.67422
| 8
|
['Sr' 'Sr' 'Ce' 'Pa' 'P' 'P' 'P' 'P']
| -10.232397
| -1.27905
|
1,963,223
| -76.704994
| -76.704994
| -76.63358
| -76.73977
|
agm004723182
| -77.244638
| 16
|
['Ce' 'Ce' 'Ce' 'Tl' 'Tl' 'Tl' 'Tl' 'Pb' 'Se' 'Se' 'Se' 'Se' 'Se' 'Se'
'Se' 'Se']
| -18.341473
| -1.146342
|
1,963,224
| -26.942623
| -26.942625
| -26.88907
| -26.936827
|
agm001302153
| -26.976578
| 4
|
['Sc' 'Pd' 'Ce' 'Pt']
| -3.455222
| -0.863806
|
1,963,225
| -72.22174
| -72.22174
| -72.298935
| -72.36294
|
agm005039211
| -72.425242
| 12
|
['Ce' 'Ce' 'Pm' 'Pm' 'Pr' 'Pr' 'Se' 'Se' 'Se' 'Se' 'Se' 'Se']
| -20.544981
| -1.712082
|
1,963,226
| -60.778103
| -60.778103
| -60.755745
| -60.832077
|
agm004636533
| -60.743483
| 12
|
['Rb' 'Rb' 'Rb' 'Ce' 'Ce' 'Pm' 'Se' 'Se' 'Se' 'Se' 'Se' 'Se']
| -20.130441
| -1.677537
|
1,963,227
| -109.31903
| -109.31903
| -108.8454
| -109.22011
|
agm004730583
| -109.50959
| 16
|
['Ce' 'Ce' 'Ce' 'Pm' 'Pm' 'Pm' 'Pm' 'Th' 'S' 'S' 'S' 'S' 'S' 'S' 'S' 'S']
| -32.250512
| -2.015657
|
1,963,228
| -135.45192
| -135.4519
| -135.17911
| -135.57486
|
agm005144310
| -137.275549
| 20
|
['Ce' 'Ce' 'Ce' 'Ce' 'Pr' 'Pr' 'Pr' 'Pr' 'Tm' 'Tm' 'Rh' 'Rh' 'Rh' 'Rh'
'Rh' 'Rh' 'Rh' 'Rh' 'Rh' 'Rh']
| -11.925555
| -0.596278
|
1,963,229
| -39.954514
| -39.95451
| -39.922203
| -39.97131
|
agm004824005
| -40.153697
| 8
|
['Ce' 'Pr' 'Tl' 'Tl' 'Se' 'Se' 'Se' 'Se']
| -10.742141
| -1.342768
|
1,963,230
| -66.13426
| -66.13426
| -65.82417
| -66.27132
|
agm004568833
| -66.745438
| 9
|
['Ce' 'Ce' 'Si' 'Pt' 'Pt' 'Rh' 'Rh' 'Rh' 'Rh']
| -7.923682
| -0.880409
|
1,963,231
| -58.047386
| -58.047382
| -58.00342
| -58.054718
|
agm004584267
| -57.994841
| 11
|
['Rb' 'Rb' 'Ce' 'Ce' 'Tm' 'Se' 'Se' 'Se' 'Se' 'Se' 'Se']
| -18.673202
| -1.697564
|
1,963,232
| -108.833275
| -108.83328
| -108.289055
| -108.80455
|
agm004728541
| -109.080995
| 16
|
['Tb' 'Tb' 'Tb' 'Ce' 'Ce' 'Ce' 'Ce' 'Sc' 'S' 'S' 'S' 'S' 'S' 'S' 'S' 'S']
| -32.082482
| -2.005155
|
1,963,233
| -109.43644
| -109.43645
| -108.87175
| -109.31093
|
agm004730473
| -109.31583
| 16
|
['Ce' 'Ce' 'Ce' 'Ce' 'Tm' 'Tm' 'Tm' 'Th' 'S' 'S' 'S' 'S' 'S' 'S' 'S' 'S']
| -31.694069
| -1.980879
|
1,963,234
| -37.602505
| -37.602505
| -37.784748
| -37.728836
|
agm005100310
| -37.96144
| 9
|
['Cs' 'Mn' 'Co' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl']
| -9.729483
| -1.081054
|
1,963,235
| -26.84076
| -26.84076
| -26.785166
| -26.902685
|
agm001564562
| -26.91361
| 5
|
['Co' 'Hf' 'Pd' 'Pd' 'Cl']
| 2.386731
| 0.477346
|
1,963,236
| -76.57473
| -76.57472
| -76.55908
| -76.5824
|
agm005091052
| -76.634243
| 18
|
['Na' 'Na' 'Ho' 'Ho' 'Co' 'Co' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl'
'Cl' 'Cl' 'Cl' 'Cl']
| -28.383567
| -1.576865
|
1,963,237
| -21.464226
| -21.464226
| -21.304235
| -21.407001
|
agm001756647
| -21.588663
| 5
|
['P' 'P' 'Cl' 'Co' 'In']
| 0.941204
| 0.188241
|
1,963,238
| -30.16584
| -30.165846
| -29.803299
| -29.768812
|
agm005099575
| -29.82095
| 9
|
['K' 'Rb' 'Co' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl']
| -9.485238
| -1.053915
|
1,963,239
| -20.215534
| -20.215534
| -20.278881
| -20.33527
|
agm001769572
| -20.408448
| 5
|
['Na' 'S' 'S' 'Co' 'Cl']
| -1.856023
| -0.371205
|
1,963,240
| -21.977318
| -21.977318
| -22.191002
| -22.16407
|
agm001756666
| -22.227263
| 5
|
['P' 'P' 'Co' 'Rb' 'Cl']
| -1.432722
| -0.286544
|
1,963,241
| -23.25949
| -23.259487
| -23.310696
| -23.293945
|
agm001756691
| -23.144411
| 5
|
['Y' 'P' 'P' 'Co' 'Cl']
| 3.100059
| 0.620012
|
1,963,242
| -50.69408
| -50.69408
| -50.823486
| -50.84366
|
agm004885943
| -50.825706
| 12
|
['Rb' 'Pm' 'Co' 'Co' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl']
| -16.041328
| -1.336777
|
1,963,243
| -21.470623
| -21.470621
| -21.431719
| -21.484715
|
agm005201811
| -21.68596
| 4
|
['Pm' 'Sm' 'Co' 'Cl']
| -3.257928
| -0.814482
|
1,963,244
| -24.393211
| -24.393211
| -24.164932
| -24.26472
|
agm001670021
| -24.324714
| 5
|
['Cr' 'Na' 'O' 'Cl' 'Cl']
| -4.673594
| -0.934719
|
1,963,245
| -59.428165
| -59.428165
| -59.47632
| -59.467503
|
agm004662919
| -59.942164
| 12
|
['Cs' 'Cs' 'Cs' 'Nb' 'Cl' 'Cl' 'F' 'F' 'F' 'F' 'F' 'F']
| -31.999189
| -2.666599
|
1,963,246
| -34.026157
| -34.026154
| -34.069416
| -34.073547
|
agm004931580
| -34.202122
| 10
|
['Cs' 'Cs' 'Li' 'Ga' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl']
| -16.448423
| -1.644842
|
1,963,247
| -40.488
| -40.488
| -40.64408
| -40.6061
|
agm004588199
| -40.847544
| 11
|
['Cs' 'Cs' 'Hf' 'Hg' 'Hg' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl']
| -17.472495
| -1.588409
|
1,963,248
| -23.257677
| -23.257679
| -23.263453
| -23.246916
|
agm005052500
| -23.576889
| 7
|
['Cs' 'In' 'Sn' 'Cl' 'Cl' 'Cl' 'Cl']
| -8.562867
| -1.223267
|
1,963,249
| -53.488304
| -53.488304
| -53.60235
| -53.619755
|
agm004735176
| -53.847742
| 16
|
['Cs' 'Cs' 'Cs' 'K' 'K' 'K' 'K' 'Rb' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl'
'Cl']
| -31.028308
| -1.939269
|
1,963,250
| -14.108095
| -14.108093
| -14.126294
| -14.154396
|
agm001629571
| -14.266587
| 5
|
['Cs' 'K' 'K' 'Te' 'Cl']
| -6.198614
| -1.239723
|
1,963,251
| -65.676636
| -65.676636
| -65.765465
| -65.82651
|
agm004884100
| -66.365429
| 12
|
['Cs' 'Pu' 'Mn' 'Mn' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl']
| -18.039896
| -1.503325
|
1,963,252
| -38.33715
| -38.33715
| -38.089867
| -38.14389
|
agm004472991
| -38.263606
| 10
|
['Cs' 'Cs' 'Os' 'Sn' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl']
| -10.217916
| -1.021792
|
1,963,253
| -46.88579
| -46.88579
| -46.961113
| -46.95724
|
agm004912644
| -47.317067
| 12
|
['Cs' 'Tb' 'Sn' 'Sn' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl']
| -19.016026
| -1.584669
|
1,963,254
| -16.057669
| -16.057669
| -15.856714
| -16.055212
|
agm001721906
| -16.403641
| 5
|
['I' 'N' 'N' 'Cu' 'Cl']
| 7.778938
| 1.555788
|
1,963,255
| -34.911236
| -34.911236
| -34.988556
| -35.021473
|
agm004746772
| -36.48398
| 12
|
['Rb' 'Rb' 'Cu' 'Cu' 'Cu' 'Cu' 'I' 'I' 'I' 'I' 'Cl' 'Cl']
| -8.162294
| -0.680191
|
1,963,256
| -43.764366
| -43.764362
| -43.824963
| -43.791798
|
agm004898011
| -44.510672
| 12
|
['Rb' 'La' 'Cu' 'Cu' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl']
| -15.570367
| -1.297531
|
1,963,257
| -55.934555
| -55.93455
| -55.715637
| -55.74476
|
agm005176521
| -57.004353
| 18
|
['Rb' 'Rb' 'Tl' 'Tl' 'Tl' 'Tl' 'Cu' 'Cu' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl'
'Cl' 'Cl' 'Cl' 'Cl']
| -18.811099
| -1.045061
|
1,963,258
| -94.35632
| -94.35633
| -93.66776
| -94.4433
|
agm004662130
| -94.611902
| 12
|
['Dy' 'Dy' 'Dy' 'U' 'Cl' 'Cl' 'O' 'O' 'O' 'O' 'O' 'O']
| -36.049593
| -3.004133
|
1,963,259
| -38.9563
| -38.9563
| -38.95309
| -38.971107
|
agm004962734
| -39.163116
| 10
|
['Na' 'Na' 'Er' 'Tl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl']
| -18.454832
| -1.845483
|
1,963,260
| -30.36785
| -30.367853
| -30.267437
| -30.284075
|
agm001601289
| -30.153432
| 5
|
['Nb' 'Nb' 'F' 'Os' 'Cl']
| 5.230294
| 1.046059
|
1,963,261
| -16.016092
| -16.01609
| -15.993266
| -15.957209
|
agm001687919
| -16.162665
| 5
|
['Pb' 'P' 'F' 'Cl' 'Cl']
| -1.429648
| -0.28593
|
1,963,262
| -19.733215
| -19.733215
| -19.7467
| -19.833641
|
agm001691858
| -20.007667
| 5
|
['S' 'Ga' 'Zr' 'Cl' 'Cl']
| -0.599324
| -0.119865
|
1,963,263
| -23.23463
| -23.23463
| -23.19731
| -23.23004
|
agm001691889
| -23.356648
| 5
|
['S' 'Nb' 'Ge' 'Cl' 'Cl']
| -0.710969
| -0.142194
|
1,963,264
| -21.580223
| -21.580225
| -21.460915
| -21.535448
|
agm001691891
| -21.559677
| 5
|
['Ge' 'Os' 'S' 'Cl' 'Cl']
| 2.121109
| 0.424222
|
1,963,265
| -68.58766
| -68.58766
| -68.35424
| -68.58045
|
agm004595188
| -69.297629
| 12
|
['Pm' 'Pm' 'Pm' 'Pm' 'Pm' 'Pm' 'Ge' 'Ge' 'Ge' 'S' 'S' 'Cl']
| -16.819264
| -1.401605
|
1,963,266
| -21.411285
| -21.41129
| -21.183146
| -21.184958
|
agm001768850
| -21.198135
| 5
|
['Y' 'H' 'S' 'S' 'Cl']
| -1.229983
| -0.245997
|
1,963,267
| -15.144895
| -15.144895
| -15.027928
| -15.057208
|
agm001458247
| -15.228874
| 5
|
['H' 'Si' 'Sn' 'Cl' 'Cl']
| 1.300364
| 0.260073
|
1,963,268
| -25.714512
| -25.714512
| -25.732265
| -25.757553
|
agm005010618
| -25.857811
| 5
|
['La' 'La' 'Pt' 'I' 'Cl']
| -6.542202
| -1.30844
|
1,963,269
| -14.507824
| -14.507824
| -14.492925
| -14.485033
|
agm001667101
| -14.901126
| 5
|
['I' 'I' 'Ni' 'Tl' 'Cl']
| -1.803156
| -0.360631
|
1,963,270
| -17.678368
| -17.678368
| -17.646744
| -17.743715
|
agm001520591
| -17.841513
| 5
|
['I' 'Y' 'Y' 'Rb' 'Cl']
| -0.491814
| -0.098363
|
1,963,271
| -19.366697
| -19.366697
| -19.371843
| -19.365536
|
agm001522788
| -19.599008
| 5
|
['I' 'Sr' 'Cl' 'Cl' 'V']
| -3.546596
| -0.709319
|
1,963,272
| -24.199465
| -24.199467
| -24.075802
| -24.15846
|
agm001770666
| -24.173167
| 5
|
['S' 'S' 'Ir' 'Tc' 'Cl']
| 5.159694
| 1.031939
|
1,963,273
| -14.856399
| -14.856398
| -14.549215
| -14.68907
|
agm001771013
| -14.92439
| 5
|
['Zn' 'Ir' 'S' 'S' 'Cl']
| 5.31644
| 1.063288
|
1,963,274
| -40.687103
| -40.687103
| -40.72642
| -40.731205
|
agm002143308
| -40.921075
| 10
|
['Sc' 'K' 'Rb' 'Rb' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl']
| -20.34393
| -2.034393
|
1,963,275
| -16.478222
| -16.478222
| -16.468231
| -16.479202
|
agm005199904
| -16.579279
| 4
|
['K' 'Sr' 'S' 'Cl']
| -7.807499
| -1.951875
|
1,963,276
| -24.044746
| -24.044746
| -24.070251
| -24.04943
|
agm001690102
| -24.232787
| 5
|
['P' 'Cl' 'Cl' 'Tc' 'La']
| 0.172211
| 0.034442
|
1,963,277
| -70.79582
| -70.79582
| -70.75259
| -70.80339
|
agm004598332
| -71.220197
| 12
|
['La' 'La' 'La' 'La' 'La' 'La' 'Pt' 'Pt' 'Rh' 'Cl' 'Cl' 'Cl']
| -16.629862
| -1.385822
|
1,963,278
| -71.281815
| -71.28182
| -71.310265
| -71.36699
|
agm004598331
| -71.930989
| 12
|
['La' 'La' 'La' 'La' 'La' 'La' 'Pt' 'Rh' 'Rh' 'Cl' 'Cl' 'Cl']
| -16.046767
| -1.337231
|
1,963,279
| -72.06052
| -72.06052
| -72.05225
| -72.0108
|
agm004599256
| -72.537711
| 12
|
['La' 'La' 'La' 'La' 'La' 'La' 'Ru' 'Ru' 'Se' 'Cl' 'Cl' 'Cl']
| -15.372753
| -1.281063
|
1,963,280
| -50.734272
| -50.734272
| -50.81335
| -50.830254
|
agm004701452
| -51.00041
| 15
|
['Rb' 'Rb' 'Rb' 'Na' 'Na' 'Na' 'Mg' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl'
'Cl']
| -27.530346
| -1.835356
|
1,963,281
| -19.155163
| -19.155163
| -18.983654
| -19.095963
|
agm001541650
| -19.399894
| 5
|
['Mg' 'Rh' 'O' 'Cl' 'Cl']
| -1.785677
| -0.357135
|
1,963,282
| -75.03575
| -75.03576
| -74.94593
| -74.92056
|
agm004939718
| -75.791216
| 20
|
['Rb' 'Rb' 'Mn' 'Mn' 'Tl' 'Tl' 'Tl' 'Tl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl'
'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl']
| -23.75254
| -1.187627
|
1,963,283
| -30.239098
| -30.239098
| -30.182367
| -30.205854
|
agm001770950
| -30.095955
| 5
|
['Y' 'Mo' 'S' 'S' 'Cl']
| -2.673201
| -0.53464
|
1,963,284
| -16.959057
| -16.959057
| -16.748205
| -16.864338
|
agm001754178
| -16.850762
| 5
|
['P' 'N' 'O' 'O' 'Cl']
| 8.668319
| 1.733664
|
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