Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_Fe__MO_650279905230_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.865948021411896
cohesive_energy=4.290335425356015
mass=55.845
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=[5.2308343399822196e-21, 4.26648422397762e-20, 1.223665608570768e-19, 2.10836831974596e-19, 2.8695784603257e-19, 3.5040243856233597e-19, 4.0488445500150593e-19, 4.52688599230164e-19, 4.9464800309799e-19, 5.31006197453352e-19, 5.61989089201644e-19, 5.88003631207902e-19, 6.095913591744179e-19, 6.27337067572602e-19, 6.41795109517818e-19, 6.534637619432399e-19, 6.6277240818678e-19, 6.700975597574279e-19, 6.757756737483239e-19, 6.80104755013392e-19, 6.833411518140719e-19, 6.855906078082079e-19, 6.86905994824722e-19, 6.87333775986e-19, 6.86873951292042e-19, 6.853951422588599e-19, 6.827227116333479e-19, 6.78646774276452e-19, 6.72917390633268e-19, 6.652237384368e-19, 6.551893061780579e-19, 6.42351064809816e-19, 6.261274242139319e-19, 6.0579259837520395e-19, 5.804381531421539e-19, 5.4892173657474e-19, 5.0979658317246e-19, 4.61233007219286e-19, 4.0087100253333596e-19, 3.25576711618506e-19, 2.3101144014992395e-19, 1.108292869156428e-19, -4.4576078746474803e-20, -2.4976972418079596e-19, -5.26172430548574e-19, -9.046818538011719e-19, -1.43019098322327e-18, -2.1711576220324198e-18]
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: -2.38418579101562e-07 eV

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

Energy: 0.01489180302934898
Energy: 0.015381888245095187
Energy: 0.0887686054445811
Energy: 0.08998396633123494
Energy: 0.10964064731847885
Energy: 0.08758855608482222
Energy: 0.10507734877438199
Energy: 0.0889119634430861
Energy: 0.09079978086803547
Energy: 0.017820225189971107
Energy: 0.015108616456754594
Energy: 0.08790737039819019
Energy: 0.10540857057136578
Energy: 0.01583129665135221
Energy: 0.016296774279004198
Energy: 0.0930560664502858
Energy: 0.08781800309899947
Energy: 0.10503240422778891
Energy: 0.08772210671881042
Energy: 0.10791878237491011
Energy: 0.08864591694054834
Energy: 0.08755669375249579
Energy: 0.10492251702618452
Energy: 0.01867344067086163
Energy: 0.08966881998714146
Energy: 0.105022742123859
Energy: 0.015454461654320153
Energy: 0.015255146410394993
Energy: 0.10529906052661488
Energy: 0.08849606476661308
Energy: 0.01662600090886298
Energy: 0.10571535234372939
Energy: 0.08776164733889807
Energy: 0.0879073585766512
Energy: 0.09256804123624467
Energy: 0.105155420616277
Energy: 0.01602049987352673
Energy: 0.015676474629756947
Energy: 0.08762569937395841
Energy: 0.01509805830703799
Energy: 0.017066305218380602
Energy: 0.0913324933047388
Energy: 0.08824625183313967
Energy: 0.015926623356850116
Energy: 0.01515771183974529
Energy: 0.0875772320288003
Energy: 0.09026316573617994
Energy: 0.08843484941508106
Energy: 0.08756263333155782
Energy: 0.01502199156462923
Energy: 0.08811693557783933
Energy: 0.09057377550410371
Energy: 0.108417830767689
Energy: 0.015593696663413361
Energy: 0.015093526633593651
Energy: 0.08851443601902978
Energy: 0.01580115886113958
Energy: 0.01710274450229468
Energy: 0.10621076105192469
Energy: 0.08744323647351446
Energy: 0.015083820403723877
Energy: 0.1055415221747079
Energy: 0.08795256758071199
Energy: 0.10504195296861449
Energy: 0.08781714888744722
Energy: 0.1048255812197831
Energy: 0.015540009003878313
Energy: 0.01710150748104352
Energy: 0.10493132505968993
Energy: 0.0886622454045058

minimum gb energy = 0.01489180302934898 eV
minimum distance =  2.4805908742869 Angstroms
sigma value = 3


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

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Energy: 1.337881645988476
Energy: 1.356562341209546
Energy: 1.3499450120898162
Energy: 1.4241985288851116
Energy: 1.3603908853362738
Energy: 1.4194267430680712
Energy: 1.4264334687137068
Energy: 1.4258330513381763
Energy: 1.4397981560512048
Energy: 1.3684765603214986
Energy: 1.361023231900807
Energy: 1.4095723640708473
Energy: 1.3882172638383088
Energy: 1.4160508292743523
Energy: 1.3623011250358492
Energy: 1.3651973227341925
Energy: 1.4268390860975042
Energy: 1.353888695558132
Energy: 1.4357413004819999
Energy: 1.4730691852985196
Energy: 1.3525942349709452
Energy: 1.41461176738889
Energy: 1.36756383858486
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Energy: 1.4115943770168007
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Energy: 1.348001574420194
Energy: 1.4504095996568465
Energy: 1.345886538429104
Energy: 1.350340451407277
Energy: 1.4105083185836376
Energy: 1.4024518300702442
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Energy: 1.3763360996884104
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Energy: 1.3530026906625805
Energy: 1.3634015141113731
Energy: 1.3858666375672317
Energy: 1.3593770760036592
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Energy: 1.372945428258915
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Energy: 1.4094842798374425
Energy: 1.3945845552684575
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Energy: 1.330924526800508
Energy: 1.330480947939781
Energy: 1.3310443669255843
Energy: 1.3340435231511545
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Energy: 1.4039492088935934
Energy: 1.4435367958937106
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Energy: 1.4795544133500582
Energy: 1.4774005171774955
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Energy: 1.3475154631147577
Energy: 1.379040465762651
Energy: 1.4616429235723256
Energy: 1.3375073943867755
Energy: 1.389148920466726
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Energy: 1.3468605515560357
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Energy: 1.3800628736794214
Energy: 1.3756609032750586
Energy: 1.3767285062062613
Energy: 1.3730325051712198
Energy: 1.3780876141641871
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Energy: 1.3442823475237926
Energy: 1.3877450995754033
Energy: 1.4000647679084843
Energy: 1.3407923222153584
Energy: 1.3799888367693955
Energy: 1.3370017071824616
Energy: 1.3432753464994147
Energy: 1.3876382331698238
Energy: 1.347984991531284
Energy: 1.3428298873407483
Energy: 1.4294731370412659
Energy: 1.4148946451248714
Energy: 1.3869011912876026
Energy: 1.3409765590992668
Energy: 1.3454190767288943
Energy: 1.3760663449407657
Energy: 1.400582614424567
Energy: 1.3626824929816712
Energy: 1.3831534505785974
Energy: 1.3664244325959911
Energy: 1.3764984018442263
Energy: 1.4148304191175998
Energy: 1.3458818551842848
Energy: 1.4747118990450692
Energy: 1.3463595270422184
Energy: 1.375429899964705
Energy: 1.3758655341006012
Energy: 1.361927247079769
Energy: 1.3582103759110946
Energy: 1.4031295962651056
Energy: 1.3508223352182391
Energy: 1.410106698912567
Energy: 1.3772795934417117
Energy: 1.4145396481984378
Energy: 1.3927363934267776
Energy: 1.3619586837752684
Energy: 1.4224209027568986
Energy: 1.3465958403958744
Energy: 1.3450542971120312
Energy: 1.5139257284029746
Energy: 1.338217854049236
Energy: 1.3456873404569285
Energy: 1.3901598969073277
Energy: 1.4166791255979325
Energy: 1.377223031521161
Energy: 1.358602454422008
Energy: 1.3507205650059066
Energy: 1.4145086341559097
Energy: 1.3469581548553367
Energy: 1.4084763336939556
Energy: 1.3813581181498247
Energy: 1.417571155972017
Energy: 1.3711482015377119
Energy: 1.3383163238279223
Energy: 1.353739561578093
Energy: 1.390141683003088
Energy: 1.3840813155691647
Energy: 1.3782734952923261
Energy: 1.3847353351582232
Energy: 1.351677806473879
Energy: 1.4257891320066745
Energy: 1.3516763253676607
Energy: 1.3926398962992879
Energy: 1.3377775797183105
Energy: 1.3458042255501572
Energy: 1.4007314206606492

minimum gb energy = 1.330480947939781 eV
minimum distance =  2.26446861349605 Angstroms
sigma value = 75


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

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Energy: 1.4645710017789704
Energy: 1.4563459418723452
Energy: 1.4287315981854287
Energy: 1.4951508107605072
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minimum gb energy = 1.3983661625137396 eV
minimum distance =  2.2613435851399 Angstroms
sigma value = 105


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

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Energy: 1.4671158615289022
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Energy: 1.4763159703490127
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Energy: 1.487068531963372
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Energy: 1.4769886553295029
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Energy: 1.5793167909435795
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Energy: 1.4457860836647525
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Energy: 1.452313779510231
Energy: 1.4462238767161293
Energy: 1.4048358928468767
Energy: 1.462239837922426
Energy: 1.4891614009223415
Energy: 1.4339859775279733
Energy: 1.5679382487291496
Energy: 1.549379397935641
Energy: 1.438376107931607
Energy: 1.4878552309162503
Energy: 1.436212856407629
Energy: 1.436225382195034
Energy: 1.4438125196633835
Energy: 1.4444794310856979
Energy: 1.429168891171029
Energy: 1.4314464076178437
Energy: 1.3956941343172733
Energy: 1.4366694394250947
Energy: 1.44730745998381
Energy: 1.4680477857962286
Energy: 1.4214443218273085
Energy: 1.4494739523665252
Energy: 1.4455021493665068
Energy: 1.4306143150823505
Energy: 1.4291942886277358
Energy: 1.4646175231682068
Energy: 1.4892052334119434
Energy: 1.4851778721654145
Energy: 1.462328944339492
Energy: 1.4963208717104868
Energy: 1.492315126287607
Energy: 1.4299852966087025
Energy: 1.4366832888451757
Energy: 1.4504658992743238
Energy: 1.430153691679388
Energy: 1.5057582269323107
Energy: 1.4635110342841522
Energy: 1.4608682650258398
Energy: 1.4289938690205364
Energy: 1.5960665655481832
Energy: 1.6270890407549767
Energy: 1.4301689327841567
Energy: 1.4704427142781662
Energy: 1.4482241433931333
Energy: 1.6221868796808465
Energy: 1.4198940100387096
Energy: 1.4229813358641619
Energy: 1.465404496322452
Energy: 1.4048509349682117
Energy: 1.4527213538348887
Energy: 1.4036719463097937
Energy: 1.549413480897
Energy: 1.6314050457449663
Energy: 1.4199259115436191

minimum gb energy = 1.353375759171747 eV
minimum distance =  2.28899196414984 Angstroms
sigma value = 165


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

Energy: 1.6348333650027513
Energy: 1.3480653807246898
Energy: 1.4069628150139348
Energy: 1.3960694902719564
Energy: 1.4165987377598148
Energy: 1.3839081507143345
Energy: 1.3723595289605803
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Energy: 1.4211657775680384
Energy: 1.3479982192719957
Energy: 1.4125294126197931
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Energy: 1.3996753323162339
Energy: 1.6690298298966473
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Energy: 1.3830607161256614
Energy: 1.4172554725859454
Energy: 1.4506734769376357
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Energy: 1.3997452902703194
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Energy: 1.6792306449955658
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Energy: 1.3663861231004917
Energy: 1.6787661713203244
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Energy: 1.405643916697443
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Energy: 1.450879104856036
Energy: 1.3719175248827435
Energy: 1.374335032982886
Energy: 1.3727279788106328
Energy: 1.4219283488058059
Energy: 1.436743305584964
Energy: 1.3954445325995988
Energy: 1.4175724849603444
Energy: 1.4150852173498347
Energy: 1.374414293243804
Energy: 1.3738952201275958
Energy: 1.3741010670097908
Energy: 1.3775967215536347
Energy: 1.3762159775694576
Energy: 1.4148558282250454
Energy: 1.3744117385706915
Energy: 1.4042730084280315
Energy: 1.425406657674292
Energy: 1.4182779751074037
Energy: 1.3803761129158685
Energy: 1.3819663940581937
Energy: 1.3720201109711323
Energy: 1.4075221273518306
Energy: 1.374713712463908
Energy: 1.4142906867781255
Energy: 1.3614808857509515
Energy: 1.4111413115677596
Energy: 1.4937775179132378
Energy: 1.451634240330383
Energy: 1.3728558984120496
Energy: 1.3834272738584352
Energy: 1.3731172220526071
Energy: 1.4133715375731846
Energy: 1.3985860891378692
Energy: 1.3939169584544489
Energy: 1.395559002148474
Energy: 1.3758239552558917
Energy: 1.3741683821701447
Energy: 1.4169560076027072
Energy: 1.4169649396835362
Energy: 1.4640651496399675
Energy: 1.6574989055827334

minimum gb energy = 1.3479982192719957 eV
minimum distance =  2.26375206822924 Angstroms
sigma value = 41


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

Energy: 2.7207930956900936
Energy: 1.3420213005847776
Energy: 1.426845312561963
Energy: 1.4239395655774019
Energy: 1.3458177024532587
Energy: 1.4646158124250857
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Energy: 1.449884141643108
Energy: 1.4482945382638237
Energy: 1.4669347762585838
Energy: 1.363829143448203
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Energy: 1.2938272299316458
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Energy: 1.3651144974489944
Energy: 1.3695251168479665
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Energy: 1.3368091190469436
Energy: 1.433069513804267
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Energy: 1.5490754494675594
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Energy: 1.368867336120786
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Energy: 1.3688285870495451
Energy: 1.2258463637311245
Energy: 1.4572453782950692
Energy: 1.4472795116094452
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Energy: 1.3711003370435866
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Energy: 1.4985870092908502
Energy: 1.340120420129189
Energy: 1.244288172277597
Energy: 1.3202076183446139
Energy: 1.4793552001474153
Energy: 1.4412991266899469
Energy: 1.3359788828298236
Energy: 1.4209204797146247
Energy: 1.3802621953154786
Energy: 1.3909478952776215
Energy: 1.3114708767473782
Energy: 1.2456018792501504
Energy: 1.2415940376768324
Energy: 1.3338305021860997
Energy: 1.4662039423913955
Energy: 1.360868795295602
Energy: 1.2732466245234741
Energy: 1.3394735415503358
Energy: 1.388901235026457
Energy: 1.3401885049112694
Energy: 1.5110750451865445
Energy: 1.4459980387275353
Energy: 1.3449372824081547
Energy: 1.3383448530562752
Energy: 1.3492815987253959
Energy: 1.3589197295543531
Energy: 1.334654134321527
Energy: 1.3352038289209973
Energy: 1.3391138506771425
Energy: 1.4425658751863282
Energy: 1.5315033668755191
Energy: 1.4982678079522471
Energy: 1.4763652141553518
Energy: 1.34140054719706
Energy: 1.336284241124403
Energy: 1.3396632120766812
Energy: 1.3357642540050418
Energy: 1.3383842728587236
Energy: 1.4414328148403834
Energy: 1.338391782223507
Energy: 1.4921443609186598
Energy: 1.4444569452807652
Energy: 1.5249630756274783
Energy: 1.3337957124177764
Energy: 1.3446072336518446
Energy: 1.3120246598112204
Energy: 1.476893483139286
Energy: 1.3604237236741916
Energy: 1.4495552317757354
Energy: 1.4311127001832757
Energy: 1.3752871789012617
Energy: 1.4353805177927914
Energy: 1.4431946831044802
Energy: 1.4921574899982364
Energy: 1.4626944448079797

minimum gb energy = 1.1783157086883858 eV
minimum distance =  2.24845937595676 Angstroms
sigma value = 185


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

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Energy: 1.2874626009143781
Energy: 1.415651621483756
Energy: 1.3866865885820228
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Energy: 1.5241716363510642
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Energy: 1.336745624830045
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Energy: 1.2805337887166748
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Energy: 1.3499783085787682
Energy: 1.511433371791528
Energy: 1.6399775010879007
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Energy: 1.291204798259853
Energy: 1.3345917095139155
Energy: 1.2935026949287913
Energy: 1.5488454663533076
Energy: 1.6318227052722063
Energy: 1.624328070202132
Energy: 1.326079625350831
Energy: 1.3312137919105476
Energy: 1.5194526982450653
Energy: 1.4509085879666441
Energy: 1.3873160490485323
Energy: 1.3925673451259923
Energy: 1.2916615424708284
Energy: 1.26498366710346
Energy: 1.3289615873724172
Energy: 1.327570811929143
Energy: 1.3263924996130692
Energy: 1.363251896098921
Energy: 1.3609766251040656
Energy: 1.3939782202620583
Energy: 1.4078199000033131
Energy: 1.4338557269414438
Energy: 1.5224347439457544
Energy: 1.577547070208752
Energy: 1.6239997024280228
Energy: 1.5067030797989442
Energy: 1.5085726062795253
Energy: 1.516652920647618
Energy: 1.3617572942058866
Energy: 1.3632833667430881
Energy: 1.3612513579164385
Energy: 1.3686880878674013
Energy: 1.3382885507047881
Energy: 1.4988302121785722
Energy: 1.524879049505882
Energy: 1.5889739156453582
Energy: 1.4781038810861031
Energy: 1.585452849865058
Energy: 1.6140673966875259
Energy: 1.38582012229801
Energy: 1.4041054481672417
Energy: 1.3951481322674308
Energy: 1.3372127342878337
Energy: 1.3383076601262072
Energy: 1.351038765166366
Energy: 1.307820738629137

minimum gb energy = 1.2641858516538738 eV
minimum distance =  2.26167545063939 Angstroms
sigma value = 33


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

Energy: 1.6601631996815018
Energy: 1.3564969255189607
Energy: 1.3553857864768726
Energy: 1.3687515225342577
Energy: 1.4755629932856573
Energy: 1.5510724886232965
Energy: 1.5481130652282276
Energy: 1.4945594898251278
Energy: 1.355405685662748
Energy: 1.3572532995485058
Energy: 1.327337597442967
Energy: 1.5366506310795367
Energy: 1.4503146099022726
Energy: 1.4857425661706793
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Energy: 1.3494636016336046
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Energy: 1.3570941213216772
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Energy: 1.4061432395207634
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Energy: 1.5917581450147584
Energy: 1.498931889430494
Energy: 1.3554282719454953
Energy: 1.3385267583785232
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Energy: 1.433232456587376
Energy: 1.4811988146033244
Energy: 1.4854567553790472
Energy: 1.4268171648334502
Energy: 1.3509373694164486
Energy: 1.3614170520200441
Energy: 1.3675507373492528
Energy: 1.3647595834238502
Energy: 1.337345144968748
Energy: 1.335842031929022
Energy: 1.4834889500215813
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Energy: 1.3531667640916147
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Energy: 1.3477250061306754
Energy: 1.3555885311906108
Energy: 1.487052613739071
Energy: 1.5468194818488887
Energy: 1.5065726788315925
Energy: 1.3503372260403457
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Energy: 1.3430472079062616
Energy: 1.3487982325545609
Energy: 1.357477427755361
Energy: 1.363093511231164
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Energy: 1.4759558126905983
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Energy: 1.3420796044013346
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Energy: 1.4785286258463948
Energy: 1.54829458373473
Energy: 1.4675890547073391
Energy: 1.361192149934337
Energy: 1.3572221644333433

minimum gb energy = 1.3207235481460569 eV
minimum distance =  2.28548217554629 Angstroms
sigma value = 219


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

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Energy: 1.3091247552224548
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Energy: 1.319220013403633
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Energy: 1.518488451044237
Energy: 1.5437809890491483
Energy: 1.29614430809594
Energy: 1.267963341735504
Energy: 1.2724876599871133
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Energy: 1.3082008711135078
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Energy: 1.39204394043538
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Energy: 1.4971952844572696
Energy: 1.3918206642172928
Energy: 1.3937072110085285
Energy: 1.5071840958710052
Energy: 1.3697755745183902

minimum gb energy = 1.267963341735504 eV
minimum distance =  2.35081099222388 Angstroms
sigma value = 15


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

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Energy: 1.5098151897009362
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Energy: 1.4997066794428613
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minimum gb energy = 1.4416651317694928 eV
minimum distance =  2.27369330345967 Angstroms
sigma value = 293


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

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Energy: 1.555249331777912
Energy: 1.5493953152213586
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Energy: 1.494067224799333
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Energy: 1.5739725477519402
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Energy: 1.486209276295231
Energy: 1.51526025563635
Energy: 1.57463014388315
Energy: 1.5428833969730849
Energy: 1.467655909756501
Energy: 1.531693527558884
Energy: 1.490821814833367
Energy: 1.4909002280195576
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Energy: 1.469664297765715
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Energy: 1.5495472160668269
Energy: 1.4524144225883964
Energy: 1.4794898703088257
Energy: 1.5509648006330097
Energy: 1.7420842684686118
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Energy: 1.5010393693285633
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Energy: 1.5562728884719923
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Energy: 1.493153998470579
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Energy: 1.4831092606938745
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Energy: 1.506216840168631
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Energy: 1.4721657537158537
Energy: 1.527648000215394
Energy: 1.5436456296703243
Energy: 1.5210646301377073
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Energy: 1.632033751837355
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Energy: 1.503901128633096
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Energy: 1.4699770286062308
Energy: 1.5208440164739936
Energy: 1.6166664182063637
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Energy: 1.48354673425308
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Energy: 1.5085778607008282
Energy: 1.4524265996633245
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Energy: 1.552955193046326
Energy: 1.4933441149328999
Energy: 1.504247317240124
Energy: 1.5041237679698358
Energy: 1.5102205871017296
Energy: 1.5408921913976406
Energy: 1.4940241690975309
Energy: 1.5717840317389942
Energy: 1.5397803258617666
Energy: 1.5097918088333093
Energy: 1.551186225281474
Energy: 1.5658153624009976
Energy: 1.4848681591808488
Energy: 1.5774998165951528
Energy: 1.5784465317472574
Energy: 1.4932988386599282
Energy: 1.5076831622560198
Energy: 1.5363647423608597
Energy: 1.541181801726476
Energy: 1.5224134148785613
Energy: 1.5427932867637701
Energy: 1.5223668160795527
Energy: 1.5463515789241757
Energy: 1.6125263634202305
Energy: 1.5723273434425875
Energy: 1.5020936258320028
Energy: 1.519496633717943
Energy: 1.5022331137770786
Energy: 1.636047798861277
Energy: 1.5709619590555701
Energy: 1.5279685529028333
Energy: 1.5556713611414819
Energy: 1.5283005026126204
Energy: 1.5121624245121132
Energy: 1.5410391413518454
Energy: 1.5732384232507954
Energy: 1.5536042144265874
Energy: 1.6521924850064982
Energy: 1.5593196296155125
Energy: 1.485398912159206
Energy: 1.451563358130125
Energy: 1.5167115054129894
Energy: 1.5288855475110377
Energy: 1.616514954185857
Energy: 1.489302604145637
Energy: 1.4746577715126812
Energy: 1.5079930479721844
Energy: 1.5404747428528198
Energy: 1.4995097027156026
Energy: 1.57225304235414
Energy: 1.4637391957151067
Energy: 1.4515956553095808
Energy: 1.512400923564426
Energy: 1.4528364109343268
Energy: 1.506073050645176
Energy: 1.492344119000692
Energy: 1.5081369533378106
Energy: 1.4943863987089159
Energy: 1.577710517260625
Energy: 1.6361026395992655
Energy: 1.5534390304946633
Energy: 1.5314162015876212
Energy: 1.5200512244151532
Energy: 1.4516587825220417
Energy: 1.4701342948487266
Energy: 1.4917005258241995
Energy: 1.5294351686591474
Energy: 1.5504714614696964
Energy: 1.5757970259119987
Energy: 1.5497316148840894
Energy: 1.4550828560171702
Energy: 1.5337469189040907
Energy: 1.5666429455019124
Energy: 1.4533397838272937
Energy: 1.4686233736419563
Energy: 1.4691194215975605
Energy: 1.5208221179391073
Energy: 1.495826530398382
Energy: 1.543740922616275
Energy: 1.5280381716151517

minimum gb energy = 1.4296850159404357 eV
minimum distance =  2.26508724924212 Angstroms
sigma value = 293


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

Energy: 1.7615219224952945
Energy: 1.5891595037014725
Energy: 1.3288431030252505
Energy: 1.325809290725903
Energy: 1.3287481929763745
Energy: 1.5236505438751722
Energy: 1.3286674203978321
Energy: 1.3503315869923567
Energy: 1.3286570747596735
Energy: 1.584649307038093
Energy: 1.2235598933819152
Energy: 1.3298661720736258
Energy: 1.424049752636247
Energy: 1.4027364313211304
Energy: 1.3298714524561246
Energy: 1.3233787567313808
Energy: 1.3498924350673382
Energy: 1.4274168322253447
Energy: 1.3308197306251897
Energy: 1.3279206805166783
Energy: 1.5192048576783697
Energy: 1.4320475645839776
Energy: 1.327899426447348
Energy: 1.3281666588848264
Energy: 1.424364037531088
Energy: 1.4245878824792697
Energy: 1.4297365528622277
Energy: 1.3486471408687584
Energy: 1.3326495861847563
Energy: 1.3288280480740122
Energy: 1.3269170663217082
Energy: 1.3717019164694566
Energy: 1.2267886523621485
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Energy: 1.3310796192184737
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Energy: 1.3286524987507957
Energy: 1.2190334225092696
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Energy: 1.3279257885392113
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Energy: 1.3287858224247937
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Energy: 1.3243275253693223
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Energy: 1.3529504864939923
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Energy: 1.3312826565932685
Energy: 1.3310581513381188
Energy: 1.4310665453020128
Energy: 1.349537857207011
Energy: 1.4228683581997168
Energy: 1.5226315999205178
Energy: 1.3582444307188446
Energy: 1.3241370172923146
Energy: 1.520470398292249
Energy: 1.5231986883063997
Energy: 1.4238458308948367
Energy: 1.3287192030769626
Energy: 1.3219530527222878
Energy: 1.2215289946412071
Energy: 1.3251209436319673
Energy: 1.3262764601100474
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Energy: 1.5807104708041966
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Energy: 1.4925331786203186
Energy: 1.328068938309365
Energy: 1.3282631935833609
Energy: 1.4292297681015085
Energy: 1.3503320053863548
Energy: 1.4310075041364654
Energy: 1.426908247696893
Energy: 1.2240977444908694
Energy: 1.351116434185335
Energy: 1.3280492901938514
Energy: 1.428839103209134
Energy: 1.428727441038165
Energy: 1.3279572234914987
Energy: 1.327219281975359
Energy: 1.349140821442832
Energy: 1.3302980438736145
Energy: 1.3278756482271914
Energy: 1.3276534166455884
Energy: 1.4280497199928028
Energy: 1.54024623017245
Energy: 1.3279897983988358
Energy: 1.4253857913849823
Energy: 1.4278994893811392
Energy: 1.430915924657835
Energy: 1.3221490844919335
Energy: 1.3280048179167563
Energy: 1.2242043748643041
Energy: 1.4247975718544716
Energy: 1.3326085548095339
Energy: 1.2228031002321351
Energy: 1.4252305118371145
Energy: 1.522494348525127
Energy: 1.5182373859262372
Energy: 1.326649457168797
Energy: 1.5238738874996012
Energy: 1.3283418751027305
Energy: 1.349281176321751
Energy: 1.3294948989740758
Energy: 1.5828292697642299
Energy: 1.5829976291246681
Energy: 1.441539575654552
Energy: 1.3287086990902062
Energy: 1.3517784556035108
Energy: 1.4267909817706652
Energy: 1.3216853488891334
Energy: 1.3530766805229573
Energy: 1.4267279487087217
Energy: 1.4277529278782741
Energy: 1.3274680714843459
Energy: 1.352507403347318
Energy: 1.3299646081785794
Energy: 1.4235347805196719
Energy: 1.401536665758323
Energy: 1.3297158947513832
Energy: 1.4270617073214718
Energy: 1.4307602191396018
Energy: 1.3467181257778138
Energy: 1.3505887737535436
Energy: 1.3294580007348962
Energy: 1.5208090460351376
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Energy: 1.3275045174155622
Energy: 1.3277094794637336
Energy: 1.4233324417340818
Energy: 1.5222314080818473
Energy: 1.3249395243565634
Energy: 1.3295804987766002
Energy: 1.2194479203420066
Energy: 1.3292600049548169
Energy: 1.3261348237826773
Energy: 1.3714620106454094
Energy: 1.58846868634676
Energy: 1.4273169388647688
Energy: 1.4298640997900198
Energy: 1.3298410722798224
Energy: 1.4225812664243846
Energy: 1.3299860295744077
Energy: 1.3518065415208866
Energy: 1.35143311775679
Energy: 1.327565965420774
Energy: 1.5821584717730086
Energy: 1.3712478365452772
Energy: 1.3232083226014077
Energy: 1.3294210948888368
Energy: 1.3269953171607518
Energy: 1.3290249168991943
Energy: 1.333183625042868
Energy: 1.4287930146597803
Energy: 1.4310643803200778
Energy: 1.330197166964155
Energy: 1.3261049105205225
Energy: 1.4283321753586353
Energy: 1.5435417757666818
Energy: 1.42632194918604
Energy: 1.5221413742501977
Energy: 1.5245430810149037
Energy: 1.42491422429046
Energy: 1.3268100380646128
Energy: 1.3220206412987388
Energy: 1.351542044811983
Energy: 1.4201400495340224
Energy: 1.5223961159883603
Energy: 1.3532812030510186
Energy: 1.32649967709427
Energy: 1.4262869835818643
Energy: 1.4271188409654691
Energy: 1.329017069366432
Energy: 1.3282781269736461
Energy: 1.4298839234989837
Energy: 1.3481761548203754
Energy: 1.32753750634499
Energy: 1.327032203072942
Energy: 1.3714303999208604
Energy: 1.5792202655492384
Energy: 1.3293957802816854
Energy: 1.4280472225896277
Energy: 1.402976759820207
Energy: 1.3274250300183652
Energy: 1.3221948044045404
Energy: 1.3527507092044317
Energy: 1.4268912865304308
Energy: 1.423382972371643
Energy: 1.2249661957042743
Energy: 1.3555295619897945
Energy: 1.5422696693708746
Energy: 1.3280772735478044
Energy: 1.4934660566210851
Energy: 1.4277642084217945
Energy: 1.4287927728711425
Energy: 1.347525762237817
Energy: 1.329839575720731
Energy: 1.32712152491976
Energy: 1.427116576548239
Energy: 1.5409918672649123
Energy: 1.2219696639643842
Energy: 1.4255652080798462
Energy: 1.5213082456776745
Energy: 1.5198254799925848
Energy: 1.3264566166801484
Energy: 1.322884381099607
Energy: 1.3289369776844355
Energy: 1.4242358228719292
Energy: 1.4286873672238847
Energy: 1.3344995727509237

minimum gb energy = 1.2190334225092696 eV
minimum distance =  2.35793646584316 Angstroms
sigma value = 15


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

Energy: 1.7077751668237293
Energy: 1.4647134209341794
Energy: 1.477058880984689
Energy: 1.454422472784202
Energy: 1.4367624911245562
Energy: 1.4626010280507191
Energy: 1.4367700350303731
Energy: 1.4346361331624404
Energy: 1.4722053164078233
Energy: 1.4949794629806468
Energy: 1.481651318724016
Energy: 1.5629978300632905
Energy: 1.473006363552584
Energy: 1.436277814751993
Energy: 1.4789770931064434
Energy: 1.4670225409497144
Energy: 1.420733070336776
Energy: 1.4239449585243764
Energy: 1.4241201000150496
Energy: 1.5518183616145715
Energy: 1.5151823708100556
Energy: 1.5103484357562456
Energy: 1.5193846130240154
Energy: 1.4434414690978044
Energy: 1.4751362859768695
Energy: 1.4545582147950538
Energy: 1.4229337074020822
Energy: 1.4408007934280875
Energy: 1.4510686949793872
Energy: 1.544943568060286
Energy: 1.471349168067438
Energy: 1.5515737783138568
Energy: 1.5013723189474424
Energy: 1.4586110327295787
Energy: 1.4569450217425375
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Energy: 1.4772204300975058
Energy: 1.4705237905659252
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Energy: 1.631381589679876
Energy: 1.4400483641752755
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Energy: 1.4299029100281873
Energy: 1.4719736622449613
Energy: 1.4851881278529455
Energy: 1.4589457936233075
Energy: 1.6244161700958992
Energy: 1.5464913374067026
Energy: 1.50784168792745
Energy: 1.4441653196146498
Energy: 1.4935996380505894
Energy: 1.5626186803234197
Energy: 1.5156246951864696
Energy: 1.5229195450512492
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Energy: 1.5070569480376166
Energy: 1.4685994906366457
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Energy: 1.5091971260338493
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Energy: 1.5209213761532616
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Energy: 1.4027453644998809
Energy: 1.4859229395150486
Energy: 1.4842463597223559
Energy: 1.4300105598157284
Energy: 1.573699577366986
Energy: 1.4945063655134136
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Energy: 1.472004833642557
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Energy: 1.523683193128236
Energy: 1.507927167011094
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Energy: 1.508071171319091
Energy: 1.5342745809052682
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Energy: 1.5245169939175542
Energy: 1.45919003002092
Energy: 1.5616881680319101
Energy: 1.5146636304453152
Energy: 1.4619093849900258
Energy: 1.5186950452959018
Energy: 1.5202385569486576
Energy: 1.471415400863428
Energy: 1.507226846444362
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Energy: 1.4762961903605636
Energy: 1.465881488341453
Energy: 1.621813665779291
Energy: 1.4702578181010635
Energy: 1.4783303704090578
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Energy: 1.4360442467045904
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Energy: 1.5213447151506114
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Energy: 1.6246163289474422
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Energy: 1.460752047540994
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Energy: 1.572050983586216
Energy: 1.5430746609688057
Energy: 1.4718661951206493
Energy: 1.6307312651047106
Energy: 1.4683033073689686
Energy: 1.4700194129208237
Energy: 1.4749643770043088
Energy: 1.472474952043058
Energy: 1.4564851531225
Energy: 1.454937346098831
Energy: 1.560820990613998
Energy: 1.587371041023559
Energy: 1.5160237702016248
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Energy: 1.4506248905687762
Energy: 1.431910726244756
Energy: 1.422795169111475
Energy: 1.4550142953584626
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Energy: 1.4933151455189941
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Energy: 1.4230780137148265
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Energy: 1.4816897302571834
Energy: 1.4452322128472284
Energy: 1.4717652490164956
Energy: 1.4603699565783683
Energy: 1.5733604717138514
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Energy: 1.4654712460742605
Energy: 1.4345959964155608
Energy: 1.4264033940890943
Energy: 1.4321657272774642
Energy: 1.4367209999227115
Energy: 1.432316099174308
Energy: 1.4611728517751879
Energy: 1.5509773529298196
Energy: 1.552741795508661
Energy: 1.508499143991943
Energy: 1.4776862173353704
Energy: 1.4268699778777532
Energy: 1.434470829301369
Energy: 1.4650327351238657
Energy: 1.4382486108657642
Energy: 1.4506559147763103
Energy: 1.4406007684721178
Energy: 1.5505787658991672
Energy: 1.5552024841716616
Energy: 1.5096100477729182
Energy: 1.4982094070246026
Energy: 1.4614519478943122
Energy: 1.4334366755466303
Energy: 1.481609797044503
Energy: 1.4864930162209236
Energy: 1.4984846076579221
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Energy: 1.4785744267340246
Energy: 1.4988625647553666
Energy: 1.514314588802781
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Energy: 1.4592714035824075
Energy: 1.4413072450646227
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Energy: 1.4927017363571062
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Energy: 1.5534345195445478
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Energy: 1.5101742858364589
Energy: 1.5518613200197977
Energy: 1.46578068041079
Energy: 1.4720992879477706
Energy: 1.572377799272078
Energy: 1.5742863146352395
Energy: 1.4988800665765216
Energy: 1.4643439009662884
Energy: 1.5142483879827704
Energy: 1.4413917790065636
Energy: 1.4365130336172367
Energy: 1.54871437120747
Energy: 1.4666719389770762
Energy: 1.5697375118403354
Energy: 1.464157314562633
Energy: 1.490723531657945
Energy: 1.5099714789220384
Energy: 1.5507720996497538
Energy: 1.5637382526329746
Energy: 1.4790307978279758
Energy: 1.470677624611234
Energy: 1.6301268198621277
Energy: 1.4984353297083783
Energy: 1.4923535770280272
Energy: 1.4887181494642137
Energy: 1.4878667508766512
Energy: 1.4352194076034592
Energy: 1.495673564875639
Energy: 1.583383145506115
Energy: 1.5528421483166657
Energy: 1.5500325965099402
Energy: 1.4352240507344487
Energy: 1.4514353301389813
Energy: 1.4864697561870692
Energy: 1.4656521891524714
Energy: 1.4332721059390612
Energy: 1.4266896008473355
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Energy: 1.5039726017625314
Energy: 1.5510222372925104
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Energy: 1.4634508804703696
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Energy: 1.449760208139318
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Energy: 1.4329066290989305
Energy: 1.4649292505509834
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Energy: 1.4593680613190756
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Energy: 1.4545368127600504
Energy: 1.4369867808506127
Energy: 1.4669056131144564
Energy: 1.4322616047199226
Energy: 1.422828635814964
Energy: 1.4228833189756638
Energy: 1.553388752669638
Energy: 1.3998354583036419
Energy: 1.4619289273792138
Energy: 1.474772455423233
Energy: 1.4253072011412755
Energy: 1.4823164084061586
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Energy: 1.4237468276601237
Energy: 1.4322266489656363
Energy: 1.4513050754013799
Energy: 1.5615217831330372
Energy: 1.5188024945538583
Energy: 1.5243322086791253
Energy: 1.560506481365952
Energy: 1.45672549809479
Energy: 1.474664449647117
Energy: 1.4667666361469491
Energy: 1.475346857351667
Energy: 1.470090160647808
Energy: 1.403402254571306
Energy: 1.6323721164175768
Energy: 1.5987809215262372
Energy: 1.561223930188723
Energy: 1.579350459014794
Energy: 1.5370171830207087
Energy: 1.4560789201960962
Energy: 1.4645612697381365
Energy: 1.62425828227479
Energy: 1.5343356835179656
Energy: 1.5072477899550047
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Energy: 1.4349375323093865
Energy: 1.5712400101466466
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Energy: 1.4713273678907954
Energy: 1.4608044446443724
Energy: 1.4634868610370533
Energy: 1.4769669798985348
Energy: 1.469431543433895
Energy: 1.5081321112911668
Energy: 1.4673406294853968
Energy: 1.531615850818256
Energy: 1.562428203443245
Energy: 1.5163721436746211
Energy: 1.5152683063710506
Energy: 1.6235909394845638
Energy: 1.457256411271267
Energy: 1.5242318534771135
Energy: 1.5252938734262962
Energy: 1.5299495149934739
Energy: 1.5105626145225108
Energy: 1.4595672098435246
Energy: 1.5430855701519806
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Energy: 1.5619466159939241
Energy: 1.4953523400361488
Energy: 1.5003470296759438
Energy: 1.476932307638396
Energy: 1.497376297789811
Energy: 1.520211071433498
Energy: 1.4564001146649124
Energy: 1.4850155349853984
Energy: 1.4842751777327354
Energy: 1.429114270266678
Energy: 1.4928343626946181
Energy: 1.4963429511597899
Energy: 1.5244418871574223
Energy: 1.5246546154148186
Energy: 1.4598145020742503
Energy: 1.5608562328406825
Energy: 1.5249159474478569
Energy: 1.5094392581218028
Energy: 1.5112906707865195
Energy: 1.5296044279201884
Energy: 1.525157022195349
Energy: 1.5069229835966402
Energy: 1.5476518804942478
Energy: 1.4762372495714182
Energy: 1.466997386430991
Energy: 1.5805553172229292
Energy: 1.5158034573887835
Energy: 1.5104572840207346
Energy: 1.5190892248322885
Energy: 1.521043976803327
Energy: 1.511313795582635
Energy: 1.5279997813991322
Energy: 1.545952854006305
Energy: 1.6260073741858996
Energy: 1.6243871382928559
Energy: 1.4972066039828729
Energy: 1.4713078947480205
Energy: 1.4692239165088872
Energy: 1.5163758049514933
Energy: 1.4402362019712005
Energy: 1.4451436340588435
Energy: 1.433436549605086
Energy: 1.631693629892442
Energy: 1.4833196028816382
Energy: 1.467186051117724
Energy: 1.4582824414158042
Energy: 1.4579147799006364
Energy: 1.5932425283861307
Energy: 1.5424180214050964
Energy: 1.4724407568287587
Energy: 1.6319508745675857
Energy: 1.4507001123909804
Energy: 1.439530863917893
Energy: 1.4364431530738013
Energy: 1.4544914184247293
Energy: 1.4746876036130818
Energy: 1.4561149930622885
Energy: 1.5629910435178391
Energy: 1.7035797043611969
Energy: 1.5192126316564096
Energy: 1.5451765476677966
Energy: 1.462011309463846
Energy: 1.422882534839816
Energy: 1.4201682869237622
Energy: 1.4676384230441055
Energy: 1.4845856114460372
Energy: 1.4023029060194794
Energy: 1.4715807954004512
Energy: 1.4759782606215863
Energy: 1.5215465206600114
Energy: 1.550112769926267
Energy: 1.4645123937692328
Energy: 1.4344364232918074
Energy: 1.4344100770131065
Energy: 1.4778101567061113
Energy: 1.4595349985138755
Energy: 1.4607361811101676
Energy: 1.4821943810103337
Energy: 1.4717126566244598
Energy: 1.5686611361190765
Energy: 1.4601283341938809
Energy: 1.5016269740446433
Energy: 1.425544305648976
Energy: 1.434463967481794
Energy: 1.4665366706726102
Energy: 1.4377084963338644
Energy: 1.4345328262803951
Energy: 1.4539659396836235
Energy: 1.5508637915982193
Energy: 1.4964711394674948
Energy: 1.5179612846449875
Energy: 1.4963515500169762
Energy: 1.4863232574537324
Energy: 1.4293608934352862
Energy: 1.4813818465691433
Energy: 1.4872560686723104
Energy: 1.4501310489630272
Energy: 1.4362958845486689
Energy: 1.5496810585673866
Energy: 1.5143541016027042
Energy: 1.5165039506685056
Energy: 1.4294912237558568
Energy: 1.4954384276589265
Energy: 1.4891644508602677
Energy: 1.4875467298572047
Energy: 1.4925593202773273
Energy: 1.4976730769735906
Energy: 1.657143897802668
Energy: 1.6569925710443547
Energy: 1.4978561450657455
Energy: 1.5507314503329475
Energy: 1.427881345280597
Energy: 1.479317735144726
Energy: 1.477110025749931
Energy: 1.4732440047209436
Energy: 1.5688045407910123
Energy: 1.5208140865972073
Energy: 1.5576355690092967
Energy: 1.4357432158815635
Energy: 1.4507065628726412
Energy: 1.509491988751766
Energy: 1.4517336565323253
Energy: 1.5544722919675436
Energy: 1.5522781126450715
Energy: 1.518637109294718
Energy: 1.4726504367519107
Energy: 1.4649380241276793
Energy: 1.5478758576120226
Energy: 1.5549348606671476
Energy: 1.5064082123814275
Energy: 1.588806755928825
Energy: 1.4419176577175037
Energy: 1.437095306087454
Energy: 1.5520805969965528
Energy: 1.4669226855342865
Energy: 1.570292294337863
Energy: 1.5717343510892443
Energy: 1.5796415287512224
Energy: 1.5510355222534715
Energy: 1.4933003443183115
Energy: 1.5876962535264436
Energy: 1.4775959820642253
Energy: 1.4711142674525268
Energy: 1.544120338787833
Energy: 1.4990651921408347
Energy: 1.4684487963277162
Energy: 1.4687721096575492
Energy: 1.5053423096339373
Energy: 1.453427116081569
Energy: 1.5700108614176314
Energy: 1.4792737634677227
Energy: 1.551910610825242
Energy: 1.5461479395672815
Energy: 1.4353723700226442
Energy: 1.4721684392310754
Energy: 1.4864284871297448
Energy: 1.4888112583553985
Energy: 1.4873301002609007
Energy: 1.4629639199378819
Energy: 1.4982907795744087
Energy: 1.5533755993690566
Energy: 1.51912005462741
Energy: 1.5508457662354465
Energy: 1.4620212057024002
Energy: 1.4350613533257748
Energy: 1.4388006919003506
Energy: 1.4640522711544515
Energy: 1.4341951967029642
Energy: 1.4365569168487775
Energy: 1.4880598561765512
Energy: 1.5094715655646969
Energy: 1.4553360327512757
Energy: 1.4551539955224855
Energy: 1.4746844143366193
Energy: 1.454501123013244
Energy: 1.4369836390832278
Energy: 1.4696671879141814
Energy: 1.425975474682488
Energy: 1.434518110119637
Energy: 1.466279889193556
Energy: 1.4723387963922943

minimum gb energy = 1.3985237020920946 eV
minimum distance =  2.28657850104202 Angstroms
sigma value = 437


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

Energy: 1.7371249644211355
Energy: 1.5363394811517983
Energy: 1.4699958758426046
Energy: 1.4910119124961376
Energy: 1.512906258024636
Energy: 1.5134829470842972
Energy: 1.5378181377586324
Energy: 1.5040134782396588
Energy: 1.4989188592903195
Energy: 1.5358248668824457
Energy: 1.5348081133283697
Energy: 1.402556126568053
Energy: 1.5532182707759683
Energy: 1.5033213301772521
Energy: 1.5022151885704074
Energy: 1.4548903947283651
Energy: 1.5078410614813986
Energy: 1.5094591604676306
Energy: 1.5005485041210855
Energy: 1.405096895467845
Energy: 1.504594682086226
Energy: 1.559783323065442
Energy: 1.403493104778691
Energy: 1.49633327795653
Energy: 1.464008260284364
Energy: 1.501402794504428
Energy: 1.514275435771303
Energy: 1.5009662016678658
Energy: 1.4245595270839893
Energy: 1.5381816279922267
Energy: 1.5198349524638666
Energy: 1.5672809296335064
Energy: 1.5247236586578907
Energy: 1.4943699078128336
Energy: 1.511862159300512
Energy: 1.468111198484433
Energy: 1.4663338981856457
Energy: 1.5248152044646828
Energy: 1.4309064348694613
Energy: 1.434265611683335
Energy: 1.5057845132623364
Energy: 1.4576323476784487
Energy: 1.4580705113186145
Energy: 1.5247269312869782
Energy: 1.5369888137759553
Energy: 1.4632004260119387
Energy: 1.4652881479498532
Energy: 1.5376297465140158
Energy: 1.4155279785466155
Energy: 1.4359996429672324
Energy: 1.4035762891268329
Energy: 1.40249786184318
Energy: 1.4194975707077973
Energy: 1.692501002525346
Energy: 1.4647873899867765
Energy: 1.4651820036922845
Energy: 1.518565916156022
Energy: 1.568357857723955
Energy: 1.4045649059983807
Energy: 1.4055079122905842
Energy: 1.4038284739786178
Energy: 1.4029207442125815
Energy: 1.4301456954021632
Energy: 1.5028555422392011
Energy: 1.4650780279541347
Energy: 1.417832834772574
Energy: 1.477927362379022
Energy: 1.4637123612991476
Energy: 1.4031699253787617
Energy: 1.4333910676133514
Energy: 1.4033692630964874
Energy: 1.4029807966995012
Energy: 1.4027125104762928
Energy: 1.5119225101357068
Energy: 1.4304540978316196
Energy: 1.4627957460672465
Energy: 1.561611080787282
Energy: 1.5321424612375538
Energy: 1.4799490657101697
Energy: 1.4036330669915018
Energy: 1.513427649180383
Energy: 1.4023087784118717
Energy: 1.433428152106493
Energy: 1.6723570043768536
Energy: 1.469445633894755
Energy: 1.4656078587616268
Energy: 1.538299075610307
Energy: 1.536515358274075
Energy: 1.4260520145655307
Energy: 1.403074419195154
Energy: 1.499603483439348
Energy: 1.4189863649401215
Energy: 1.4162501678639066
Energy: 1.5083485440959008
Energy: 1.4952441385646094
Energy: 1.4950610136945892
Energy: 1.4962768568279297
Energy: 1.5024812863753765
Energy: 1.4845483543350062
Energy: 1.5393404571659268
Energy: 1.5061027701300052
Energy: 1.4591647463098862
Energy: 1.4598354020773
Energy: 1.4974858320134339
Energy: 1.4828644314145196
Energy: 1.4650242558844089
Energy: 1.4612029953256862
Energy: 1.5012100149882905
Energy: 1.5090115718934902
Energy: 1.550800269564915
Energy: 1.5421510363127326
Energy: 1.5440001080641126
Energy: 1.451092895426558
Energy: 1.500171327569001
Energy: 1.4619678987151057
Energy: 1.4732125131871987
Energy: 1.4803452345199755
Energy: 1.5068556532137938
Energy: 1.4148197931370565
Energy: 1.5617336583314052
Energy: 1.4942628315003557
Energy: 1.404856070426615
Energy: 1.404903515277784
Energy: 1.6541162966631673
Energy: 1.4976479921778447
Energy: 1.4644513791087643
Energy: 1.506088445695453
Energy: 1.537232823852353
Energy: 1.4214130181789826
Energy: 1.4233452743709862
Energy: 1.6501103875233325
Energy: 1.471959015951727
Energy: 1.472083758095657
Energy: 1.4918614596690618
Energy: 1.4996609958982574
Energy: 1.4583679497793585
Energy: 1.5387419386559607
Energy: 1.5051547278447766
Energy: 1.4566717236225675
Energy: 1.5348415025013764

minimum gb energy = 1.4023087784118717 eV
minimum distance =  2.29828070432363 Angstroms
sigma value = 33