Model name: model_name=EAM_Dynamo_FoilesBaskesDaw_1986Universal3_Pd__MO_786012902615_001
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Pd
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.889999970793724
cohesive_energy=3.9103075409767074
mass=106.42
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[9.879694039430279e-20, 1.6581727073583e-19, 2.22705756479268e-19, 2.72382845193072e-19, 3.16391432975784e-19, 3.5569923451433995e-19, 3.9097275528848397e-19, 4.22705465701488e-19, 4.512770816156099e-19, 4.76987210061408e-19, 5.00082586240518e-19, 5.20765084408824e-19, 5.39214148349334e-19, 5.55573973959108e-19, 5.69971133192232e-19, 5.82520982766354e-19, 5.9332285763278195e-19, 6.0246487750638595e-19, 6.10027151218866e-19, 6.16083378895386e-19, 6.20696045424672e-19, 6.239260335188159e-19, 6.25827817183374e-19, 6.264510638939999e-19, 6.25774945354452e-19, 6.23571952482702e-19, 6.19548886954728e-19, 6.13350065557782e-19, 6.04546104953952e-19, 5.92619502090456e-19, 5.76940601550132e-19, 5.567387563720259e-19, 5.310670801654439e-19, 4.98751177457664e-19, 4.58329863158478e-19, 4.0796704284532203e-19, 3.4534116257553e-19, 2.6748659339956796e-19, 1.7057253098554197e-19, 4.9621813619930997e-20, -1.019610790287894e-19, -2.92977223646508e-19, -5.353977636071459e-19, -8.45742581966214e-19, -1.2472544551531498e-18, -1.7735454467726396e-18, -2.47427341941888e-18, -3.4248448163710798e-18, -4.745070406319759e-18, -6.63031960801488e-18, -9.42002956313568e-18, -1.380175835239692e-17, -2.1284756365026598e-17, -3.57335056857654e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

========================================
theta = 0.0
========================================

Energy: 0.014736008536504636
Energy: 0.0934640627122385
Energy: 0.0958856430322759
Energy: 0.095310368760479
Energy: 0.01863990116902267
Energy: 0.0159198517146239
Energy: 0.09310403761613334
Energy: 0.09653598036388528
Energy: 0.09460853623063518
Energy: 0.0179436777561241
Energy: 0.09332166150476057
Energy: 0.09432684143422078
Energy: 0.09329303815129888
Energy: 0.09580929857038593
Energy: 0.09575547590097978
Energy: 0.09344559568899023
Energy: 0.0983739872737677
Energy: 0.09315954110421668
Energy: 0.09606461665809092
Energy: 0.09535004524359793
Energy: 0.09628514793411107
Energy: 0.01804728345527419
Energy: 0.015183794050199845
Energy: 0.09379098063495793
Energy: 0.09489670416987445
Energy: 0.0955589485884843
Energy: 0.017221577516683954
Energy: 0.015162186374137975
Energy: 0.0934666159183457
Energy: 0.09584577270803463
Energy: 0.09504064901637399
Energy: 0.016457491074217588
Energy: 0.01619865453900734
Energy: 0.09750033940060787
Energy: 0.09358802277337191
Energy: 0.09571330941795778
Energy: 0.016585458345881987
Energy: 0.015458314755719512
Energy: 0.09525338684724792
Energy: 0.09327963406187129
Energy: 0.09447193125933434
Energy: 0.09444250808817369
Energy: 0.09694560067173484
Energy: 0.016606954570722685
Energy: 0.016192753438762173
Energy: 0.094029685553391
Energy: 0.09506990407986851
Energy: 0.09624829493865308
Energy: 0.017243072161814275
Energy: 0.09530797285733988
Energy: 0.09733632236268817
Energy: 0.0936466781058724
Energy: 0.09447566324703176
Energy: 0.01580464039630567
Energy: 0.01886242863960857
Energy: 0.09684507018818211
Energy: 0.09309892396413062
Energy: 0.09515783320782567
Energy: 0.016222409644539405
Energy: 0.015265496527518393
Energy: 0.019681586585916486
Energy: 0.09751851986100642
Energy: 0.0947492973564098
Energy: 0.09404935591371921
Energy: 0.09747260016390942
Energy: 0.01921904001126899
Energy: 0.09738195017882216
Energy: 0.0942274787565637
Energy: 0.09453749922441959
Energy: 0.09682989582257592

minimum gb energy = 0.014736008536504636 eV
minimum distance =  2.7108947340534 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

Energy: 0.758675157098244
Energy: 0.7060455844172477
Energy: 0.7750905204175957
Energy: 0.7078594921662261
Energy: 0.7065512033743968
Energy: 0.7691221613354607
Energy: 0.7067275087567295
Energy: 0.7081856955907432
Energy: 0.7074676569436734
Energy: 0.7503012863821932
Energy: 0.790731604091546
Energy: 0.8152054082127068
Energy: 0.7084011872386892
Energy: 0.7089428059765854
Energy: 0.6353211983587034
Energy: 0.6359394413057948
Energy: 0.7735028304375353
Energy: 0.7754207473220418
Energy: 0.6350122916702486
Energy: 0.7473562268699009
Energy: 0.7867599504976438
Energy: 0.805372796848814
Energy: 0.666888388556938
Energy: 0.6334674598908767
Energy: 0.6355036772201443
Energy: 0.6329728934912082
Energy: 0.8036167684955695
Energy: 0.6665933865707021
Energy: 0.742238391390812
Energy: 0.6349510184865846
Energy: 0.7423882872635443
Energy: 0.803356183194274
Energy: 0.749091560813754
Energy: 0.6324595944852981
Energy: 0.6352154741273796
Energy: 0.6325995908155156
Energy: 0.7120154565851752
Energy: 0.7490301843254
Energy: 0.7409356789254817
Energy: 0.6350030027090293
Energy: 0.7078410295684459
Energy: 0.7532174713140655
Energy: 0.8580109569003294
Energy: 0.8060734875472214
Energy: 0.7246774397751681
Energy: 0.7732831997636702
Energy: 0.7518187748694081
Energy: 0.8576563712728257
Energy: 0.8061237468134019
Energy: 0.7715037894009015
Energy: 0.8113923467200003
Energy: 0.751472516461317
Energy: 0.8459538285149075
Energy: 0.718876630654348
Energy: 0.8514707111782785
Energy: 0.8518200653173549
Energy: 0.7500585042827383
Energy: 0.8457860542431165
Energy: 0.7177397162998352
Energy: 0.8445555677643345
Energy: 0.812674164686869
Energy: 0.7074087023848943
Energy: 0.7994637245885361
Energy: 0.7202149771371852
Energy: 0.7984876438201587
Energy: 0.806677744803944
Energy: 0.7093996366487644
Energy: 0.7735250529317436
Energy: 0.7196329989850205
Energy: 0.8013132624531657
Energy: 0.8133939440231641
Energy: 0.8010869299027725
Energy: 0.7103010174577431
Energy: 0.7056882559829752
Energy: 0.7994991488063383
Energy: 0.8077646114367273
Energy: 0.7096318182589847
Energy: 0.8065072322398082
Energy: 0.7066181073256801
Energy: 0.7978803291033948
Energy: 0.894637721396168
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Energy: 0.7211129696320404
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Energy: 0.8873505817696562
Energy: 0.7295184198221029
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Energy: 0.8088387383215546
Energy: 0.8127025298054418
Energy: 0.7222702435843537
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Energy: 0.696152771949713
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Energy: 0.6329742241943639
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Energy: 0.8062475484936905
Energy: 0.8107501580595102
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Energy: 0.8071077410554279
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Energy: 0.7272317410751642
Energy: 0.7525525447337926
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Energy: 0.7984869935480265
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Energy: 0.7086002377454581
Energy: 0.7084876301034356
Energy: 0.6356055133384294
Energy: 0.6365435879093447
Energy: 0.7767589120898514
Energy: 0.7079380939497271
Energy: 0.8583174644657257
Energy: 0.7535262198068746
Energy: 0.7053059943529025
Energy: 0.7752105404909241
Energy: 0.7074183663620354
Energy: 0.7061011071409864
Energy: 0.7071345107785788
Energy: 0.7059826616158095
Energy: 0.7083273966525236
Energy: 0.7068860470055777
Energy: 0.7506444765448069
Energy: 0.6952682704609057
Energy: 0.8749430355363819
Energy: 0.7082004576785166
Energy: 0.7080722103582573
Energy: 0.6352027901534831
Energy: 0.6354582598148448
Energy: 0.7734624430395541
Energy: 0.7752352708051816
Energy: 0.7076086559633056
Energy: 0.6359798041112601
Energy: 0.7891469509686543
Energy: 0.7271985197725234
Energy: 0.6672106699977556
Energy: 0.6377591843943077
Energy: 0.6359658671201163
Energy: 0.6328810000768641
Energy: 0.6689447163326625
Energy: 0.6682919498111549
Energy: 0.7449302955237204
Energy: 0.6353409580878681
Energy: 0.7422607524414014
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Energy: 0.6696364406788368
Energy: 0.6324808314433903
Energy: 0.7007591163621835
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Energy: 0.6677563414516725
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Energy: 0.7039732113775554
Energy: 0.7082689233394832
Energy: 0.7766258868044411
Energy: 0.8593803016557483
Energy: 0.8054557788749352
Energy: 0.7255819252343426
Energy: 0.8341042278352936
Energy: 0.7750324861103332
Energy: 0.773071825700034
Energy: 0.7187959775112102
Energy: 0.7242367577445903
Energy: 0.8104576690485032
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Energy: 0.8471664008912136
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Energy: 0.8116201945787889
Energy: 0.801770995895929
Energy: 0.846981019401256
Energy: 0.7821674374440019
Energy: 0.8434480004058917
Energy: 0.8125774463491703
Energy: 0.8195220932099171
Energy: 0.8034872631359268
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Energy: 0.8099295878433139
Energy: 0.7092097927760658
Energy: 0.7362055407749267
Energy: 0.7187921916456836
Energy: 0.7092418915370886
Energy: 0.8150477215400231
Energy: 0.8093836360888117
Energy: 0.7081171007216481
Energy: 0.6532202585938012
Energy: 0.7986578980778422
Energy: 0.8067786929595823
Energy: 0.8049683825124928
Energy: 0.6974912708304812
Energy: 0.7069935460324636
Energy: 0.7971387983210213
Energy: 0.8918370181368303
Energy: 0.7223354314384829
Energy: 0.7208787783437273
Energy: 0.7180556403763421
Energy: 0.8092096660512282
Energy: 0.8899205845120288
Energy: 0.7222597950556126
Energy: 0.7211484999053628
Energy: 0.6362618347387285
Energy: 0.8072585414052401
Energy: 0.6988740352409885
Energy: 0.7226440228706043
Energy: 0.71965403195063
Energy: 0.7363971122453049
Energy: 0.6621899983092312
Energy: 0.6957178720081602
Energy: 0.7231494780362657
Energy: 0.719340579755135
Energy: 0.633028381558144
Energy: 0.6620250344708898
Energy: 0.6928551544623657
Energy: 0.7714972710256224
Energy: 0.7642376556782521
Energy: 0.6982938154576293
Energy: 0.6623756075240457
Energy: 0.6338397457806366
Energy: 0.7199255162695121
Energy: 0.7688875751710186
Energy: 0.7709644960225819
Energy: 0.6620088984344716
Energy: 0.9039287375060756
Energy: 0.7188950288875484
Energy: 0.7230975669929778
Energy: 0.7972920315453526
Energy: 0.7704480164612297
Energy: 0.6366180973596542
Energy: 0.6354298420071814
Energy: 0.7219544014941861
Energy: 0.8918193328268412
Energy: 0.7743803978629062
Energy: 0.8753984137637366
Energy: 0.7863678362726966
Energy: 0.772552907002324
Energy: 0.8090668423633781
Energy: 0.8113377423528085
Energy: 0.7253839968532144
Energy: 0.634095192307237
Energy: 0.7274253766775425
Energy: 0.8020795184442095
Energy: 0.8101109775636137
Energy: 0.6911463696071459
Energy: 0.7495205555693248
Energy: 0.7766984597060554
Energy: 0.7091284748055466
Energy: 0.7089083682161421
Energy: 0.6355065236907599
Energy: 0.6360815955267466
Energy: 0.778051092145966
Energy: 0.7090931779779052
Energy: 0.807163904521466
Energy: 0.7530850776035035
Energy: 0.7061335067131203
Energy: 0.7757643026951501
Energy: 0.7076763275023094
Energy: 0.7063249924196184
Energy: 0.7087339719149549
Energy: 0.7066985995484727
Energy: 0.7083556526669682
Energy: 0.7067425651841185
Energy: 0.8134641246764608

minimum gb energy = 0.6324595944852981 eV
minimum distance =  2.4419068481841 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

Energy: 1.6374844669539548
Energy: 0.8535291520050315
Energy: 0.7530142398371784
Energy: 0.8526165017111464
Energy: 0.8344408887108731
Energy: 0.8375745199619582
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Energy: 0.7638300009476441
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Energy: 0.8580893426265574
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Energy: 0.8097816046807725
Energy: 0.7705839810973668
Energy: 0.7651306681848467
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Energy: 0.7745015174414378
Energy: 0.7993954902701825
Energy: 0.8341538341269008
Energy: 0.9181862416832821
Energy: 0.8149830496665174
Energy: 0.7896402069498775
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Energy: 0.7886054362086525
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Energy: 0.8480755819422239
Energy: 0.8156214246649853
Energy: 0.8466216317454341
Energy: 0.8456050574472701
Energy: 0.8217159720143197
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Energy: 0.7949624605682869
Energy: 0.8173047817659589
Energy: 0.8080407115184509
Energy: 0.7777611188191987
Energy: 0.8147833350547891
Energy: 0.8275333639635308
Energy: 0.8368417800850478
Energy: 0.7766293167122382
Energy: 0.9090254794664825
Energy: 0.9195727515164448
Energy: 0.7512663207784381
Energy: 0.8020024322943633
Energy: 0.7604313589790253
Energy: 0.8680041007861017
Energy: 0.878281190396666
Energy: 0.9090829861577007
Energy: 0.8753268448598498
Energy: 0.8745906996763653
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Energy: 0.9023319659796482
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Energy: 0.9162608998768733
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Energy: 0.8253195675633087
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Energy: 0.8083464870757029
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Energy: 0.8093414662042411
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Energy: 0.8071138569963366
Energy: 0.9093564313994289
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Energy: 0.8557836900677268
Energy: 0.7597707331262787
Energy: 0.8977258136823406
Energy: 0.8984126272719385
Energy: 0.8700981939450402
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Energy: 0.7684018881422805
Energy: 0.8834829877927967
Energy: 0.8305300912490364
Energy: 0.7786823533024901
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Energy: 0.8391645631886625
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Energy: 0.8026490440981257
Energy: 0.7941744366907378
Energy: 0.7570018231282025
Energy: 0.8541411552733429
Energy: 0.7960057659410851
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Energy: 0.8010285907319195
Energy: 0.7765279750015244
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Energy: 0.811370898592122
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Energy: 0.818307552043631
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Energy: 0.7835301122659648
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minimum gb energy = 0.743046655537476 eV
minimum distance =  2.45785003787134 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 0.8094540972414336
Energy: 0.8086915046594736
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Energy: 0.8734827778560541
Energy: 0.7974820419466829
Energy: 0.7739359433860474
Energy: 0.8531505324260309
Energy: 0.8170828631110141
Energy: 0.8568645704305803
Energy: 0.8223314414127416
Energy: 0.7741304825719701
Energy: 0.8789043038873826
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Energy: 0.8056728860970629
Energy: 0.8850877656787851
Energy: 0.8838448645155106
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Energy: 0.8347826750969989
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Energy: 0.7865168643926955
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Energy: 0.858427018777732
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Energy: 0.8333609336823944
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Energy: 0.799754652954534
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Energy: 0.7831731277610005
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Energy: 0.8333766299938798
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Energy: 0.8759398304174298
Energy: 0.8710905980979565
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Energy: 0.8630189974938883
Energy: 0.8754317868625273
Energy: 0.882388401855225
Energy: 0.859559639029295
Energy: 0.8105308220543695
Energy: 0.7898557564311597
Energy: 0.8305421458481429
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Energy: 0.810329930456625
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Energy: 0.7936823855862336
Energy: 0.808267580340785
Energy: 0.8165498421687604
Energy: 0.8155033760657976
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Energy: 0.8109497788789526
Energy: 0.8109292891199921
Energy: 0.8332138018358347
Energy: 0.8370269565217133
Energy: 0.8432137469386108
Energy: 0.8202205065118499
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Energy: 0.8304560923409459
Energy: 0.8219756485412151
Energy: 0.8755973582434701
Energy: 0.8221031810759714
Energy: 0.8290553516448209
Energy: 0.8323460593433684
Energy: 0.8253589901980288
Energy: 0.8114215877447524
Energy: 0.8327926071584827
Energy: 0.8869000162287196
Energy: 0.7970388747191508
Energy: 0.8812831114558911
Energy: 0.7819568305432201
Energy: 0.831456964543165
Energy: 0.8846520069664264
Energy: 0.8088441552138012
Energy: 0.8688525933641279
Energy: 0.8152631607327158
Energy: 0.8277412005925955
Energy: 0.8225436523848627
Energy: 0.7939009733550844
Energy: 0.8211961209340349
Energy: 0.7845780610832448
Energy: 0.8276829824778293
Energy: 0.822259420780799
Energy: 0.7933050647245551
Energy: 0.8511618955807696
Energy: 0.854283382010889
Energy: 0.8214769812832851
Energy: 0.8235226083011872
Energy: 0.7893004121963436
Energy: 0.8489706881636899
Energy: 0.8488239910236425
Energy: 0.822934298966599
Energy: 0.8240673916996774
Energy: 0.8137337347633566
Energy: 0.8496876963657132
Energy: 0.8487301379043003
Energy: 0.8330044192801507
Energy: 0.8026409159943964
Energy: 0.8229573165045805
Energy: 0.8298321697017904
Energy: 0.8110856098827146
Energy: 0.8279277640890291
Energy: 0.7848105870586665
Energy: 0.8225612812662962
Energy: 0.8798571302056639
Energy: 0.8197771231847256
Energy: 0.8337935064763858
Energy: 0.8330159977246854
Energy: 0.8104594339080061
Energy: 0.8331535159302295
Energy: 0.8121739679302812
Energy: 0.8270588916808136
Energy: 0.8262080254342417
Energy: 0.8225959592573034
Energy: 0.7771039015283283
Energy: 0.8590877378745773
Energy: 0.8037242812879484
Energy: 0.8325493110807248
Energy: 0.8117923519783894
Energy: 0.7700692994690842
Energy: 0.8107120024095809
Energy: 0.776385873024811
Energy: 0.8273424339210425
Energy: 0.8281737046044843
Energy: 0.8330151295252166
Energy: 0.8156120734946629
Energy: 0.7930985587989059
Energy: 0.8354502265544126
Energy: 0.8296868760701981
Energy: 0.7940176345061164
Energy: 0.8212027153232458
Energy: 0.7866943952710816
Energy: 0.8048042024021752
Energy: 0.8472439798310508
Energy: 0.796156053728082
Energy: 0.8454963935132129
Energy: 0.8510590107488336
Energy: 0.8313164331513616
Energy: 0.8516690023882604
Energy: 0.8309921800489065
Energy: 0.8744566428445629
Energy: 0.8482562730012377
Energy: 0.8442966532227032
Energy: 0.8491727293421023
Energy: 0.8482350628401254
Energy: 0.8333525093226346
Energy: 0.7974713852950817
Energy: 0.7864342228527372
Energy: 0.7607493639425801
Energy: 0.8320784535059712
Energy: 0.7852332446796677
Energy: 0.7881779538297787
Energy: 0.7606588180728941
Energy: 0.7601507492194585
Energy: 0.848049031385332
Energy: 0.8545053603642228
Energy: 0.759201933967466
Energy: 0.7594773288102997
Energy: 0.7595812562097808
Energy: 0.7533372478285599
Energy: 0.7501592470853905
Energy: 0.7591593281786926
Energy: 0.759540632432279
Energy: 0.759478901002779
Energy: 0.8366741922451659

minimum gb energy = 0.7501592470853905 eV
minimum distance =  2.42644210311369 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 1.066670372291641
Energy: 0.7666366523745877
Energy: 0.7666152727347678
Energy: 0.7936600813422588
Energy: 0.7592770475453999
Energy: 0.8176356025309651
Energy: 0.7666059852069127
Energy: 0.7658066339253619
Energy: 0.7968548263980731
Energy: 0.7589008286070625
Energy: 0.7899257324380813
Energy: 0.7912085892368078
Energy: 0.7652497822813473
Energy: 0.7932956079286765
Energy: 0.8220509903898722
Energy: 0.7899305095361489
Energy: 0.7907872515437686
Energy: 0.7904047512321333
Energy: 0.7938996478526446
Energy: 0.8222728268049259
Energy: 0.7958334534661297
Energy: 0.830022536060529
Energy: 0.7918554841455233
Energy: 0.7720706918354487
Energy: 0.8112219992671996
Energy: 0.795432266490425
Energy: 0.7976394963019253
Energy: 0.7944125005040227
Energy: 0.7728703983916427
Energy: 0.8120515806449629
Energy: 0.8459466442766564
Energy: 0.7912835251654193
Energy: 0.7960956629846435
Energy: 0.7719632959200434
Energy: 0.759581426248897
Energy: 0.8202785473192254
Energy: 0.7908749905338897
Energy: 0.795533256614849
Energy: 0.7716166051473246
Energy: 0.8135281633980883
Energy: 0.7913920909890245
Energy: 0.7648016158219095
Energy: 0.7918968382258488
Energy: 0.7895876146578156
Energy: 0.7912721594826666
Energy: 0.79495128635246
Energy: 0.7647355353507422
Energy: 0.7914257149622247
Energy: 0.7907156992561327
Energy: 0.7983897483425424
Energy: 0.7982567999613802
Energy: 0.7956874940795535
Energy: 0.7656764425354712
Energy: 0.76061273621041
Energy: 0.7662045999173854
Energy: 0.7980884584837934
Energy: 0.7976160614119628
Energy: 0.766733575661397
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Energy: 0.7663229872303006
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Energy: 0.7901767377134981
Energy: 0.7897370225507878
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Energy: 0.7973946340395299
Energy: 0.8245231741604339
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Energy: 0.7901711085873551
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Energy: 0.8159922841806618
Energy: 0.7659254872017192
Energy: 0.7914675182784789
Energy: 0.790740594628869
Energy: 0.7900808726358027
Energy: 0.7571009726736178
Energy: 0.7657198250934283
Energy: 0.7903987599160783
Energy: 0.7905625580545237
Energy: 0.7600027585972052
Energy: 0.7570297155620846
Energy: 0.7902784770738863
Energy: 0.765207676970752
Energy: 0.7917501543938334
Energy: 0.8246571800510063
Energy: 0.7576940098660191
Energy: 0.7666265307814611
Energy: 0.765118491260626
Energy: 0.7897456346458062
Energy: 0.7952444647576314
Energy: 0.8213258499293518
Energy: 0.7954647107572861
Energy: 0.794598086242808
Energy: 0.7943198256002916
Energy: 0.7895314650385561
Energy: 0.8213296999877707
Energy: 0.7912104574764002
Energy: 0.7916345166397739
Energy: 0.7946835023298828
Energy: 0.7901065230645902
Energy: 0.8205896938559157
Energy: 0.7730816248101434
Energy: 0.7949609870365264
Energy: 0.7972795665480746
Energy: 0.8115963566097165
Energy: 0.7981013888218218
Energy: 0.7722546793120811
Energy: 0.7653477972174568
Energy: 0.7974121991197244
Energy: 0.8118791345349051
Energy: 0.7970745003747267
Energy: 0.7979955635577427
Energy: 0.7954726049216393
Energy: 0.7957907210562685
Energy: 0.7575109619321899
Energy: 0.765572113804228
Energy: 0.7896748033427047
Energy: 0.7948632796740016
Energy: 0.796527312269167
Energy: 0.801490878996529
Energy: 0.798058593490413
Energy: 0.8011944717911037
Energy: 0.7657636399840211
Energy: 0.7902888662525146
Energy: 0.7686113534018074
Energy: 0.79989068536271
Energy: 0.7963742986353795
Energy: 0.7658888848274453
Energy: 0.7912312489491244
Energy: 0.7702199903853909
Energy: 0.8253310446880253
Energy: 0.7905489597546087
Energy: 0.7904249864322065
Energy: 0.7619519826400288
Energy: 0.7914480193219373
Energy: 0.8278220208728145
Energy: 0.790327221473217
Energy: 0.7661391189959124
Energy: 0.7606862832532513
Energy: 0.7901505778270486
Energy: 0.7600468163915998
Energy: 0.8058530960014705
Energy: 0.7935945231478755
Energy: 0.7665565381651752
Energy: 0.7918926650003888
Energy: 0.7593557429367523
Energy: 0.8023107600198521
Energy: 0.7922528721720277
Energy: 0.7663647507658247
Energy: 0.7911569918508718

minimum gb energy = 0.7570297155620846 eV
minimum distance =  2.44569030997293 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 0.9840290955863398
Energy: 0.6682679858765481
Energy: 0.6670341639976445
Energy: 0.6683807632366422
Energy: 0.6611246629401001
Energy: 0.7156510608098122
Energy: 0.6676554424397507
Energy: 0.6675384332790117
Energy: 0.6681531245688583
Energy: 0.7168317590934287
Energy: 0.7225813636167963
Energy: 0.6820885293153758
Energy: 0.6807743778158389
Energy: 0.6826093193453413
Energy: 0.7233269095378397
Energy: 0.7213981097039137
Energy: 0.6810639435593466
Energy: 0.6799647200883278
Energy: 0.6808632603485786
Energy: 0.7201376197759036
Energy: 0.6999697818665376
Energy: 0.7057984713067453
Energy: 0.7063034612760928
Energy: 0.6904740532919705
Energy: 0.7122953335644171
Energy: 0.6992567332831466
Energy: 0.7051624195931159
Energy: 0.7062009360807527
Energy: 0.689955183027391
Energy: 0.7120676679785758
Energy: 0.7180824670394808
Energy: 0.6803573011353616
Energy: 0.7098563676101387
Energy: 0.6928076773774177
Energy: 0.7148396588951832
Energy: 0.7179284769126165
Energy: 0.6792761704506771
Energy: 0.709512144937689
Energy: 0.6937209799142678
Energy: 0.7337984209346383
Energy: 0.7181219653646606
Energy: 0.6966851900463937
Energy: 0.7177449298430019
Energy: 0.717529433704138
Energy: 0.7249144976388588
Energy: 0.7191342530670589
Energy: 0.711258249119876
Energy: 0.7158658345592159
Energy: 0.7187725194746075
Energy: 0.7233184467344169
Energy: 0.7201783936799406
Energy: 0.6985018922288672
Energy: 0.7170103041218845
Energy: 0.6628275595395319
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Energy: 0.7206453692379624
Energy: 0.698562179838346
Energy: 0.7180853414088265
Energy: 0.661739021562705
Energy: 0.730169965244805
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Energy: 0.7181598289240061
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Energy: 0.6937551213716953
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Energy: 0.6978768191550742
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Energy: 0.7072830670084617
Energy: 0.6796457388310523
Energy: 0.6992663436249277
Energy: 0.6893175934459387
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Energy: 0.6964504367946143
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Energy: 0.7212135504156901
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Energy: 0.7213198859287978
Energy: 0.6904533098479969
Energy: 0.6703995047451835
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Energy: 0.6671623910125616
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Energy: 0.6838013476444469
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Energy: 0.6674662539443653
Energy: 0.7069718931898731
Energy: 0.6798284395521724
Energy: 0.6724943951578563
Energy: 0.6812724874384856
Energy: 0.6798764335969792
Energy: 0.7244585518531242
Energy: 0.6797165806387141
Energy: 0.669037783222892
Energy: 0.6805885274925962
Energy: 0.714499652068366
Energy: 0.7232060498554402
Energy: 0.6801878090549165
Energy: 0.667402624525422
Energy: 0.6820161489926536
Energy: 0.7158532312861925
Energy: 0.7049058545494037
Energy: 0.68032150432072
Energy: 0.6681315098475372
Energy: 0.6836969113904645
Energy: 0.7264034313510201
Energy: 0.7052198543202111
Energy: 0.6700493853937541
Energy: 0.6799006573265345
Energy: 0.667817167611283
Energy: 0.7229324826895304
Energy: 0.7160961703542649
Energy: 0.6687757087387259
Energy: 0.6807833882591798
Energy: 0.6679187679997188
Energy: 0.7142410644483914
Energy: 0.7135222068227116
Energy: 0.6714500694061242
Energy: 0.6830122803278812
Energy: 0.6893322159263859
Energy: 0.7175368731944372
Energy: 0.6958799561543079
Energy: 0.6696538714048121
Energy: 0.6848064281642771
Energy: 0.7289089289139129
Energy: 0.7188359133832646
Energy: 0.695682431028317
Energy: 0.7104519543288706
Energy: 0.6968959077195663
Energy: 0.713417991191739
Energy: 0.7149784509042297
Energy: 0.7119969227712134
Energy: 0.7250541152960531
Energy: 0.6982937958546729
Energy: 0.7135300657121071
Energy: 0.7146206462878536
Energy: 0.7096006236341782
Energy: 0.7075944279125862
Energy: 0.6967945363175552
Energy: 0.71320608090636
Energy: 0.7119281092404118
Energy: 0.7060866960360864
Energy: 0.711267590002856
Energy: 0.6969783619237642
Energy: 0.7137135035369946
Energy: 0.7131912132976057
Energy: 0.7112984653818386
Energy: 0.7153007666438602
Energy: 0.7185465383903764
Energy: 0.7201701452037506
Energy: 0.7213251977204191
Energy: 0.6793572344297506
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Energy: 0.7210098242240482
Energy: 0.7079931722646311
Energy: 0.7223149635344519
Energy: 0.670993542146223
Energy: 0.7231889786614673
Energy: 0.7179365903949793
Energy: 0.724087936689737
Energy: 0.7198251190518811
Energy: 0.6886003838051137
Energy: 0.7161371467160633
Energy: 0.7180316327746549
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Energy: 0.7202079247480324
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Energy: 0.7195970407952044
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Energy: 0.6907640701414632
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Energy: 0.7066389818182238
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Energy: 0.7211752341856078
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Energy: 0.6785065788278779
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Energy: 0.7070677689083547
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Energy: 0.69109088421674
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Energy: 0.7095308089069231
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Energy: 0.7180993114138088
Energy: 0.7054249775114257
Energy: 0.6600213760975381
Energy: 0.709236539055795
Energy: 0.7162776567104241
Energy: 0.6809217142247413
Energy: 0.6811604069253521
Energy: 0.6726081910059609
Energy: 0.6983703432074563
Energy: 0.730086114560512
Energy: 0.6805661426732781
Energy: 0.6803987031579943
Energy: 0.6680891678254702
Energy: 0.6901802408125605
Energy: 0.7200340794130436
Energy: 0.6671195685325749
Energy: 0.6834001612184311
Energy: 0.6703841366088495
Energy: 0.6904625101500438
Energy: 0.7270826072983717
Energy: 0.6670778537460772
Energy: 0.6821335503044735
Energy: 0.6718449504379047
Energy: 0.7205342332558629
Energy: 0.7215444630300831
Energy: 0.6816594746849198
Energy: 0.6684993422769389
Energy: 0.6678364747325343
Energy: 0.7209674279399866
Energy: 0.7262049865560741
Energy: 0.6804201464717476
Energy: 0.6689792394778296
Energy: 0.6818282649946794
Energy: 0.7060316917834012
Energy: 0.6982946047688569
Energy: 0.6863008543618968
Energy: 0.6886271727944302
Energy: 0.6795087202965258
Energy: 0.694586559470181
Energy: 0.6679872107113286
Energy: 0.6846428260618638
Energy: 0.6830185540483295
Energy: 0.6986160259382563

minimum gb energy = 0.6600213760975381 eV
minimum distance =  2.49664034881855 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

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Energy: 0.48766882947902246
Energy: 0.5076049823796818
Energy: 0.45923198117742103
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Energy: 0.31592198368168944
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Energy: 0.4606661450998198
Energy: 0.4652206629082685
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Energy: 0.5129096555186033
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Energy: 0.4891407071745469
Energy: 0.4901701941174827
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Energy: 0.4589240377648476
Energy: 0.459393778487544
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Energy: 0.4763650758919762
Energy: 0.35834840084294184
Energy: 0.4845108468095108
Energy: 0.4901300197748568
Energy: 0.47771914906351626
Energy: 0.4727197616882128
Energy: 0.3903713591181102
Energy: 0.48320191432197845
Energy: 0.5396899400892718
Energy: 0.483630104896167
Energy: 0.3568219380782663
Energy: 0.35881791446019035
Energy: 0.4885223018943796
Energy: 0.4653074053064384
Energy: 0.47398991376569316
Energy: 0.3880141509694957
Energy: 0.3954586091954953
Energy: 0.5215100039408219
Energy: 0.5150815076964989
Energy: 0.4830448311936825
Energy: 0.48848024477691865
Energy: 0.4810121133142018
Energy: 0.4778478213249199
Energy: 0.46290846839940303
Energy: 0.47325585708809614
Energy: 0.48500938936221893
Energy: 0.4850459126494182
Energy: 0.4747882066529189
Energy: 0.5019666132606247
Energy: 0.4866393349310522
Energy: 0.45786506669476723
Energy: 0.47544443525673313
Energy: 0.5042425577792811
Energy: 0.47618520123856223
Energy: 0.46975302497906724
Energy: 0.31607563463193805
Energy: 0.46110510505873115
Energy: 0.46080763960995685
Energy: 0.4751352375708485
Energy: 0.4566855147011754

minimum gb energy = 0.31481040310502334 eV
minimum distance =  2.5192798080848 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 0.6454651436544718
Energy: 0.6387524415339105
Energy: 0.6559963404317642
Energy: 0.6542357094819656
Energy: 0.6278032331927621
Energy: 0.6259898410385225
Energy: 0.6391209081213741
Energy: 0.6523401496554121
Energy: 0.6543538963903847
Energy: 0.6310518238538636
Energy: 0.6349692290620622
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Energy: 0.6665359575994618
Energy: 0.6353092993756975
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Energy: 0.6560933911080583
Energy: 0.6541461556391277
Energy: 0.6305086870712653
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Energy: 0.6283864538629887
Energy: 0.6277817192009036
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Energy: 0.6565617892769904
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Energy: 0.6510023678756591
Energy: 0.6361140192300904
Energy: 0.6481408352793017
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Energy: 0.6597391306534032
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Energy: 0.6501968892253691
Energy: 0.6582130902603961
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Energy: 0.672158031082866
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Energy: 0.6416666303633372
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Energy: 0.6429556828906883
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Energy: 0.6480453446183785
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Energy: 0.6406725289822672
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Energy: 0.6411899637873055
Energy: 0.6275814964854739
Energy: 0.6286937634995375
Energy: 0.6429007286748952
Energy: 0.6766012034910756
Energy: 0.6297308813297808
Energy: 0.6368773905977105
Energy: 0.6473475901678595
Energy: 0.6419672315538045
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Energy: 0.6408597623927239
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Energy: 0.6400841764760835
Energy: 0.6319042121533824
Energy: 0.6484048297085374
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Energy: 0.6532890746245089
Energy: 0.6382214231013249
Energy: 0.6418581359270553
Energy: 0.6426553484397983
Energy: 0.6402013757895255
Energy: 0.6565393470606612
Energy: 0.6456064593516315
Energy: 0.6332577534823428
Energy: 0.6374111447175747
Energy: 0.635048100462498
Energy: 0.6355681087981183
Energy: 0.6355110417597164
Energy: 0.6566804220248943
Energy: 0.6404691757811656
Energy: 0.6398454044551305
Energy: 0.6346147881956852
Energy: 0.6399886558337571
Energy: 0.6530620353286227
Energy: 0.6436019061920781
Energy: 0.6444944946669864
Energy: 0.6355150569498529
Energy: 0.6345051174711859
Energy: 0.6428236417671355
Energy: 0.649052647573514
Energy: 0.6400464462578762
Energy: 0.6292212590590976
Energy: 0.6349898444376372
Energy: 0.6490648831876689
Energy: 0.6415323102822198
Energy: 0.6445804086039609
Energy: 0.6536694764899293
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Energy: 0.6672442934867311
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Energy: 0.6283294318453457
Energy: 0.6256750510166573
Energy: 0.6403991355006541
Energy: 0.6516737152405928
Energy: 0.6583078484218209
Energy: 0.6405876581341826

minimum gb energy = 0.6256750510166573 eV
minimum distance =  2.4317251919804 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 1.254614225971438
Energy: 0.8346702592708846
Energy: 0.8381437505196754
Energy: 0.8390712383601724
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Energy: 0.8438831554942069
Energy: 0.8410585651111293
Energy: 0.8422232112052171
Energy: 0.8369337568036875
Energy: 0.8370986710898718
Energy: 0.8433953799928771
Energy: 0.8414280193967338
Energy: 0.8581382550665254
Energy: 0.832174733565245
Energy: 0.8404061976050557
Energy: 0.8425035567163649
Energy: 0.8415438931363403
Energy: 0.8419677359736071
Energy: 0.8327473844714987
Energy: 0.8378127875549369
Energy: 0.8608278926267379
Energy: 0.8464886829858532
Energy: 0.8372471678776809
Energy: 0.8323440783407587
Energy: 0.8318352397268247
Energy: 0.8726267037630738
Energy: 0.8477041930933171
Energy: 0.8361217576559523
Energy: 0.8391089726908004
Energy: 0.8321617301791475
Energy: 0.838577811017877
Energy: 0.8374848574940968
Energy: 0.8321147619061126
Energy: 0.8374404654237245
Energy: 0.8333693560631759
Energy: 0.8558337627931523
Energy: 0.8372617025331384
Energy: 0.8326304147822151
Energy: 0.837582910381903
Energy: 0.8329493498321594
Energy: 0.8356761229730357
Energy: 0.8374394083023423
Energy: 0.8637626405060109
Energy: 0.8350069730036399
Energy: 0.8325362162747437
Energy: 0.8376854094331436
Energy: 0.8370052025722469
Energy: 0.8637236824917597
Energy: 0.8372912978072345
Energy: 0.844007447394969
Energy: 0.8352386920738674
Energy: 0.8368460758964978
Energy: 0.8317984414641194
Energy: 0.8337449489856428
Energy: 0.8524351395512662
Energy: 0.8346944202181734
Energy: 0.8366719469433487
Energy: 0.8627197393138378
Energy: 0.8587112454586912
Energy: 0.8369929529339734
Energy: 0.8349934993737183
Energy: 0.8371958310349926
Energy: 0.8416457957595604
Energy: 0.8324304131267978
Energy: 0.8379223775240668
Energy: 0.8351892544914303
Energy: 0.8485464409099654
Energy: 0.8388153665025238
Energy: 0.8335636349313684
Energy: 0.8228764876804123
Energy: 0.8371070936307778
Energy: 0.8418580458624901
Energy: 0.8427876967900625
Energy: 0.8377928050343031
Energy: 0.824134129631967
Energy: 0.8372347586775233
Energy: 0.8425444866189123
Energy: 0.8436240624267564
Energy: 0.8361764938008698

minimum gb energy = 0.8228764876804123 eV
minimum distance =  2.50416402735663 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

Energy: 1.4837560754790122
Energy: 0.9699824109856594
Energy: 0.9672713069958503
Energy: 0.969947173546712
Energy: 0.9692692714592436
Energy: 0.9431311354072116
Energy: 0.9603817444548437
Energy: 0.9758649565668228
Energy: 0.9815579655731014
Energy: 0.9672074632791906
Energy: 0.9618259065442566
Energy: 0.9597353668723515
Energy: 0.9693281977255724
Energy: 0.9688802764258416
Energy: 0.9615434300980792
Energy: 0.9568796588281961
Energy: 0.9509259567463036
Energy: 0.9713583182031961
Energy: 0.9637684090569034
Energy: 0.9623567133779466
Energy: 0.9637492602507597
Energy: 0.9615197608349451
Energy: 0.9647829093594886
Energy: 0.9530345093813632
Energy: 0.971302825420307
Energy: 0.9819016951601744
Energy: 0.9527142738214021
Energy: 0.9618753641365551
Energy: 0.9576021175495597
Energy: 0.9678603768167456
Energy: 0.9604035493673111
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minimum gb energy = 0.9403171806971081 eV
minimum distance =  2.44447583311488 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 0.9534674538849254
Energy: 0.9421541698639124
Energy: 0.9531821963406061
Energy: 0.9896169900857545
Energy: 0.957143491293073
Energy: 0.9683514148707592
Energy: 0.9754668786610794
Energy: 0.9649783512193029
Energy: 0.9901758135838411
Energy: 0.9578741356306137
Energy: 0.9683450040109147
Energy: 0.9756014144142572
Energy: 0.9558219402393054
Energy: 0.9759109362411059
Energy: 1.0060370338350233
Energy: 0.9506822637825899
Energy: 0.9766563227769768
Energy: 0.9561104217787484
Energy: 0.9863370118460356
Energy: 1.00618657853425
Energy: 0.9559405623662661
Energy: 0.9798591884443644
Energy: 0.9799181435952041
Energy: 0.9843165728433751
Energy: 0.9518592188813239
Energy: 0.9521112183212027
Energy: 0.9838316587733716
Energy: 0.9451774804298486
Energy: 0.9846642859022459
Energy: 0.9500501558560849
Energy: 0.9417779619795478
Energy: 0.9835881578186364
Energy: 0.9258260855264767
Energy: 0.9796456493064752
Energy: 0.9447730323780538
Energy: 0.9390379955818905
Energy: 0.9656316929892984
Energy: 0.9258839209294977
Energy: 0.9801881911688013
Energy: 0.9448773900583876
Energy: 0.941653052492191
Energy: 0.9593565598454019
Energy: 0.9626035949593063
Energy: 0.9463646884104725
Energy: 0.9513655138475133
Energy: 0.95125072970256
Energy: 0.9488005434944586
Energy: 0.9637079916336961
Energy: 0.9459785799316736
Energy: 0.9500008251467682
Energy: 0.9441370278803102
Energy: 0.9479014704052282
Energy: 0.9672998524293738
Energy: 0.9525573384175159
Energy: 0.9485599077532603
Energy: 1.000646312107983
Energy: 0.9675144541715722
Energy: 0.9683608339424228
Energy: 0.9492959796117483
Energy: 0.9527833618900271
Energy: 0.9721552321849537
Energy: 0.9472537150764611
Energy: 1.0106975747558138
Energy: 0.941923126930833
Energy: 0.9357346694846845
Energy: 0.9691824081317059
Energy: 0.9673946891287125
Energy: 1.0106282530408415
Energy: 0.9295767051016819
Energy: 0.9350855224416841
Energy: 0.9668573107839239
Energy: 0.9675905476157634
Energy: 0.9802020548096291
Energy: 0.938429159066627
Energy: 0.9854669259460556
Energy: 0.9527452797841495
Energy: 0.9467585664119029
Energy: 0.9819637950642911
Energy: 0.9373527497226847
Energy: 0.9467198884958782
Energy: 0.9502541641084062
Energy: 0.9470973357996141
Energy: 0.9485600210451716
Energy: 0.948572488865607
Energy: 0.9545325006945088
Energy: 0.9622692338684967
Energy: 0.9482959715641153
Energy: 0.9503845005004168
Energy: 0.9525275732482276
Energy: 0.9538775922813075
Energy: 0.9600783529343936
Energy: 0.9476254502161153
Energy: 0.9444225541047032
Energy: 0.9432805303949301
Energy: 0.9574657616053251
Energy: 0.9487992772028545
Energy: 0.9622260307139515
Energy: 0.9435300009050007
Energy: 0.9447682460948792
Energy: 0.9561486883514685
Energy: 0.9492655504054544
Energy: 0.9614843664609838
Energy: 0.9436707718173639
Energy: 0.9601859116382268
Energy: 0.9684048252538452
Energy: 0.9842430277316035
Energy: 0.9585491000835502
Energy: 0.9426398895638303
Energy: 0.9832237259387209
Energy: 0.9695035280562541
Energy: 0.9843620403997606
Energy: 0.9541344295042548
Energy: 0.9750688235075528
Energy: 0.9606244495791297
Energy: 0.9695186035719728
Energy: 0.9763761616395263
Energy: 0.9986566389976692
Energy: 0.9723835005132927
Energy: 0.9843611280106661
Energy: 0.9695301010678242
Energy: 0.9749949629820683
Energy: 0.9624334319181347
Energy: 0.9557599933216544
Energy: 0.9374637052029794
Energy: 0.9956868925832406
Energy: 0.9455439679863047
Energy: 0.957083323569361
Energy: 0.9606711073851043
Energy: 0.9354432665369986
Energy: 0.9468718117115342
Energy: 0.9457745351240613
Energy: 0.9557605006472489
Energy: 0.9440875118647548
Energy: 0.9525543268964416
Energy: 0.9252534664586302
Energy: 0.9274611529319733
Energy: 0.9436520143747259
Energy: 0.9494185408956107
Energy: 0.9596279248051155
Energy: 0.9250831053003913
Energy: 0.9252337714553387
Energy: 0.9587380829404856
Energy: 0.9582222456141739
Energy: 0.962579165215345
Energy: 0.9479298820302706
Energy: 0.9652121777220651
Energy: 0.9463779866493177
Energy: 0.9586387646678256
Energy: 0.9553430627326898
Energy: 0.9792469972825262
Energy: 0.9396924393737414
Energy: 0.9465077268874723
Energy: 0.9821877383619034
Energy: 0.9481375396525609
Energy: 0.9476427425287898
Energy: 0.9709035963476782
Energy: 0.9488897096541061
Energy: 0.9845565532456847
Energy: 0.9474666028971129
Energy: 0.9501991828885492
Energy: 0.973841436410178
Energy: 0.947900941384081
Energy: 0.9326338385525066
Energy: 0.9599369011988493
Energy: 0.9623599593129625
Energy: 0.9559756679503579
Energy: 0.9298162998961588
Energy: 0.9637232706660269
Energy: 0.95375654151135
Energy: 0.9863290109051013
Energy: 0.9566590024485574
Energy: 0.9328023304722801
Energy: 1.0099779984785509
Energy: 0.9459661302516781
Energy: 0.9474386597284651
Energy: 0.9837751654514799
Energy: 0.9339378554724157
Energy: 1.0000517693220683
Energy: 0.9438969059881052
Energy: 0.9464175118717894
Energy: 0.9733006520320607
Energy: 0.933216041320089
Energy: 0.9511997032918389
Energy: 0.9598629081745433
Energy: 0.9453720644132156
Energy: 0.9883532174468922
Energy: 0.9464468737584698
Energy: 0.9490498042396446
Energy: 0.9603586981915627
Energy: 0.9434575156282503
Energy: 0.9630825552708004
Energy: 0.9461812344675177
Energy: 0.9597565309675383
Energy: 0.9737228438066343
Energy: 0.9639744735469259
Energy: 0.9446126248448093
Energy: 0.9435677300038382
Energy: 0.9504218752705931
Energy: 0.9744863356948689
Energy: 0.9586863744239598
Energy: 0.9430744683010086
Energy: 0.9444617931878443
Energy: 0.9523725109983402
Energy: 0.9842251980302688
Energy: 0.9562893485116324
Energy: 0.9477162851978261
Energy: 0.9716867658751374
Energy: 0.9572937337137244
Energy: 0.9834985052347833
Energy: 0.9731993328379605
Energy: 0.9767180182285093
Energy: 0.9738358258748608
Energy: 0.9561341505473097
Energy: 0.9748379620997958
Energy: 0.9466813084983501
Energy: 0.9554485465726503
Energy: 0.9763233180984655
Energy: 0.9555926396455239
Energy: 0.9776404939514142
Energy: 1.007378502476969
Energy: 0.9566906270745281
Energy: 0.9885761295018488
Energy: 0.9311365678001488
Energy: 0.9549771170557447
Energy: 0.9543703388153891
Energy: 0.9471594739485598
Energy: 0.9848430143866552
Energy: 0.9519060473260459
Energy: 0.9484730927810796
Energy: 0.9526865788140728
Energy: 0.9627368219598335
Energy: 0.9954200324580538

minimum gb energy = 0.9245714749015269 eV
minimum distance =  2.43058387700369 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 0.9085500649581251
Energy: 0.9243981045187027
Energy: 0.9853029449881316
Energy: 0.9252012333981625
Energy: 0.917052125261748
Energy: 0.908590867150908
Energy: 0.9242902502704324
Energy: 0.9853177165554065
Energy: 0.9244353501689836
Energy: 0.9137605644678912
Energy: 0.97844932877396
Energy: 0.9210300935755567
Energy: 0.9199578685969335
Energy: 0.9201560068857667
Energy: 0.921077417099208
Energy: 0.9763306804372808
Energy: 0.9221869051788095
Energy: 0.9127647886398377
Energy: 0.9212075252241031
Energy: 0.9227843384071357
Energy: 0.9231036525123085
Energy: 0.921815154444641
Energy: 0.9222803678509738
Energy: 0.9245218564521104
Energy: 0.9782832243742884
Energy: 0.9224268717919749
Energy: 0.9215187723755098
Energy: 0.9218618257689496
Energy: 0.9867822947592665
Energy: 0.9786541379313529
Energy: 0.9852449611166096
Energy: 0.9097369614669552
Energy: 0.9115401767164996
Energy: 0.9222906602537525
Energy: 0.9802491690081224
Energy: 0.9873631418387369
Energy: 0.9094528870169019
Energy: 0.9128001043509704
Energy: 0.9223752061085888
Energy: 0.9096116028467021
Energy: 0.9227956329484323
Energy: 0.9176736802553809
Energy: 0.9092415890428197
Energy: 0.9799524029557428
Energy: 0.922754556169339
Energy: 0.9219510884489139
Energy: 0.9151076295508512
Energy: 0.9096116799807465
Energy: 0.9202792659129571
Energy: 0.9214377764948231
Energy: 0.9218008765029171
Energy: 0.9840616274360898
Energy: 0.9245594695092748
Energy: 0.9224969538153827
Energy: 0.9147595434035549
Energy: 0.9227100164013956
Energy: 0.9848862140812245
Energy: 0.9243202008505188
Energy: 0.9223561918260947
Energy: 0.9185784513470878
Energy: 0.9239970002606729
Energy: 0.9105323860415366
Energy: 0.9222711642587843
Energy: 0.9216276085210422
Energy: 0.9204959541656973
Energy: 0.923226980613625
Energy: 0.9093131036663057
Energy: 0.9208886854359832
Energy: 0.9209772529102875
Energy: 0.9199550249732722
Energy: 0.9237981120409029
Energy: 0.9748023382225501
Energy: 0.9241327094990638
Energy: 0.9092181939189252
Energy: 0.9196843741586592
Energy: 0.9243868605302675
Energy: 0.9745615421244216
Energy: 0.9233871776586068
Energy: 0.9094203237993135
Energy: 0.9219194561420586
Energy: 0.9206929380031227
Energy: 0.9121919264686732
Energy: 0.9211507209783728
Energy: 0.9108511688655234
Energy: 0.9772997390527852
Energy: 0.920438670742746
Energy: 0.9201853919329827
Energy: 0.9213147645905677
Energy: 0.9101076372753552
Energy: 0.9821323768092961
Energy: 0.9225831775647165
Energy: 0.922930466528558
Energy: 0.9749141569990408
Energy: 0.98865153829793
Energy: 0.9231725886532228
Energy: 0.9224144249126633
Energy: 0.9231358370152188
Energy: 0.9752606822350858
Energy: 0.9271186724127596
Energy: 0.9213694498980959
Energy: 0.9101318622957735
Energy: 0.9225300526124671
Energy: 0.9193073480381514
Energy: 0.9209224378600244
Energy: 0.9808768945130869
Energy: 0.91049370481045
Energy: 0.9218266736200399
Energy: 0.9097075820753229
Energy: 0.9228885526544
Energy: 0.9802399403776353
Energy: 0.9087649365979312
Energy: 0.9243948229397994
Energy: 0.989577481321534
Energy: 0.9244248453817707
Energy: 0.9181001147436055
Energy: 0.9091460639771669
Energy: 0.9241832904803243
Energy: 0.9249520470347503
Energy: 0.9235923768313302
Energy: 0.9141658895769332
Energy: 0.978446644441845
Energy: 0.9209420972759611
Energy: 0.9197587366903355
Energy: 0.9204206288139966
Energy: 0.9212132985756815
Energy: 0.9764904800620722
Energy: 0.9216032936288382
Energy: 0.9130360241974506
Energy: 0.9218341446796618
Energy: 0.9259107445505661
Energy: 0.9226657649855081
Energy: 0.921926281476772
Energy: 0.9224330433987075
Energy: 0.9251671520882339
Energy: 0.9781632360416467
Energy: 0.9221054905653555
Energy: 0.9218364002331
Energy: 0.9218979410567465
Energy: 0.9851984908433171
Energy: 0.9784405028606566
Energy: 0.9843844036300125
Energy: 0.9098187199815809
Energy: 0.9113385979553551
Energy: 0.9221729447366921
Energy: 0.9795242646749248
Energy: 0.9864994747260111
Energy: 0.9095051036009035
Energy: 0.9126836197204847
Energy: 0.9224035226792416
Energy: 0.9781236533934071
Energy: 0.9224448712447205
Energy: 0.9187869197910521
Energy: 0.9093954423523003
Energy: 0.9211721977013124
Energy: 0.9226956976515859
Energy: 0.9218294785443071
Energy: 0.9148135638990681
Energy: 0.9097957976063017
Energy: 0.9199242514962775
Energy: 0.9218944849736294
Energy: 0.9211363420623108
Energy: 0.9838855007659235
Energy: 0.9240055419738081
Energy: 0.922000420544358
Energy: 0.9142557029318151
Energy: 0.9224020573861914
Energy: 0.9852682204112095
Energy: 0.9240354249354106
Energy: 0.922347283842461
Energy: 0.9177822676649321
Energy: 0.9247473578788338
Energy: 0.9104985328041499
Energy: 0.9223543307464281
Energy: 0.9221863690839657
Energy: 0.9208221278299211
Energy: 0.9226695765044374
Energy: 0.9092070313793169
Energy: 0.9213745289112774
Energy: 0.9210531363011408
Energy: 0.9198977828579638
Energy: 0.923577434983577
Energy: 0.9746064684806324
Energy: 0.9240008865334646
Energy: 0.9091926779876879
Energy: 0.9195366625901391
Energy: 0.9249590483817517
Energy: 0.9744185327962185
Energy: 0.9234304333843562
Energy: 0.9092984478749058
Energy: 0.9221093561979273
Energy: 0.9208554955439155
Energy: 0.912428387879826
Energy: 0.9213940209907144
Energy: 0.9109707386224429
Energy: 0.978379558635523
Energy: 0.9205855997504838
Energy: 0.9198100984097479
Energy: 0.9203802445900744
Energy: 0.9103141184616825
Energy: 0.9211558314352742
Energy: 0.9226416258696659
Energy: 0.9227367210446964
Energy: 0.9744623036198676
Energy: 0.9886270197867274
Energy: 0.9226314512389099
Energy: 0.9224852528378922
Energy: 0.9231144356834003
Energy: 0.9763597402730827
Energy: 0.9252661761529195
Energy: 0.9217588371981145
Energy: 0.910084685205991
Energy: 0.9224924210127564
Energy: 0.9194388986977466
Energy: 0.9216612774483229
Energy: 0.9810744566637221
Energy: 0.9104628318376563
Energy: 0.9215910703896462
Energy: 0.9096838611674615
Energy: 0.922550445054711
Energy: 0.9787329573039912

minimum gb energy = 0.9085500649581251 eV
minimum distance =  2.44111309507466 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.659965685985683
Energy: 0.9747368932796481
Energy: 1.0141305590020337
Energy: 0.9349647156918396
Energy: 0.9953402918297406
Energy: 0.9035245372983665
Energy: 0.9886412638751332
Energy: 0.9916535082601693
Energy: 0.9221285823129682
Energy: 0.9312139397765806
Energy: 0.9127560197811013
Energy: 0.9272376465378974
Energy: 0.9514453711966725
Energy: 0.9515855998674994
Energy: 0.9812319851727718
Energy: 0.8854732122886885
Energy: 0.9270492130335458
Energy: 0.9511115763382674
Energy: 0.9302421888430071
Energy: 0.9504381094382868
Energy: 1.019494593373869
Energy: 0.9523560227596857
Energy: 0.9087210700022221
Energy: 0.9720017645744317
Energy: 0.9309129159520148
Energy: 1.0274868962042372
Energy: 0.9517633706092132
Energy: 0.9073327418118785
Energy: 0.957709627028591
Energy: 0.9130329497737925
Energy: 0.9128115945314818
Energy: 0.9032858583192422
Energy: 0.9596888291030192
Energy: 0.9884924192181095
Energy: 1.03392147186178
Energy: 0.9286800853954882
Energy: 0.9033090496262921
Energy: 0.9728178147296276
Energy: 1.0214441448769942
Energy: 0.911112634696958
Energy: 1.0202448871772924
Energy: 0.9914860497210005
Energy: 0.9006416984722224
Energy: 0.9070537180529236
Energy: 0.9722575674348847
Energy: 0.9943863000545878
Energy: 0.9853627877594918
Energy: 0.8897734691314012
Energy: 0.9082059004173031
Energy: 0.9727176538154154
Energy: 0.8902202380050614
Energy: 0.906832597662902
Energy: 0.9070904772986927
Energy: 0.9876264844239202
Energy: 1.0512660376268108
Energy: 0.9149895739527396
Energy: 0.9073279816673295
Energy: 0.9060989611234453
Energy: 1.0343707490541614
Energy: 1.002762103136612
Energy: 0.9097116581478724
Energy: 0.9057160174469612
Energy: 0.9086086066004118
Energy: 0.9365200313860635
Energy: 1.0114442313886312
Energy: 0.9083967343731238
Energy: 0.9055537980740067
Energy: 0.9083560741200309
Energy: 0.907580396447908
Energy: 1.0380522696512076
Energy: 0.9112056265370628
Energy: 0.9074659103472831
Energy: 0.9316274920339913
Energy: 0.9041497610241287
Energy: 0.9684762498655244
Energy: 0.9085992318553029
Energy: 0.9062280609082944
Energy: 0.9449529286820254
Energy: 0.9021099522164121
Energy: 0.9769430206843371
Energy: 0.9064620759804284
Energy: 1.0707553686698241
Energy: 0.9648912094680571
Energy: 0.9021763626397874
Energy: 0.907827297989752
Energy: 0.9054015439988913
Energy: 1.0896870462839874
Energy: 0.9796002335796501
Energy: 0.9017390131548443
Energy: 0.9077347298514379
Energy: 0.975989069056716
Energy: 0.965098001897997
Energy: 0.9277008160835603
Energy: 0.9111316546840222
Energy: 0.9221473116162449
Energy: 0.9589796563803223
Energy: 0.9576212183016083
Energy: 0.9271141797306628
Energy: 0.9118408190217148
Energy: 0.9140871058592667
Energy: 0.9706669948909658
Energy: 0.9732889519188692
Energy: 0.9081291073640737
Energy: 0.9269605198970913
Energy: 0.9253506040286404
Energy: 0.9620596052530883
Energy: 0.9247283646884364
Energy: 0.9218558034425847
Energy: 0.9244883895181961
Energy: 0.9263144559231636
Energy: 1.0777553940389193
Energy: 0.9462772965378464
Energy: 0.9526905437248518
Energy: 0.88670516767406
Energy: 0.9312164201764127
Energy: 1.0599733512785865
Energy: 0.9424771462499485
Energy: 0.8938166061541575
Energy: 0.8858825410450561
Energy: 0.929349748115674
Energy: 0.9689966377947823
Energy: 0.9118321055262033
Energy: 0.9065139033098127
Energy: 0.9325535669324262
Energy: 0.9140900124165217
Energy: 0.9646062857135542
Energy: 0.9364839124374181
Energy: 0.9054868723572507
Energy: 0.9351794829402296
Energy: 0.9008047978172271
Energy: 0.9554332840715676
Energy: 0.9491992906657202
Energy: 1.0042601756952803
Energy: 0.9447230526786959
Energy: 0.9261237747823139
Energy: 0.9517665156625933
Energy: 0.9456374488928104
Energy: 1.005023659591228
Energy: 0.9415256531751488
Energy: 0.9330000103370422
Energy: 0.9066756702881936
Energy: 0.9277162331378663
Energy: 1.0170439872997459
Energy: 1.0012927173026533
Energy: 0.9253511011159512
Energy: 0.9063261971796184
Energy: 0.9249974863632399
Energy: 1.0161494653501275
Energy: 0.9539285632269328
Energy: 0.9253659852255081
Energy: 1.0357818243355137
Energy: 1.0165182535851243
Energy: 0.926436925414877
Energy: 0.9613745549200914
Energy: 0.9350780891686457
Energy: 1.0401606390434504
Energy: 1.0164510740339676
Energy: 0.9254514362628691
Energy: 0.9490290133356314
Energy: 0.9374726474733982
Energy: 0.8937703393958016
Energy: 0.9109858462699495
Energy: 0.915632574774996
Energy: 1.0215676601786328
Energy: 0.9849041432301539
Energy: 0.898766548879518
Energy: 0.9927365017090761
Energy: 0.9240913030139275
Energy: 1.0227988713756224
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Energy: 1.0475174950958495
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Energy: 0.9640152039020384
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Energy: 1.01728595486729
Energy: 1.0294299524036326
Energy: 0.906975334582921
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Energy: 0.8856517717677138
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Energy: 1.03689574254086
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Energy: 0.9256898707985689
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Energy: 0.9299039704050094
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Energy: 0.951688704248089
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Energy: 1.0549179157353668
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Energy: 0.9108475010715036
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Energy: 0.9733499347860955
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Energy: 0.9506887561534952
Energy: 0.9435598418693157
Energy: 0.9649847922988225
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Energy: 1.0206451534097718
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Energy: 1.0082178428764692
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Energy: 1.0079821617396387
Energy: 1.0202672348047983
Energy: 0.9297560229034105
Energy: 1.0087003300133608
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Energy: 1.033871891740073
Energy: 1.041159655241611
Energy: 0.9578809992085354
Energy: 0.9924627315814498
Energy: 0.9346995931807447
Energy: 0.9078999084972991
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Energy: 1.0238402811762572
Energy: 0.9252040898016274
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Energy: 0.909301556927805
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Energy: 0.9074368396751857
Energy: 0.9082535881178783
Energy: 1.0087488748318
Energy: 1.0783370693280276
Energy: 1.0118410189883482
Energy: 0.9080655129018904
Energy: 0.9072210055900197
Energy: 1.0197504236453614
Energy: 1.0358632943407944
Energy: 0.9092569621083696
Energy: 0.9100921352099679
Energy: 0.9084400596504962
Energy: 0.938029565600376
Energy: 1.0140309991716767
Energy: 0.9080982725846726
Energy: 0.9099201493823105
Energy: 0.9082431099981356
Energy: 0.9148769098085863
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Energy: 0.9080979488140571
Energy: 0.9116688545704066
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Energy: 0.9827093450517421
Energy: 0.9091383190436183
Energy: 0.9070540400313097
Energy: 0.9117188424085587
Energy: 0.9010801188035767
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Energy: 0.9693942590574708
Energy: 0.9050478461338824
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Energy: 0.9324424756235316
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Energy: 1.0052962244120998
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Energy: 0.9432187094814952
Energy: 0.9590828110174499
Energy: 0.8896480384991016
Energy: 0.939729372575527
Energy: 0.8943610461482938
Energy: 0.9139667460708146
Energy: 0.958519908153076
Energy: 0.8892274253301942
Energy: 0.94721623651845
Energy: 0.8948110755101633
Energy: 0.9138718213034056
Energy: 0.9638674337326919
Energy: 0.9176868654330382
Energy: 0.9204980114634446
Energy: 0.9253295694024738
Energy: 0.9253722550356165
Energy: 0.9609154473512778
Energy: 0.9278203177346095
Energy: 0.9230271308846087
Energy: 0.9269872614194254
Energy: 0.9260526745269777
Energy: 1.0775065688887129
Energy: 0.9280603356612245
Energy: 0.8933213122628655
Energy: 0.8948312544118724
Energy: 0.9268441425093665
Energy: 1.0588788372251283
Energy: 0.9893023555011403
Energy: 0.8937482195892609
Energy: 0.8947181224108438
Energy: 0.9311087959676417
Energy: 0.9624651501081253
Energy: 0.8854427678595069
Energy: 0.9041674243705903
Energy: 0.9084980062970263
Energy: 0.9274665391165323
Energy: 0.9636990402559775
Energy: 0.9005538259615846
Energy: 0.9076912353899254
Energy: 0.9319884118560904
Energy: 0.9119393037598165
Energy: 0.9507324660269847
Energy: 0.9529023931036802
Energy: 0.9784562849694923
Energy: 0.9231736819751294
Energy: 0.9083076392296552
Energy: 0.9503212337937551
Energy: 0.9554035381925755
Energy: 0.9110069472511259
Energy: 0.9191366335880878
Energy: 0.9278253076999307
Energy: 0.9058801808154768
Energy: 0.9517655684169855
Energy: 0.8954281929205817
Energy: 0.95484827737858
Energy: 0.9243019776931204
Energy: 0.9066251902082408
Energy: 0.9421896772994869
Energy: 0.9116129345585684
Energy: 0.9286368063373306
Energy: 0.9267143300470966
Energy: 1.038532269246322
Energy: 1.0410180208805877
Energy: 0.9266918965330715
Energy: 0.9982223678440323
Energy: 0.9380641763359534
Energy: 1.0317084046650946
Energy: 1.041639943958994
Energy: 0.9260095216433281
Energy: 1.0007563503316028
Energy: 0.8894476692278271
Energy: 0.9014372906776337
Energy: 0.9923362118948148
Energy: 1.0013891115406206
Energy: 1.0407011810370173
Energy: 0.9666059716894825
Energy: 0.8938117702380495
Energy: 0.9771745999677444
Energy: 0.9751426211673878
Energy: 1.0408113076263854
Energy: 0.935795323461339
Energy: 1.013547352964554
Energy: 1.0349915489236798
Energy: 1.0632512288056013
Energy: 0.9313364364169326
Energy: 0.9072292628764714
Energy: 1.0220991376879054
Energy: 1.064064191527892
Energy: 1.062694158979725
Energy: 0.9202544274971866
Energy: 0.9080984429733172
Energy: 0.9072239591141598
Energy: 0.9036391196540873
Energy: 0.9114290168969692
Energy: 0.9058840335072779
Energy: 0.910235380339271
Energy: 0.906008574415828
Energy: 0.8891164651692477
Energy: 0.9105639554545297
Energy: 0.9071028535758396
Energy: 0.9167487716468912
Energy: 0.9092529513500742
Energy: 0.9331183064214742
Energy: 0.9585591719183718
Energy: 0.9067644612863245
Energy: 0.9076697702785992
Energy: 0.9078839993603242
Energy: 0.9539604225490675
Energy: 0.9405043017288631
Energy: 0.9069787621652743
Energy: 0.9086267470361777
Energy: 0.9686992976075318
Energy: 0.9012793262413956
Energy: 0.9249044074828997
Energy: 0.9767865432211099
Energy: 0.9555948271769309
Energy: 0.947085687278228
Energy: 0.9009959979745508
Energy: 0.9195915983202343
Energy: 0.9783255009278999
Energy: 0.9618344750849421
Energy: 0.9128868173404987
Energy: 0.9112498995623618
Energy: 0.9780233270600373
Energy: 1.0700020603378775
Energy: 0.9058482983644248
Energy: 0.8854759077793702
Energy: 0.8850024444542453
Energy: 0.9652672237822881
Energy: 1.0926017230925849
Energy: 0.9075638516736385
Energy: 0.9193291989531212
Energy: 0.9127127076951356
Energy: 0.9195727896179278
Energy: 0.9062268032233486
Energy: 0.8874784718839274
Energy: 0.9265636431000216
Energy: 0.9294599656499525
Energy: 0.931165961803762
Energy: 0.9076529495659841
Energy: 0.9114052678219885
Energy: 0.9124523611426673
Energy: 0.9482905115887564
Energy: 1.0557779692846605
Energy: 1.05407897029797
Energy: 0.9711457955767887
Energy: 0.8868712114492149
Energy: 0.9707668957346913
Energy: 1.0571653024185672
Energy: 0.9312415251611141
Energy: 0.9761375953538446
Energy: 0.9358859029966963
Energy: 0.9882655540103189
Energy: 0.9061881521360065
Energy: 0.9232991785684315
Energy: 0.8829733458380263
Energy: 0.9047395254612461
Energy: 0.9957633442527204
Energy: 0.9076159438523215
Energy: 0.9281786699211664
Energy: 0.8903107909802207

minimum gb energy = 0.8829733458380263 eV
minimum distance =  2.42032485426917 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.2585496092913206
Energy: 0.8745460379046394
Energy: 0.9528492311064997
Energy: 0.8724619674552452
Energy: 0.9079231079055071
Energy: 0.8927543056577344
Energy: 0.8736213305159016
Energy: 0.9547620716378565
Energy: 0.8407828867028939
Energy: 0.9916980393780375
Energy: 0.8250911052569303
Energy: 0.9443474585518318
Energy: 0.8233028702899245
Energy: 0.9960575252881858
Energy: 0.9242470283721678
Energy: 0.8242594880523524
Energy: 0.943560114710073
Energy: 0.8237742996416525
Energy: 0.9449479496274393
Energy: 0.8254339072300237
Energy: 0.9142374259011521
Energy: 0.9260806717736353
Energy: 0.8603444265149457
Energy: 0.8609031540338806
Energy: 0.8271233441103948
Energy: 0.913539172722832
Energy: 0.926698916168014
Energy: 0.860437895868411
Energy: 0.8594148987274115
Energy: 0.9147964859192829
Energy: 0.8588965927547214
Energy: 0.8620889026991423
Energy: 0.8582475018421947
Energy: 0.8383467625376166
Energy: 0.8249059261304865
Energy: 0.8601586074392753
Energy: 0.8601738056076441
Energy: 0.858975038037949
Energy: 0.9123734324438527
Energy: 0.8584858025573754
Energy: 0.8372843231482997
Energy: 0.9448505221016331
Energy: 0.8380748961535457
Energy: 0.8470381438795487
Energy: 0.8948345024985065
Energy: 0.8381209592239823
Energy: 0.9408757799937683
Energy: 0.8356772231355287
Energy: 0.8413696994531417
Energy: 0.8942824890931933
Energy: 0.8245779963601207
Energy: 0.861923340076803
Energy: 0.8610339388598662
Energy: 0.9067530046511106
Energy: 0.8930463979577623
Energy: 0.8822520043608945
Energy: 0.8593366914070999
Energy: 0.8246507274710553
Energy: 0.9110162510540168
Energy: 0.8930214644431931
Energy: 0.9143483664971257
Energy: 0.9107720492416884
Energy: 0.9104886313443259
Energy: 0.8565257388459759
Energy: 0.8590753167040351
Energy: 0.9126951146022626
Energy: 0.9100920612403881
Energy: 0.9101653935770296
Energy: 0.8576774444320043
Energy: 0.8592535686131563
Energy: 0.9202859070886928
Energy: 0.8271828205207683
Energy: 0.8268822282502328
Energy: 0.8379475957758841
Energy: 0.9429874005412678
Energy: 0.9255915562113475
Energy: 0.8232351276723253
Energy: 0.8576723541889277
Energy: 0.8386731237845984
Energy: 0.9431516092690917
Energy: 0.8577130435106913
Energy: 0.8591034224638903
Energy: 0.871551054608003
Energy: 0.8606547818646174
Energy: 0.8585372358393926
Energy: 0.856521174261208
Energy: 0.858159323588796
Energy: 0.8718129248123756
Energy: 0.8626944991653133
Energy: 0.8571542538527566
Energy: 0.8751885430952414
Energy: 0.9115598926384746
Energy: 0.8254178290771355
Energy: 0.9209203339801576
Energy: 0.8758808612513584
Energy: 0.8416493019023714
Energy: 0.8345761014044933
Energy: 0.8254537731102586
Energy: 1.0015540541873598
Energy: 0.8762642704330537
Energy: 0.8250654266921016
Energy: 0.8240024613351635
Energy: 0.8739948368460867
Energy: 0.8914498755814747
Energy: 0.8260214303497665
Energy: 0.8244326644741905
Energy: 0.8238724363099564
Energy: 0.9400710734359681
Energy: 0.892328831436064
Energy: 0.8616089588011653
Energy: 0.828098030672314
Energy: 0.8288227753675731
Energy: 0.8287871919448807
Energy: 0.9753296264819212
Energy: 0.8268348642656286
Energy: 0.8238940508837517
Energy: 0.8232730788915932
Energy: 0.8241574111233905
Energy: 0.9477195155495433
Energy: 0.8255869448156116
Energy: 0.8256277100223833
Energy: 0.825941346806231
Energy: 0.9458642516015663
Energy: 0.9448408229623725
Energy: 0.8711586441134095
Energy: 0.8262833095196409
Energy: 0.8276069373312185
Energy: 0.9488922651988341
Energy: 0.9431026070871802
Energy: 0.8265357716597072
Energy: 0.8224854481956134
Energy: 0.8780154731335428
Energy: 1.0410998129112685
Energy: 0.8250281280990767
Energy: 0.8328623616141198
Energy: 0.8262842773283743
Energy: 0.8731824010203598
Energy: 1.035371162928906
Energy: 0.828220089127442
Energy: 0.8797706827496298

minimum gb energy = 0.8224854481956134 eV
minimum distance =  2.4841952232951 Angstroms
sigma value = 33