Model name: model_name=EAM_Dynamo_SongMendelev_2021_AlSm__MO_722733117926_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.044527357816695
cohesive_energy=3.312098846316254
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: 0.010233464173542307
Energy: 0.39913327382855684
Energy: 0.010233464173542307
Energy: 0.39913327382855684
Energy: 0.010233464173542307
Energy: 0.3991332738288075
Energy: 0.3991332738283064
Energy: 0.47213252125666105
Energy: 0.3991332738283064
Energy: 0.6513717888741715
Energy: 0.3991332738288075
Energy: 0.40832956598045
Energy: 0.010233464173542307
Energy: 0.39913327382855684
Energy: 0.010233464173542307
Energy: 0.3991332738288075
Energy: 0.010233464173542307
Energy: 0.39913327382855684
Energy: 0.39913327382855684
Energy: 0.6513717888746446
Energy: 0.3991332738283064
Energy: 0.5629860945734178
Energy: 0.39913327382855684
Energy: 0.40832956598045
Energy: 0.010233464173542307
Energy: 0.3991332738283064
Energy: 0.010233464173542307
Energy: 0.3991332738280558
Energy: 0.010233464173542307
Energy: 0.3991332738283064
Energy: 0.3991332738288075
Energy: 0.40832956597969844
Energy: 0.39913327382855684
Energy: 0.40832956597969844
Energy: 0.3991332738288075
Energy: 0.40832956597994896

minimum gb energy = 0.010233464173542307 eV
minimum distance =  2.58436268030842 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 0.482238638729294
Energy: 0.5063426685047846
Energy: 0.482238638729294
Energy: 0.5063426685053877
Energy: 0.482238638729294
Energy: 0.5063426685053877
Energy: 0.5567555544558194
Energy: 0.5058165382917855
Energy: 0.556755554460041
Energy: 0.5058165382923887
Energy: 0.5567555544594378
Energy: 0.5058165382923887
Energy: 0.46618477667070113
Energy: 0.5105223676401955
Energy: 0.46618477667070113
Energy: 0.5105223676401955
Energy: 0.46618477667130415
Energy: 0.5105223676395924
Energy: 0.5451834391822806
Energy: 0.5023248217555649
Energy: 0.5451834391834867
Energy: 0.5023248217543588
Energy: 0.5451834391828836
Energy: 0.5023248217549618
Energy: 0.47953011317142813
Energy: 0.5118190884222572
Energy: 0.47953011317082506
Energy: 0.5118190884228603
Energy: 0.47953011317203115
Energy: 0.5118190884234634
Energy: 0.510891575447325
Energy: 0.47200456897883586
Energy: 0.5108915754467219
Energy: 0.472004568980042
Energy: 0.5108915754467219
Energy: 0.47200456897943893
Energy: 0.49050696500182955
Energy: 0.4693901986634998
Energy: 0.49068718659356436
Energy: 0.4693901986634998
Energy: 0.47492300162150525
Energy: 0.4693901986665152
Energy: 0.4909442731284209
Energy: 0.501572791302262
Energy: 0.49094427312902406
Energy: 0.501572791302262
Energy: 0.49094427312962713
Energy: 0.501572791302262
Energy: 0.5176741320007578
Energy: 0.4728526298408764
Energy: 0.5176741319989487
Energy: 0.4728526298390672
Energy: 0.5176741319989487
Energy: 0.4728526298390672
Energy: 0.48812193259143966
Energy: 0.491835416525892
Energy: 0.48812193259143966
Energy: 0.49183541652649504
Energy: 0.48812193259143966
Energy: 0.4918354165270981
Energy: 0.4913018132290168
Energy: 0.4715745072756473
Energy: 0.4913018132290168
Energy: 0.4715745072756473
Energy: 0.4913018132290168
Energy: 0.4715745072756473
Energy: 0.5149814590189306
Energy: 0.4872080347005891
Energy: 0.5149814590177244
Energy: 0.48720803470842894
Energy: 0.5149814590189306
Energy: 0.48720803470601676
Energy: 0.550425687136615
Energy: 0.5125200396974262
Energy: 0.5504256871360119
Energy: 0.5125200396974262
Energy: 0.5504256871372181
Energy: 0.5125200396974262
Energy: 0.4834436847547634
Energy: 0.4984920214181125
Energy: 0.4834436847547634
Energy: 0.4984920214175094
Energy: 0.48344368475416044
Energy: 0.4984920214169063
Energy: 0.5219450501066898
Energy: 0.4967964593923144
Energy: 0.5219450501060867
Energy: 0.49679645939352063
Energy: 0.5219450501060867
Energy: 0.49679645939412365
Energy: 0.5211084443744152
Energy: 0.500079430173131
Energy: 0.5211084443756214
Energy: 0.5000794301749402
Energy: 0.5211084443744152
Energy: 0.500079430173734
Energy: 0.46255632853088363
Energy: 0.4997258850266128
Energy: 0.46255632853028056
Energy: 0.4997258850266128
Energy: 0.4625563285314867
Energy: 0.4997258850272159
Energy: 0.46270164001070874
Energy: 0.4989714609119669
Energy: 0.46270164000950254
Energy: 0.49897146091015765
Energy: 0.46270164000889946
Energy: 0.4989714609065392
Energy: 0.471258024379066
Energy: 0.502021397050531
Energy: 0.49505466267478015
Energy: 0.502021397051134
Energy: 0.49505466267839854
Energy: 0.502021397050531
Energy: 0.517470344721183
Energy: 0.4732345811082444
Energy: 0.517470344721183
Energy: 0.4732345811088475
Energy: 0.5174703447205798
Energy: 0.4732345811088475
Energy: 0.5048140702006982
Energy: 0.6155407115052914
Energy: 0.5048140702013013
Energy: 0.615540711502879
Energy: 0.5048140702000952
Energy: 0.6155407115022761
Energy: 0.49732048056053313
Energy: 0.47040821905475905
Energy: 0.4973204805587239
Energy: 0.470408219054156
Energy: 0.49732048055993006
Energy: 0.470408219054156
Energy: 0.5207566283412203
Energy: 0.6410331263535933
Energy: 0.5207566283400142
Energy: 0.6410331263535933
Energy: 0.5207566283418233
Energy: 0.6410331263529903

minimum gb energy = 0.46255632853028056 eV
minimum distance =  2.58421274420383 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 0.46138342520756537
Energy: 0.48838925234239894
Energy: 0.4613834252058503
Energy: 0.48838925234239894
Energy: 0.4613834252079084
Energy: 0.4883892523427419
Energy: 0.5370313959481774
Energy: 0.4829051542163731
Energy: 0.5370313959495494
Energy: 0.4829051542160301
Energy: 0.5370313959481774
Energy: 0.4829051542163731
Energy: 0.5049973786074183
Energy: 0.4835143482715021
Energy: 0.5049973786077615
Energy: 0.4835143482711591
Energy: 0.5049973786077615
Energy: 0.4835143482715021
Energy: 0.5069696348738479
Energy: 0.5061240974274707
Energy: 0.5069696348731618
Energy: 0.5061240974271276
Energy: 0.5069696348800223
Energy: 0.5061240974271276
Energy: 0.4823237724666441
Energy: 0.5229596524294519
Energy: 0.48232377246733016
Energy: 0.5229596524311669
Energy: 0.4823237724666441
Energy: 0.522959652430824
Energy: 0.48391203179353115
Energy: 0.5006688057456652
Energy: 0.48391203179353115
Energy: 0.5006688057456652
Energy: 0.4839120317955893
Energy: 0.5006688057446361
Energy: 0.4888927440531006
Energy: 0.4619236544534222
Energy: 0.48889274405721694
Energy: 0.46192365445479433
Energy: 0.4888927440548157
Energy: 0.46192365445513733
Energy: 0.503829238013253
Energy: 0.46177502917735613
Energy: 0.50382923801291
Energy: 0.46177502917769914
Energy: 0.503829238013939
Energy: 0.4617750291770131
Energy: 0.5252597435086275
Energy: 0.5017335186035763
Energy: 0.5252597435086275
Energy: 0.5017335186032333
Energy: 0.5252597435106855
Energy: 0.5017335186032333
Energy: 0.491760377358215
Energy: 0.4987717734351418
Energy: 0.4917603773564998
Energy: 0.4987717734347988
Energy: 0.491760377359244
Energy: 0.4987717734351418
Energy: 0.4986979182522475
Energy: 0.493707048505984
Energy: 0.4986979182501893
Energy: 0.493707048505984
Energy: 0.4986979182529335
Energy: 0.49370704850564107
Energy: 0.4934022449902389
Energy: 0.5247566714866903
Energy: 0.4934022449895529
Energy: 0.5247566714863472
Energy: 0.4934022449895529
Energy: 0.5247566714866903
Energy: 0.4621665613167106
Energy: 0.50213515229844
Energy: 0.4621665613163675
Energy: 0.502135152298783
Energy: 0.4621665613160245
Energy: 0.50213515229844
Energy: 0.46165695266576656
Energy: 0.48937899001888224
Energy: 0.46165695266610957
Energy: 0.48937899001956825
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Energy: 0.48937899001922525
Energy: 0.49644918832782914
Energy: 0.48411318517871393
Energy: 0.4964491883288582
Energy: 0.484113185178371
Energy: 0.4964491883333175
Energy: 0.484113185178028
Energy: 0.4942419718344221
Energy: 0.48259419144429166
Energy: 0.4942419718337361
Energy: 0.4825941914446347
Energy: 0.494241971833393
Energy: 0.4825941914446347
Energy: 0.5084957551203221
Energy: 0.5054382657715573
Energy: 0.5084957551210081
Energy: 0.5054382657729294
Energy: 0.508495755120665
Energy: 0.5054382657719003
Energy: 0.48478904849580645
Energy: 0.5008924425848887
Energy: 0.48478904849614946
Energy: 0.5008924425845458
Energy: 0.4847890484971785
Energy: 0.5008924425855749
Energy: 0.48461980362273416
Energy: 0.4962159928294744
Energy: 0.484619803620676
Energy: 0.4962159928294744
Energy: 0.484619803620676
Energy: 0.49621599282981743
Energy: 0.48966591767593126
Energy: 0.46347126373221625
Energy: 0.48966591767558826
Energy: 0.46347126373221625
Energy: 0.4896659176766173
Energy: 0.46347126373187325
Energy: 0.5010592927575115
Energy: 0.46177761629285025
Energy: 0.5010592927585406
Energy: 0.4617776163000537
Energy: 0.5010592927581976
Energy: 0.4617776163014258
Energy: 0.48418104939970286
Energy: 0.5018016098366831
Energy: 0.4841810494010749
Energy: 0.5018016098363401
Energy: 0.48418104940279
Energy: 0.5018016098370262
Energy: 0.49086253530518126
Energy: 0.5003991717525405
Energy: 0.49086253530621027
Energy: 0.5003991717525405
Energy: 0.49086253530586726
Energy: 0.5003991717504823
Energy: 0.5009839287841075
Energy: 0.4826363189218709
Energy: 0.5009839287830783
Energy: 0.4826363189229001
Energy: 0.5009839287854796
Energy: 0.482636318922557
Energy: 0.5049525153166754
Energy: 0.48431060344554633
Energy: 0.5049525153159893
Energy: 0.48431060344451726
Energy: 0.5049525153156463
Energy: 0.48431060344486027
Energy: 0.461712534473255
Energy: 0.48020056094195396
Energy: 0.461712534471883
Energy: 0.4802005609416109
Energy: 0.461712534473255
Energy: 0.48020056094195396
Energy: 0.46170532571985606
Energy: 0.4796226031953361
Energy: 0.461705325720542
Energy: 0.479622603192935
Energy: 0.46170532571985606
Energy: 0.4796226031949931
Energy: 0.504981885217556
Energy: 0.4841545283966409
Energy: 0.504981885218585
Energy: 0.4841545283966409
Energy: 0.504981885217899
Energy: 0.48415452839561185
Energy: 0.5009741161560037
Energy: 0.4826246215816063
Energy: 0.5009741161563467
Energy: 0.4826246215822924
Energy: 0.5009741161570327
Energy: 0.48262462158263536
Energy: 0.4908469333709505
Energy: 0.49965373371503347
Energy: 0.4908469333709505
Energy: 0.4996537337109171
Energy: 0.49084693337129354
Energy: 0.4996537337116032
Energy: 0.4842190172438927
Energy: 0.5017074819674314
Energy: 0.48421901724354965
Energy: 0.5017074819684605
Energy: 0.4842190172438927
Energy: 0.5017074819681174
Energy: 0.5010479685774363
Energy: 0.4617480416250016
Energy: 0.5010479685774363
Energy: 0.46174804162534466
Energy: 0.5010479685781223
Energy: 0.4617480416256876
Energy: 0.48964007348670086
Energy: 0.4634649376108583
Energy: 0.4896400734870439
Energy: 0.4634649376108583
Energy: 0.4896400734870439
Energy: 0.4634649376108583
Energy: 0.4847418361246451
Energy: 0.49598189725584846
Energy: 0.48474183612498817
Energy: 0.49598189725584846
Energy: 0.4847418361260173
Energy: 0.49598189725516245
Energy: 0.48486357155356524
Energy: 0.4942982301084467
Energy: 0.4848635715521932
Energy: 0.4942982301091328
Energy: 0.4848635715528792
Energy: 0.4942982301084467
Energy: 0.508471127211599
Energy: 0.5054341979758081
Energy: 0.508471127211599
Energy: 0.5054341979754651
Energy: 0.5084711272112561
Energy: 0.5054341979754651
Energy: 0.49432780384847985
Energy: 0.4826615778492653
Energy: 0.49432780384779385
Energy: 0.4826615778485792
Energy: 0.49432780384847985
Energy: 0.4826615778492653
Energy: 0.497332131015895
Energy: 0.48410143877396583
Energy: 0.497332131015552
Energy: 0.48410143877362277
Energy: 0.4973321310141799
Energy: 0.48410143877362277
Energy: 0.46182562722105913
Energy: 0.4894893991707014
Energy: 0.461825627219687
Energy: 0.4894893991734456
Energy: 0.4618256272207162
Energy: 0.4894893991713874
Energy: 0.46221878738292876
Energy: 0.5021168785962888
Energy: 0.46221878738224265
Energy: 0.5021168785956028
Energy: 0.46221878738258576
Energy: 0.5021168785959459
Energy: 0.4936313111787071
Energy: 0.5247253582095043
Energy: 0.4936313111797362
Energy: 0.5247253582105333
Energy: 0.4936313111804222
Energy: 0.5247253582091612

minimum gb energy = 0.4613834252058503 eV
minimum distance =  2.70557879818003 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 0.48835041787379346
Energy: 0.4926932984051425
Energy: 0.48835041787299865
Energy: 0.4926932984059373
Energy: 0.48835041787379346
Energy: 0.4926932984059373
Energy: 0.5807098509575798
Energy: 0.5007976089767538
Energy: 0.5807098509575798
Energy: 0.5007976089767538
Energy: 0.5807098509575798
Energy: 0.5007976089767538
Energy: 0.460290809093471
Energy: 0.5750890576021223
Energy: 0.4602908090926942
Energy: 0.5750890576029172
Energy: 0.4602908090926942
Energy: 0.5750890576029172
Energy: 0.4895738803778646
Energy: 0.49063723618619914
Energy: 0.4895738803778646
Energy: 0.49063723618619914
Energy: 0.4895738803778646
Energy: 0.49063723618619914
Energy: 0.5166968196323238
Energy: 0.46688747134225067
Energy: 0.5166968196315292
Energy: 0.46688747134225067
Energy: 0.5166968196315292
Energy: 0.46688747134225067
Energy: 0.5143015363403732
Energy: 0.4665303453007401
Energy: 0.5143015363388017
Energy: 0.46653034530153487
Energy: 0.5143015363388017
Energy: 0.4665303453007401
Energy: 0.5209375678336756
Energy: 0.46653209279688596
Energy: 0.5209375678336756
Energy: 0.46653209279609115
Energy: 0.5209375678328808
Energy: 0.46653209279529645
Energy: 0.47639344834818326
Energy: 0.467310981159709
Energy: 0.47639344834818326
Energy: 0.4673109811589143
Energy: 0.4763934483489781
Energy: 0.4673109811589143
Energy: 0.5719390845596483
Energy: 0.491862460924614
Energy: 0.5719390845596483
Energy: 0.491862460924614
Energy: 0.5719390845596483
Energy: 0.491862460924614
Energy: 0.4974249729434265
Energy: 0.5893819310287174
Energy: 0.4974249729434265
Energy: 0.5893819310287174
Energy: 0.4974249729434265
Energy: 0.5893819310287174
Energy: 0.50136548400239
Energy: 0.49580467810081413
Energy: 0.50136548400239
Energy: 0.49580467810081413
Energy: 0.50136548400239
Energy: 0.49580467810081413
Energy: 0.4899745253259496
Energy: 0.4943332963716317
Energy: 0.4899745253259496
Energy: 0.4943332963716317
Energy: 0.4899745253259496
Energy: 0.4943332963716317
Energy: 0.5707040971815793
Energy: 0.5001364805228162
Energy: 0.5707040971807845
Energy: 0.5001364805228162
Energy: 0.5707040971807845
Energy: 0.5001364805228162
Energy: 0.46035809682242024
Energy: 0.4818164806772951
Energy: 0.46035809682242024
Energy: 0.4818164806772951
Energy: 0.460358096823215
Energy: 0.4818164806780898
Energy: 0.49076311384177396
Energy: 0.5030446935381229
Energy: 0.49076311384177396
Energy: 0.5030446935389177
Energy: 0.49076311384256877
Energy: 0.5030446935381229
Energy: 0.5184045816256176
Energy: 0.4666718406056577
Energy: 0.5184045816248228
Energy: 0.4666718406056577
Energy: 0.5184045816256176
Energy: 0.4666718406056577
Energy: 0.5157587597032495
Energy: 0.5019593366080537
Energy: 0.5157587597032495
Energy: 0.5019593366080537
Energy: 0.5157587597040443
Energy: 0.5019593366080537
Energy: 0.497017879893697
Energy: 0.46828748647439433
Energy: 0.4970178798929023
Energy: 0.46828748647439433
Energy: 0.4970178798929023
Energy: 0.46828748647439433

minimum gb energy = 0.4602908090926942 eV
minimum distance =  2.57243468579343 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 0.4256408031890439
Energy: 0.4365798954127269
Energy: 0.4256408031890439
Energy: 0.4365798954127269
Energy: 0.4256408031890439
Energy: 0.4365798954127269
Energy: 0.4705960262735343
Energy: 0.4924675174976834
Energy: 0.4705960262735343
Energy: 0.4924675174976834
Energy: 0.4705960262735343
Energy: 0.4924675174981549
Energy: 0.40813465886127737
Energy: 0.4916896367473595
Energy: 0.40813465886222017
Energy: 0.4916896367464166
Energy: 0.40813465886222017
Energy: 0.49168963674688804
Energy: 0.4499508116263599
Energy: 0.4080290826687209
Energy: 0.44995081162588846
Energy: 0.4080290826691924
Energy: 0.44995081162683137
Energy: 0.4080290826687209
Energy: 0.4144024204515501
Energy: 0.42590355998502805
Energy: 0.4144024204520215
Energy: 0.42590355998455665
Energy: 0.4144024204515501
Energy: 0.42590355998455665
Energy: 0.41444220244119934
Energy: 0.4259494048528514
Energy: 0.41444220244261365
Energy: 0.4259494048528514
Energy: 0.41444220244214225
Energy: 0.4259494048528514
Energy: 0.4497271239040077
Energy: 0.4080210407545016
Energy: 0.4497271239049506
Energy: 0.4080210407549731
Energy: 0.4497271239049506
Energy: 0.4080210407545016
Energy: 0.4081426043912989
Energy: 0.4917256034475022
Energy: 0.40814260439177025
Energy: 0.4917256034484451
Energy: 0.4081426043912989
Energy: 0.4917256034479737
Energy: 0.4708752632145104
Energy: 0.4924528897345123
Energy: 0.4708752632154532
Energy: 0.4924528897345123
Energy: 0.47087526321498185
Energy: 0.4924528897345123
Energy: 0.42564080318951536
Energy: 0.4365798954122555
Energy: 0.4256408031890439
Energy: 0.4365798954127269
Energy: 0.4256408031890439
Energy: 0.4365798954127269
Energy: 0.4705960262744773
Energy: 0.4924675174976834
Energy: 0.47059602627306285
Energy: 0.4924675174976834
Energy: 0.4705960262735343
Energy: 0.4924675174981549
Energy: 0.40813465886222017
Energy: 0.4916896367464166
Energy: 0.40813465886222017
Energy: 0.49168963674688804
Energy: 0.40813465886222017
Energy: 0.4916896367464166
Energy: 0.44995081162588846
Energy: 0.4080290826691924
Energy: 0.44995081162683137
Energy: 0.4080290826687209
Energy: 0.44995081162588846
Energy: 0.4080290826687209
Energy: 0.4144024204515501
Energy: 0.42590355998455665
Energy: 0.4144024204520215
Energy: 0.42590355998408524
Energy: 0.4144024204515501
Energy: 0.42590355998455665
Energy: 0.4144422024416708
Energy: 0.4259494048537942
Energy: 0.41444220244214225
Energy: 0.42594940485332283
Energy: 0.4144422024416708
Energy: 0.42594940485332283
Energy: 0.44972712390542197
Energy: 0.4080210407549731
Energy: 0.4497271239058934
Energy: 0.4080210407549731
Energy: 0.44972712390447916
Energy: 0.4080210407549731
Energy: 0.4081426043912989
Energy: 0.4917256034489166
Energy: 0.4081426043912989
Energy: 0.49172560344938804
Energy: 0.40814260439177025
Energy: 0.4917256034479737
Energy: 0.4708752632145104
Energy: 0.4924528897345123
Energy: 0.47087526321733897
Energy: 0.4924528897345123
Energy: 0.47087526321592466
Energy: 0.4924528897345123
Energy: 0.42564080318951536
Energy: 0.4365798954122555
Energy: 0.4256408031899868
Energy: 0.436579895411784
Energy: 0.4256408031890439
Energy: 0.4365798954127269
Energy: 0.47059602627400576
Energy: 0.4924675174981549
Energy: 0.47059602627306285
Energy: 0.4924675174976834
Energy: 0.47059602627400576
Energy: 0.4924675174981549
Energy: 0.40813465886222017
Energy: 0.49168963674688804
Energy: 0.40813465886127737
Energy: 0.4916896367483024
Energy: 0.40813465886222017
Energy: 0.49168963674688804
Energy: 0.4499508116277742
Energy: 0.4080290826687209
Energy: 0.4499508116244741
Energy: 0.4080290826687209
Energy: 0.44995081162683137
Energy: 0.4080290826691924
Energy: 0.4144024204515501
Energy: 0.42590355998455665
Energy: 0.4144024204506072
Energy: 0.42590355998455665
Energy: 0.4144024204506072
Energy: 0.42590355998455665
Energy: 0.41444220244261365
Energy: 0.4259494048537942
Energy: 0.4144422024416708
Energy: 0.42594940485332283
Energy: 0.41444220244214225
Energy: 0.42594940485332283
Energy: 0.44972712390542197
Energy: 0.4080210407545016
Energy: 0.44972712390447916
Energy: 0.4080210407549731
Energy: 0.44972712390447916
Energy: 0.4080210407559159
Energy: 0.40814260439082745
Energy: 0.4917256034479737
Energy: 0.40814260439082745
Energy: 0.4917256034498595
Energy: 0.40814260439177025
Energy: 0.4917256034475022
Energy: 0.47087526321592466
Energy: 0.4924528897345123
Energy: 0.4708752632154532
Energy: 0.4924528897345123
Energy: 0.4708752632154532
Energy: 0.4924528897345123
Energy: 0.4256408031899868
Energy: 0.4365798954127269
Energy: 0.4256408031890439
Energy: 0.4365798954127269
Energy: 0.42564080318951536
Energy: 0.4365798954127269
Energy: 0.47059602627400576
Energy: 0.4924675174981549
Energy: 0.4705960262754201
Energy: 0.4924675174981549
Energy: 0.47059602627306285
Energy: 0.4924675174981549
Energy: 0.40813465886127737
Energy: 0.49168963674688804
Energy: 0.40813465886080585
Energy: 0.4916896367464166
Energy: 0.40813465886222017
Energy: 0.49168963674688804

minimum gb energy = 0.4080210407545016 eV
minimum distance =  2.58126082558814 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 0.45167560284760927
Energy: 0.4155196102837165
Energy: 0.45167560284760927
Energy: 0.4155196102837165
Energy: 0.45167560284760927
Energy: 0.4155196102837165
Energy: 0.4458908808556265
Energy: 0.45171158957290136
Energy: 0.4458908807378906
Energy: 0.45171158957290136
Energy: 0.44589088084292383
Energy: 0.4517115895717466
Energy: 0.4069978713910908
Energy: 0.4814645708111976
Energy: 0.4069978713910908
Energy: 0.4814645708111976
Energy: 0.4069978713910908
Energy: 0.4814645708111976
Energy: 0.5339554240611591
Energy: 0.40528497245175304
Energy: 0.5339554240611591
Energy: 0.4052849724529078
Energy: 0.5339554240611591
Energy: 0.4052849724529078
Energy: 0.47694463251181113
Energy: 0.40123050749812433
Energy: 0.47694463250950153
Energy: 0.40123050749812433
Energy: 0.47694463250950153
Energy: 0.40123050749812433
Energy: 0.4577227249270511
Energy: 0.4795408704653423
Energy: 0.4577227249258963
Energy: 0.47954087046649707
Energy: 0.4577227249258963
Energy: 0.4795408704653423
Energy: 0.41669407652995827
Energy: 0.4509437150696153
Energy: 0.41669407652995827
Energy: 0.4509437150696153
Energy: 0.4610123943123662
Energy: 0.4509437150696153
Energy: 0.4442518321188136
Energy: 0.4170543774935054
Energy: 0.4442518321188136
Energy: 0.4170543774935054
Energy: 0.4442518321188136
Energy: 0.4170543774935054
Energy: 0.4452704341492276
Energy: 0.42195363082075055
Energy: 0.4452704341492276
Energy: 0.4219536308126933
Energy: 0.4452704341492276
Energy: 0.42195363081500287
Energy: 0.43894549594015464
Energy: 0.4888722114894814
Energy: 0.43894549594015464
Energy: 0.4888722114894814
Energy: 0.43894549594015464
Energy: 0.4888722114894814
Energy: 0.454263188788375
Energy: 0.4010507956836298
Energy: 0.45426318878952976
Energy: 0.4010507956836298
Energy: 0.48440864472995554
Energy: 0.4010507956836298
Energy: 0.4768472593912817
Energy: 0.44473431594743956
Energy: 0.4768472593912817
Energy: 0.4447343159462847
Energy: 0.4768472593912817
Energy: 0.4447343159462847

minimum gb energy = 0.4010507956836298 eV
minimum distance =  2.5570902985617 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 0.4020156951745957
Energy: 0.38739327187917694
Energy: 0.4020156951765424
Energy: 0.38739327187917694
Energy: 0.4020156951745957
Energy: 0.3873932718795014
Energy: 0.5173196628121228
Energy: 0.3928760815056617
Energy: 0.5173196628124472
Energy: 0.4000376092409615
Energy: 0.5173196628121228
Energy: 0.3947843315382886
Energy: 0.3606105286946087
Energy: 0.48675635611517765
Energy: 0.3606105286939597
Energy: 0.48675635612264045
Energy: 0.3606105286952576
Energy: 0.48675635612264045
Energy: 0.3954281171595774
Energy: 0.37739524990185075
Energy: 0.39542811715925286
Energy: 0.37739524990217516
Energy: 0.39542811715925286
Energy: 0.37739524990120177
Energy: 0.4049155825716027
Energy: 0.372262037032942
Energy: 0.40491558256933147
Energy: 0.37226203703359095
Energy: 0.4049155825722517
Energy: 0.37226203703391536
Energy: 0.39234241793895286
Energy: 0.3886449630544498
Energy: 0.3923424179408997
Energy: 0.3886449630557477
Energy: 0.39234241794057517
Energy: 0.397943044393885
Energy: 0.37825528486010773
Energy: 0.4362928574445351
Energy: 0.37825528485945886
Energy: 0.4362928574429128
Energy: 0.37825528486043225
Energy: 0.4362928574445351
Energy: 0.355611161829721
Energy: 0.42819513256178654
Energy: 0.3556111618313434
Energy: 0.42819513256178654
Energy: 0.35561116183004554
Energy: 0.42819513256178654
Energy: 0.5107163024179643
Energy: 0.3721832688456042
Energy: 0.5107163024156931
Energy: 0.3721832688456042
Energy: 0.5107163024202356
Energy: 0.3721832688456042
Energy: 0.4064284952598707
Energy: 0.4786579852677107
Energy: 0.40642849525824837
Energy: 0.4786579852680352
Energy: 0.40642849525922176
Energy: 0.4786579852677107
Energy: 0.3987558354468859
Energy: 0.36654282674605154
Energy: 0.3987558354478593
Energy: 0.36654282674605154
Energy: 0.3987558354472103
Energy: 0.36654282674637595
Energy: 0.37087374686538654
Energy: 0.4012692425980452
Energy: 0.37087374686279073
Energy: 0.4012692425990187
Energy: 0.37087374686603547
Energy: 0.4012692425986942
Energy: 0.3919540657176769
Energy: 0.39285935083482326
Energy: 0.39195406571897473
Energy: 0.39285935083514767
Energy: 0.39195406571832586
Energy: 0.39285935083514767
Energy: 0.4023120853632247
Energy: 0.38901696190913676
Energy: 0.40231208536711827
Energy: 0.38901696190978574
Energy: 0.402312085365496
Energy: 0.38901696190978574
Energy: 0.3823178963956792
Energy: 0.4017666112242302
Energy: 0.3823178963956792
Energy: 0.4017666112252036
Energy: 0.3823178963956792
Energy: 0.4017666112252036
Energy: 0.4737436739755484
Energy: 0.3945890117865235
Energy: 0.4737436739739261
Energy: 0.3945890117874969
Energy: 0.47374367397457495
Energy: 0.3945890117868479
Energy: 0.4964213313055434
Energy: 0.4828045807798486
Energy: 0.4964213313055434
Energy: 0.48280458078017296
Energy: 0.49642133130424554
Energy: 0.48280458077919963
Energy: 0.39184186772595836
Energy: 0.372287231989735
Energy: 0.39184186772855406
Energy: 0.372287231989735
Energy: 0.39184186772595836
Energy: 0.372287231989735
Energy: 0.3579949692767219
Energy: 0.5124512223212108
Energy: 0.35799496927801977
Energy: 0.5124512223208862
Energy: 0.3579949692783443
Energy: 0.5124512223205618
Energy: 0.44361408786398654
Energy: 0.41932156990980285
Energy: 0.443614087863662
Energy: 0.41932156990947844
Energy: 0.4436140878630131
Energy: 0.41932156991012737
Energy: 0.3577202921068673
Energy: 0.5119225579657509
Energy: 0.3577202921042716
Energy: 0.5119225579647775
Energy: 0.3577202921058939
Energy: 0.5119225579651019
Energy: 0.39211051108631223
Energy: 0.37192952763665055
Energy: 0.3921105110892325
Energy: 0.3719295276372995
Energy: 0.392110511084041
Energy: 0.37192952763697507
Energy: 0.49640142862549724
Energy: 0.48268085948322614
Energy: 0.4964014286261461
Energy: 0.482680859480306
Energy: 0.49640142862582165
Energy: 0.48268085948322614
Energy: 0.47565361134228046
Energy: 0.37926731650797335
Energy: 0.4756536113442273
Energy: 0.37926731650764883
Energy: 0.4756536113442273
Energy: 0.37926731650797335
Energy: 0.38204472057380706
Energy: 0.40153627128253516
Energy: 0.38204472057640276
Energy: 0.4015362712831841
Energy: 0.3820447205767273
Energy: 0.40153627128221075
Energy: 0.40211903885934436
Energy: 0.3892178058612889
Energy: 0.4021190388573976
Energy: 0.38921780586096444
Energy: 0.40211903885837097
Energy: 0.3892178058616134
Energy: 0.39198268922920887
Energy: 0.39302098816842584
Energy: 0.3919826892295334
Energy: 0.39302098816842584
Energy: 0.39198268922985785
Energy: 0.3930209881681013
Energy: 0.37088792508763324
Energy: 0.38043352907812406
Energy: 0.37088792508763324
Energy: 0.38043352907779965
Energy: 0.37088792508763324
Energy: 0.38043352907715067
Energy: 0.3968491209979274
Energy: 0.36673114967431814
Energy: 0.3968491209979274
Energy: 0.3667311496739937
Energy: 0.3968491209966296
Energy: 0.36673114967366927
Energy: 0.4064198187151002
Energy: 0.5814492314998402
Energy: 0.406419818717047
Energy: 0.5814492315001646
Energy: 0.4064198187144512
Energy: 0.5814492315001646
Energy: 0.5107400604669331
Energy: 0.37222043752723194
Energy: 0.5107400604656352
Energy: 0.3722204375269074
Energy: 0.5107400604636884
Energy: 0.37222043752755635
Energy: 0.3556642395686443
Energy: 0.4281882958643224
Energy: 0.3556642395692933
Energy: 0.4281882958646468
Energy: 0.3556642395692933
Energy: 0.4281882958643224
Energy: 0.37819198377516716
Energy: 0.4363360934133343
Energy: 0.37819198377322033
Energy: 0.43633609341300983
Energy: 0.3781919837741937
Energy: 0.43633609341300983
Energy: 0.3921495181508949
Energy: 0.47685625384429225
Energy: 0.3921495181495971
Energy: 0.4768562538449412
Energy: 0.3921495181495971
Energy: 0.47685625384429225
Energy: 0.40497137747052664
Energy: 0.37246731852653847
Energy: 0.40497137747214895
Energy: 0.3724673185258896
Energy: 0.4049713774711755
Energy: 0.372467318526214
Energy: 0.39544570745765567
Energy: 0.37735350285947455
Energy: 0.3954457074589535
Energy: 0.37735350285915004
Energy: 0.39544570745765567
Energy: 0.37735350285979896
Energy: 0.36059247154816154
Energy: 0.48380399777770156
Energy: 0.360592471548486
Energy: 0.48380399777640365
Energy: 0.36059247154816154
Energy: 0.4838039977770526
Energy: 0.5206330770863887
Energy: 0.4166094967132616
Energy: 0.5206330770876866
Energy: 0.4166094967126126
Energy: 0.5206330770863887
Energy: 0.4166094967122882
Energy: 0.4020156951736223
Energy: 0.38739327187787903
Energy: 0.40201569517556907
Energy: 0.38739327187787903
Energy: 0.40201569517297336
Energy: 0.3873932718775546
Energy: 0.5173196628179632
Energy: 0.39287608151117764
Energy: 0.5173196628199099
Energy: 0.39287608151150216
Energy: 0.5173196628176386
Energy: 0.39287608151150216
Energy: 0.3606105286962015
Energy: 0.48675635612166707
Energy: 0.3606105286978239
Energy: 0.4867563561180979
Energy: 0.36061052869749943
Energy: 0.48675635612426277
Energy: 0.3954281171621731
Energy: 0.3773952498963347
Energy: 0.39542811716152415
Energy: 0.3773952498960103
Energy: 0.3954281171611997
Energy: 0.3773952498960103
Energy: 0.4049155825657623
Energy: 0.37226203703229305
Energy: 0.40491558256381555
Energy: 0.37226203703261745
Energy: 0.4049155825657623
Energy: 0.37226203703261745

minimum gb energy = 0.355611161829721 eV
minimum distance =  2.64561414780587 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.255735352940598
Energy: 0.2249912541528596
Energy: 0.14931177975767762
Energy: 0.22499125415359822
Energy: 0.255735352940598
Energy: 0.2249912541513824
Energy: 0.2971784769409026
Energy: 0.2236329307366322
Energy: 0.2971784769460728
Energy: 0.2232338938387881
Energy: 0.2971784769453342
Energy: 0.22363293074254104
Energy: 0.25176623718250113
Energy: 0.3157255889174534
Energy: 0.2517662371832397
Energy: 0.358536561756604
Energy: 0.25176623718176244
Energy: 0.31572558891819197
Energy: 0.2259973836097324
Energy: 0.2017809878984395
Energy: 0.2259973836097324
Energy: 0.1493781456449984
Energy: 0.225997383606073
Energy: 0.20178098789622373
Energy: 0.2188100973426033
Energy: 0.29609963747867835
Energy: 0.2188100973381716
Energy: 0.2960996374764625
Energy: 0.2188100973381716
Energy: 0.2960996374794169
Energy: 0.14939453458823362
Energy: 0.2550443589866206
Energy: 0.14939453458823362
Energy: 0.2550443589880978
Energy: 0.14939453458823362
Energy: 0.25504435898735917
Energy: 0.149447923562791
Energy: 0.17700510563721697
Energy: 0.14944792355983658
Energy: 0.17700510563647834
Energy: 0.14944792355762074
Energy: 0.17700510563500116
Energy: 0.297528108621607
Energy: 0.21751133653746868
Energy: 0.297528108621607
Energy: 0.21751133653525284
Energy: 0.2975281086208684
Energy: 0.21751133653451424
Energy: 0.2264909986433668
Energy: 0.1493744694737473
Energy: 0.2264909986441054
Energy: 0.2018011611823077
Energy: 0.22649099864632122
Energy: 0.14937446947300867
Energy: 0.17711309610980105
Energy: 0.31137313307893294
Energy: 0.17711309611497128
Energy: 0.3113731330818874
Energy: 0.1771130961127554
Energy: 0.3113731330811487
Energy: 0.2183922503453217
Energy: 0.30873426084181893
Energy: 0.21839225034606033
Energy: 0.3087342608381259
Energy: 0.21839225034384455
Energy: 0.30873426084108035
Energy: 0.25573535293838223
Energy: 0.22499125415359822
Energy: 0.14931177975767762
Energy: 0.22499125415507543
Energy: 0.25573535293912086
Energy: 0.2249912541543368
Energy: 0.2971784769423798
Energy: 0.22363293073810941
Energy: 0.2971784769453342
Energy: 0.22323389384026532
Energy: 0.2971784769460728
Energy: 0.22363293074106386
Energy: 0.25176623718176244
Energy: 0.3157255889130218
Energy: 0.2517662371832397
Energy: 0.35853656175512677
Energy: 0.2517662371832397
Energy: 0.3157255889159762
Energy: 0.2259973836097324
Energy: 0.20178098789917812
Energy: 0.22599738360828878
Energy: 0.149378145645737
Energy: 0.225997383606073
Energy: 0.2017809878969623
Energy: 0.21881009734186468
Energy: 0.2960996374779397
Energy: 0.21881009733964885
Energy: 0.29609963747867835
Energy: 0.21881009733964885
Energy: 0.29609963748015555
Energy: 0.1493945345889722
Energy: 0.2550443589851434
Energy: 0.1493945345889722
Energy: 0.2550443589888364
Energy: 0.14939453458823362
Energy: 0.25504435898588196
Energy: 0.14944792355983658
Energy: 0.1770051056401714
Energy: 0.14944792355835934
Energy: 0.1770051056401714
Energy: 0.14944792355835934
Energy: 0.17700510563869418
Energy: 0.2975281086208684
Energy: 0.21751133653746868
Energy: 0.297528108621607
Energy: 0.21751133653673005
Energy: 0.2975281086201298
Energy: 0.21751133653525284

minimum gb energy = 0.14931177975767762 eV
minimum distance =  2.77855880489298 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 0.3720376688997881
Energy: 0.3659398245840048
Energy: 0.3720376688997881
Energy: 0.3659398245834638
Energy: 0.3720376688992471
Energy: 0.3659398245840048
Energy: 0.4127621437365316
Energy: 0.35968921775214735
Energy: 0.41276214373544956
Energy: 0.35968921775214735
Energy: 0.41276214373599057
Energy: 0.3596892177510653
Energy: 0.4317819576233125
Energy: 0.5303392244993708
Energy: 0.44275448301253456
Energy: 0.5303392244993708
Energy: 0.42868431764250636
Energy: 0.5303392244988296
Energy: 0.4288900807081709
Energy: 0.3412175596404745
Energy: 0.42889008070925294
Energy: 0.3412175596404745
Energy: 0.42889008070871193
Energy: 0.34121755963993344
Energy: 0.3592615900602489
Energy: 0.31901241398139957
Energy: 0.3592615900602489
Energy: 0.31901241398085856
Energy: 0.3592615900613309
Energy: 0.31901241398139957
Energy: 0.36862026312270396
Energy: 0.40800904506190977
Energy: 0.36862026312324503
Energy: 0.40800904506190977
Energy: 0.3686202631216218
Energy: 0.40800904506190977
Energy: 0.3463726219556592
Energy: 0.41226979595931496
Energy: 0.3463726219578234
Energy: 0.41226979595174035
Energy: 0.34637262195728236
Energy: 0.4122697959631023
Energy: 0.37278706854290344
Energy: 0.30669686654163675
Energy: 0.37278706854236243
Energy: 0.30669686654163675
Energy: 0.37278706854236243
Energy: 0.30669686654163675
Energy: 0.3711945402123596
Energy: 0.3101959988091519
Energy: 0.3711945402112775
Energy: 0.31019599880861076
Energy: 0.3711945402118186
Energy: 0.31019599880861076
Energy: 0.3121348315803744
Energy: 0.47905085193310015
Energy: 0.3121348315782102
Energy: 0.47905085193147706
Energy: 0.3121348315792923
Energy: 0.47905085193147706
Energy: 0.45472683895983235
Energy: 0.45427110418104144
Energy: 0.45472683896091437
Energy: 0.45427110418050043
Energy: 0.45472683895875027
Energy: 0.45427110418050043
Energy: 0.36242705108202694
Energy: 0.32148724508315685
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Energy: 0.38123285819958275
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Energy: 0.38123285819958275
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Energy: 0.4109735630505739
Energy: 0.521256962347121
Energy: 0.41097356304949184
Energy: 0.5212569623476621
Energy: 0.4109735630505739
Energy: 0.5212569623465799
Energy: 0.41106437216485314
Energy: 0.36187457019693564
Energy: 0.41106437216322994
Energy: 0.36187457019693564
Energy: 0.4110643721616069
Energy: 0.3618745701958536
Energy: 0.3553159617981622
Energy: 0.3666133999418664
Energy: 0.35531596180086744
Energy: 0.3666133999413254
Energy: 0.3553159617981622
Energy: 0.3666133999418664
Energy: 0.3433433468487181
Energy: 0.35828946059210975
Energy: 0.3433433468492591
Energy: 0.35828946059210975
Energy: 0.3433433468481771
Energy: 0.35828946059265077
Energy: 0.4669283109545396
Energy: 0.46468885227351553
Energy: 0.4669283109550807
Energy: 0.46468885227622075
Energy: 0.4669283109545396
Energy: 0.46468885227405654
Energy: 0.42856863576494447
Energy: 0.3406575025033247
Energy: 0.42856863576494447
Energy: 0.3406575025044068
Energy: 0.42856863576656756
Energy: 0.3406575025038658
Energy: 0.36242170854921574
Energy: 0.3467926655115699
Energy: 0.36242170854975675
Energy: 0.346792665512652
Energy: 0.36242170854921574
Energy: 0.34679266551211096
Energy: 0.3131062497818342
Energy: 0.3694551684872639
Energy: 0.31310624978453944
Energy: 0.3694551684872639
Energy: 0.31310624978129314
Energy: 0.3694551684867229
Energy: 0.3910872957118257
Energy: 0.4135542857166918
Energy: 0.39108729575943746
Energy: 0.4135542857156096
Energy: 0.39108729573671364
Energy: 0.4135542857183149
Energy: 0.37571570658884756
Energy: 0.3571723473026588
Energy: 0.37571570658884756
Energy: 0.3571723473026588
Energy: 0.37571570658884756
Energy: 0.3571723473026588
Energy: 0.3715658812737155
Energy: 0.3351916556985936
Energy: 0.3715658812737155
Energy: 0.3351916556980526
Energy: 0.3715658812726334
Energy: 0.3351916556985936
Energy: 0.3130861528644741
Energy: 0.4581463033130574
Energy: 0.3130861528666383
Energy: 0.4581463033125164
Energy: 0.3130861528644741
Energy: 0.45814630331197537
Energy: 0.5536458404113818
Energy: 0.4564582074187586
Energy: 0.5536458404108408
Energy: 0.45645820741929966
Energy: 0.5536458404113818
Energy: 0.4564582074182175

minimum gb energy = 0.30669686654163675 eV
minimum distance =  2.66928682778353 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 0.421732417354798
Energy: 0.34005202927036143
Energy: 0.4217324173556509
Energy: 0.34005202927078787
Energy: 0.421732417354798
Energy: 0.34005202927036143
Energy: 0.4300412809185043
Energy: 0.4144242890507829
Energy: 0.4300412809206364
Energy: 0.4144242890507829
Energy: 0.43004128091935717
Energy: 0.4144242890512093
Energy: 0.5107251264846829
Energy: 0.5878937416496067
Energy: 0.5107251264859622
Energy: 0.5878937416496067
Energy: 0.5107251264834036
Energy: 0.5878937416491804
Energy: 0.3917308196490233
Energy: 0.3373869318873671
Energy: 0.3917308196485968
Energy: 0.3373869318869407
Energy: 0.39173081964944967
Energy: 0.3373869318873671
Energy: 0.33282920953415485
Energy: 0.3586304963672633
Energy: 0.3328292095337284
Energy: 0.35863049636683686
Energy: 0.3328292095337284
Energy: 0.35863049636683686
Energy: 0.4166902294140897
Energy: 0.4867007293760182
Energy: 0.41669022941494255
Energy: 0.4867007293760182
Energy: 0.41669022941451606
Energy: 0.48670072937644465
Energy: 0.36005559773091833
Energy: 0.4629555580776414
Energy: 0.3600555977317712
Energy: 0.4629555580759357
Energy: 0.36005559773091833
Energy: 0.4629555580776414
Energy: 0.3489946979631227
Energy: 0.3372732910619562
Energy: 0.3489946979631227
Energy: 0.3372732910619562
Energy: 0.3489946979639756
Energy: 0.3372732910623827
Energy: 0.33366303188883467
Energy: 0.35750259693405817
Energy: 0.33366303188840823
Energy: 0.35750259693491104
Energy: 0.33366303188883467
Energy: 0.35750259693405817
Energy: 0.38997070154750507
Energy: 0.483200451933474
Energy: 0.38997070154707864
Energy: 0.4832004519326211
Energy: 0.38997070154707864
Energy: 0.483200451933474
Energy: 0.38969756174341236
Energy: 0.484679718128605
Energy: 0.389697561745971
Energy: 0.48467971812903143
Energy: 0.38969756174426523
Energy: 0.48467971812903143
Energy: 0.33177966404511694
Energy: 0.41445600588712067
Energy: 0.33177966404426407
Energy: 0.43357464035209436
Energy: 0.33177966404511694
Energy: 0.4121095944518371
Energy: 0.34925329442715514
Energy: 0.338759066758671
Energy: 0.34925329442758163
Energy: 0.338759066758671
Energy: 0.34925329442758163
Energy: 0.338759066758671
Energy: 0.33114821133732275
Energy: 0.4767054266521463
Energy: 0.33114821133732275
Energy: 0.4767054266521463
Energy: 0.3311482113368963
Energy: 0.47670542665257276
Energy: 0.4160138368490813
Energy: 0.48735289119170483
Energy: 0.41601383684993415
Energy: 0.48735289119085196
Energy: 0.416013836847802
Energy: 0.4873528911912784
Energy: 0.3346612860398283
Energy: 0.44566775511473694
Energy: 0.3346612860402547
Energy: 0.446372455682722
Energy: 0.3346612860402547
Energy: 0.3935065057084549
Energy: 0.3533167531339752
Energy: 0.3386696415347026
Energy: 0.3533167531339752
Energy: 0.3386696415347026
Energy: 0.3533167531331224
Energy: 0.3386696415347026
Energy: 0.43238075517983815
Energy: 0.5893994437141442
Energy: 0.43238075517941166
Energy: 0.5893994437137178
Energy: 0.43238075518026453
Energy: 0.5893994437137178
Energy: 0.4286276096201982
Energy: 0.4151175786362359
Energy: 0.4286276096206247
Energy: 0.4151175786362359
Energy: 0.4286276096201982
Energy: 0.4151175786362359
Energy: 0.3884455327401202
Energy: 0.4356855762988087
Energy: 0.3884455327435316
Energy: 0.4420297692475922
Energy: 0.3884455327409731
Energy: 0.4098080794068443
Energy: 0.33419922178584044
Energy: 0.4142847893354139
Energy: 0.33419922178584044
Energy: 0.4142847893349874
Energy: 0.33419922178498757
Energy: 0.4142847893349874
Energy: 0.5104884718881659
Energy: 0.5546357457961197
Energy: 0.5104884718877396
Energy: 0.5546357457956932
Energy: 0.5104884718877396
Energy: 0.5546357457973989
Energy: 0.39223098823315544
Energy: 0.3386031360994857
Energy: 0.3922309882335818
Energy: 0.3386031361003386
Energy: 0.3922309882314497
Energy: 0.3386031360999121
Energy: 0.3346873359763861
Energy: 0.44410934907863436
Energy: 0.3346873359759596
Energy: 0.4604959794398839
Energy: 0.3346873359763861
Energy: 0.422734732053184
Energy: 0.33052520360850074
Energy: 0.4468261115900897
Energy: 0.3305252036089272
Energy: 0.4468261115905161
Energy: 0.33052520360978005
Energy: 0.4468261115900897
Energy: 0.35864596709241026
Energy: 0.4806854854673934
Energy: 0.3586459670928367
Energy: 0.48068548546696693
Energy: 0.3586459670928367
Energy: 0.4806854854673934
Energy: 0.34954782206145485
Energy: 0.33856516838241896
Energy: 0.3495478220623077
Energy: 0.3385651683832718
Energy: 0.3495478220623077
Energy: 0.33856516838284534
Energy: 0.3346884342592874
Energy: 0.4298851427830961
Energy: 0.3346884342601403
Energy: 0.4568378870126083
Energy: 0.33468843425843453
Energy: 0.3812194419194365
Energy: 0.3886783458332218
Energy: 0.42096440460780976
Energy: 0.3886783458340747
Energy: 0.4209644046073833
Energy: 0.3886783458340747
Energy: 0.4209644046073833
Energy: 0.5079346083892722
Energy: 0.46146436411893355
Energy: 0.5079346083875664
Energy: 0.4390412363252912
Energy: 0.5079346083892722
Energy: 0.46146436411936004
Energy: 0.3310607336393979
Energy: 0.38053790352065503
Energy: 0.3310607336393979
Energy: 0.38053790352065503
Energy: 0.3310607336398244
Energy: 0.38053790352065503
Energy: 0.3481046382553762
Energy: 0.3360914325295193
Energy: 0.3481046382549498
Energy: 0.3360914325295193
Energy: 0.3481046382558026
Energy: 0.33609143252909285
Energy: 0.33051561838284427
Energy: 0.3929504478088685
Energy: 0.33051561838327076
Energy: 0.39295044780844207
Energy: 0.33051561838284427
Energy: 0.39295044780844207

minimum gb energy = 0.33051561838284427 eV
minimum distance =  2.69866892753089 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 0.3669047980971357
Energy: 0.3558948481514925
Energy: 0.3669047980959386
Energy: 0.35589484815206385
Energy: 0.3669047980977343
Energy: 0.35589484815179173
Energy: 0.41541548973777215
Energy: 0.3671960965703794
Energy: 0.41541548973777215
Energy: 0.3671960965703794
Energy: 0.41541548973777215
Energy: 0.3671960965703794
Energy: 0.5671351612660013
Energy: 0.5610683837245412
Energy: 0.5671351612671983
Energy: 0.5610683837242418
Energy: 0.5671351612674976
Energy: 0.5610683837245412
Energy: 0.39550942385250865
Energy: 0.35556669652357775
Energy: 0.39550942385131155
Energy: 0.35556669652297923
Energy: 0.39550942385340654
Energy: 0.35556669652357775
Energy: 0.3529578814399795
Energy: 0.5224361158083436
Energy: 0.35295788143968027
Energy: 0.5224361158089421
Energy: 0.35295788143968027
Energy: 0.5224361158086428
Energy: 0.4790215640822143
Energy: 0.3602647724462352
Energy: 0.4790215640836835
Energy: 0.3602647724468338
Energy: 0.4790215640833842
Energy: 0.360264772447133
Energy: 0.39502046145531305
Energy: 0.4408914646121885
Energy: 0.3950204614544153
Energy: 0.44089146459961887
Energy: 0.3950204614544153
Energy: 0.44089146460530515
Energy: 0.3957191021236111
Energy: 0.43142566028249596
Energy: 0.395719102122414
Energy: 0.4314256602842916
Energy: 0.395719102122414
Energy: 0.43142566028249596
Energy: 0.5220932037915288
Energy: 0.37808528784360546
Energy: 0.5220932037930253
Energy: 0.37808528784360546
Energy: 0.5220932037924266
Energy: 0.37808528784390477
Energy: 0.4938373852218739
Energy: 0.3755861607594521
Energy: 0.4938373852221732
Energy: 0.37558616075975143
Energy: 0.49383738522157455
Energy: 0.3755861607591529
Energy: 0.40036232912400777
Energy: 0.4021460738734293
Energy: 0.4003623291162266
Energy: 0.40214607387402784
Energy: 0.40036232909380814
Energy: 0.4021460738689402
Energy: 0.5308581626894784
Energy: 0.355734087340821
Energy: 0.5308581626894784
Energy: 0.35573408734022244
Energy: 0.5308581626903762
Energy: 0.3557340873414196
Energy: 0.3790842768578774
Energy: 0.5225667709292994
Energy: 0.37908427685727886
Energy: 0.5225667709301971
Energy: 0.3790842768578774
Energy: 0.5225667709301971
Energy: 0.42812311829195804
Energy: 0.3952438042654583
Energy: 0.42812311829255656
Energy: 0.39524380426515904
Energy: 0.42812311829315514
Energy: 0.39524380426575767
Energy: 0.42487165779405867
Energy: 0.3963888747248302
Energy: 0.42487165779375946
Energy: 0.3963888747245309
Energy: 0.4248716577928617
Energy: 0.39638887472542866
Energy: 0.36081751034794707
Energy: 0.4800549684121971
Energy: 0.3608175103506406
Energy: 0.48005496841279566
Energy: 0.3608175103506406
Energy: 0.48005496841279566
Energy: 0.5259337409250918
Energy: 0.35391194738832293
Energy: 0.525933740924194
Energy: 0.35391194738922077
Energy: 0.5259337409232961
Energy: 0.3539119473889215
Energy: 0.3583317847869804
Energy: 0.3964372214115569
Energy: 0.3583317847872796
Energy: 0.3964372214097613
Energy: 0.35833178478638184
Energy: 0.39643722141065907
Energy: 0.49588801420697814
Energy: 0.5663940116998629
Energy: 0.49588801420548184
Energy: 0.5663940116995636
Energy: 0.49588801420907314
Energy: 0.5663940116992644
Energy: 0.4556319620221279
Energy: 0.3817700714898763
Energy: 0.45563196202302575
Energy: 0.3817700714901755
Energy: 0.45563196202422285
Energy: 0.3817700714898763
Energy: 0.3579166548146813
Energy: 0.36794099703973665
Energy: 0.3579166548125864
Energy: 0.36794099703973665
Energy: 0.3579166548146813
Energy: 0.36794099703973665
Energy: 0.3688846708613334
Energy: 0.4151647167986395
Energy: 0.3688846708595377
Energy: 0.41516471679804096
Energy: 0.36888467086103405
Energy: 0.4151647167986395
Energy: 0.5454098831105961
Energy: 0.4701303127204123
Energy: 0.5454098831096983
Energy: 0.47013031272011296
Energy: 0.5454098831099976
Energy: 0.47013031272011296
Energy: 0.3573884614747149
Energy: 0.47380230936418294
Energy: 0.3573884614753135
Energy: 0.4738023093629858
Energy: 0.3573884614747149
Energy: 0.4738023093644822
Energy: 0.519314091926675
Energy: 0.35388219557451617
Energy: 0.519314091926675
Energy: 0.3538821955742169
Energy: 0.5193140919263758
Energy: 0.3538821955742169
Energy: 0.361230827602448
Energy: 0.4793055206772685
Energy: 0.36123082760364505
Energy: 0.47930552067667
Energy: 0.36123082760095165
Energy: 0.47930552067667
Energy: 0.42018157257446354
Energy: 0.394187167240533
Energy: 0.42018157257476285
Energy: 0.39418716724023367
Energy: 0.42018157257476285
Energy: 0.394187167240533
Energy: 0.3711972732801619
Energy: 0.3546765599249517
Energy: 0.37119727328076035
Energy: 0.3546765599249517
Energy: 0.37119727328165825
Energy: 0.3546765599243531
Energy: 0.3794451684344438
Energy: 0.5223359639460706
Energy: 0.3794451684344438
Energy: 0.5223359639457714
Energy: 0.3794451684353416
Energy: 0.5223359639457714
Energy: 0.37788783796731196
Energy: 0.4945614058413232
Energy: 0.3778878379667134
Energy: 0.4945614058419217
Energy: 0.37788783796701264
Energy: 0.4945614058413232
Energy: 0.39917852332049314
Energy: 0.36123854421545265
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Energy: 0.3612385442163505
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Energy: 0.35729422116899345
Energy: 0.5288772699998588
Energy: 0.3572942211698913
Energy: 0.5288772699995595
Energy: 0.3572942211698913
Energy: 0.5288772699998588
Energy: 0.5224197250033522
Energy: 0.3586115855461738
Energy: 0.5224197250027537
Energy: 0.3586115855467723
Energy: 0.5224197250030529
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Energy: 0.39625636755150356
Energy: 0.4259836534160256
Energy: 0.3962563675518028
Energy: 0.42598365341423
Energy: 0.39625636755210214
Energy: 0.4259836534136314
Energy: 0.3958603476879344
Energy: 0.4259818263821646
Energy: 0.39586034769122636
Energy: 0.42598182638246385
Energy: 0.3958603476891315
Energy: 0.42598182638246385
Energy: 0.5224725020222231
Energy: 0.3585254502572742
Energy: 0.5224725020234201
Energy: 0.3585254502569749
Energy: 0.5224725020231208
Energy: 0.3585254502569749
Energy: 0.357265365354772
Energy: 0.5289496436327636
Energy: 0.357265365352677
Energy: 0.5289496436324642
Energy: 0.3572653653550712
Energy: 0.5289496436327636
Energy: 0.39928170281705705
Energy: 0.36123875807554695
Energy: 0.3992817028179277
Energy: 0.36123875807524763
Energy: 0.399281702818227
Energy: 0.36123875807554695
Energy: 0.3778734937857699
Energy: 0.49481725604635074
Energy: 0.37787349378606927
Energy: 0.49481725604605153
Energy: 0.3778734937857699
Energy: 0.49481725604814636
Energy: 0.37941699745830787
Energy: 0.5223071785237133
Energy: 0.37941699745830787
Energy: 0.522307178523414
Energy: 0.37941699745830787
Energy: 0.5223071785240125
Energy: 0.37122850828488824
Energy: 0.3547589935707325
Energy: 0.3712285082857861
Energy: 0.3547589935698347
Energy: 0.37122850828369114
Energy: 0.35475899357013396
Energy: 0.4203819485587066
Energy: 0.3940173718642859
Energy: 0.42038194855421745
Energy: 0.3940173718642859
Energy: 0.4203819485560131
Energy: 0.39401737186368735
Energy: 0.3616972255777498
Energy: 0.4793067554753699
Energy: 0.3616972255759542
Energy: 0.4793067554750707
Energy: 0.3616972255762534
Energy: 0.47930675547477136
Energy: 0.5194307044593235
Energy: 0.3538883988735392
Energy: 0.519430704457827
Energy: 0.3538883988732398
Energy: 0.5194307044590241
Energy: 0.3538883988735392
Energy: 0.3573997917161614
Energy: 0.47386986686212995
Energy: 0.35739979171586206
Energy: 0.4738698668618307
Energy: 0.35739979171586206
Energy: 0.47386986686332705
Energy: 0.5454532534118786
Energy: 0.47019855017950524
Energy: 0.5454532534118786
Energy: 0.4701985501780089
Energy: 0.5454532534121778
Energy: 0.47019855018010376
Energy: 0.36891974100307173
Energy: 0.4150657428758435
Energy: 0.3689197410036703
Energy: 0.41506574287554426
Energy: 0.3689197410024732
Energy: 0.41506574287554426

minimum gb energy = 0.35295788143968027 eV
minimum distance =  2.66393681480339 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 0.3530954749203985
Energy: 0.37388522941954094
Energy: 0.3530954749208076
Energy: 0.3738852294191546
Energy: 0.35309547492098947
Energy: 0.37388522941954094
Energy: 0.3513219038838989
Energy: 0.3582992392536401
Energy: 0.3513219038841035
Energy: 0.3582992392538447
Energy: 0.35132190388430806
Energy: 0.3582992392540493
Energy: 0.47074399851763304
Energy: 0.4830311592530565
Energy: 0.5361923678919649
Energy: 0.4830311592532383
Energy: 0.5522552444322618
Energy: 0.4830311592524428
Energy: 0.3513202951213902
Energy: 0.35830417187919916
Energy: 0.35132029512100377
Energy: 0.3583041718794037
Energy: 0.3513202951212083
Energy: 0.3583041718794037
Energy: 0.3530954749239897
Energy: 0.3738852294185409
Energy: 0.3530954749231942
Energy: 0.3738852294191546
Energy: 0.3530954749231942
Energy: 0.3738852294185409
Energy: 0.3513219038814896
Energy: 0.35829923924943524
Energy: 0.3513219038814896
Energy: 0.35829923924943524
Energy: 0.3513219038821033
Energy: 0.3582992392492534
Energy: 0.5361923678865782
Energy: 0.4830311592522382
Energy: 0.5361923678881692
Energy: 0.4830311592532383
Energy: 0.5005412060143444
Energy: 0.48303115925264734

minimum gb energy = 0.35132029512100377 eV
minimum distance =  2.67141931745049 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 0.5054512826669509
Energy: 0.427337464982319
Energy: 0.4873836266655771
Energy: 0.42733746497796404
Energy: 0.5054512826623486
Energy: 0.42733746497712266
Energy: 0.45203815510221707
Energy: 0.4159634943748629
Energy: 0.45203815510954143
Energy: 0.4159634943669943
Energy: 0.45203815511038276
Energy: 0.41596349436724167
Energy: 0.47485446437814155
Energy: 0.5213837326792182
Energy: 0.4679285619894895
Energy: 0.5213837326754077
Energy: 0.47485446438412965
Energy: 0.521383732669667
Energy: 0.4997711171388907
Energy: 0.42330993680975404
Energy: 0.49977111714379
Energy: 0.42330993681490087
Energy: 0.4997711171407712
Energy: 0.4160385678466944
Energy: 0.4494078981352837
Energy: 0.48468240554674713
Energy: 0.44940789813473936
Energy: 0.48468240555080516
Energy: 0.44940789813855
Energy: 0.4846824055505577
Energy: 0.4540260305361611
Energy: 0.4765484427398673
Energy: 0.4540260305356167
Energy: 0.47654844273526487
Energy: 0.4540260305331918
Energy: 0.476548442736898
Energy: 0.5124670039850756
Energy: 0.4815290811703461
Energy: 0.5120008201660262
Energy: 0.4815290811676242
Energy: 0.5124670039859168
Energy: 0.48152908116980175
Energy: 0.4626766314012022
Energy: 0.4307652325577195
Energy: 0.4626766314096153
Energy: 0.4391524732567213
Energy: 0.4626766314055572
Energy: 0.47591272311610605
Energy: 0.4331510592024722
Energy: 0.4773927346233692
Energy: 0.43315105920682717
Energy: 0.47739273462475484
Energy: 0.43315105920301655
Energy: 0.47739273462475484
Energy: 0.45512501958478074
Energy: 0.47645485021160516
Energy: 0.4551250195842363
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Energy: 0.4764548502145744
Energy: 0.4514909978678389
Energy: 0.4637076509981318
Energy: 0.45149099778836044
Energy: 0.4637076509992206
Energy: 0.45149099800655484
Energy: 0.4637076509992206
Energy: 0.42145812262961074
Energy: 0.4737355852017978
Energy: 0.42146060508913874
Energy: 0.4809255752537468
Energy: 0.4214581226282251
Energy: 0.4762871356912419
Energy: 0.4633454972267691
Energy: 0.4719672472297116
Energy: 0.4633454972218698
Energy: 0.4719672472269898
Energy: 0.4633454972325097
Energy: 0.4719672472272867
Energy: 0.4421312859988446
Energy: 0.44846650403553334
Energy: 0.44213128599612267
Energy: 0.4484665040418183
Energy: 0.4421312859953309
Energy: 0.44846650404152144
Energy: 0.5026757344948433
Energy: 0.434269640707075
Energy: 0.5026757344929628
Energy: 0.43426964069401014
Energy: 0.502675734489944
Energy: 0.43426964069401014
Energy: 0.45934441949582466
Energy: 0.4465573455159844
Energy: 0.45934441949122223
Energy: 0.4552449911760583
Energy: 0.459344419496369
Energy: 0.44419273161952116
Energy: 0.49278104386003
Energy: 0.47990361110842755
Energy: 0.49278104386656246
Energy: 0.4799036111103576
Energy: 0.49278104388259675
Energy: 0.47990361111006063
Energy: 0.4168008866049293
Energy: 0.48519835601301864
Energy: 0.41680088660304876
Energy: 0.4851983560157406
Energy: 0.4168008866003269
Energy: 0.48519835602880546
Energy: 0.4719856957241454
Energy: 0.4746830363024735
Energy: 0.4719856957396352
Energy: 0.4746830362995042
Energy: 0.471985695736369
Energy: 0.47468303629866293
Energy: 0.42182648454244404
Energy: 0.4695075820214906
Energy: 0.4218264845408109
Energy: 0.4695075820160469
Energy: 0.42182648454516586
Energy: 0.46950758201466125
Energy: 0.4851469301459142
Energy: 0.5154636673358821
Energy: 0.4851472134968006
Energy: 0.5154636673315273
Energy: 0.48514693015571286
Energy: 0.5154636673317747
Energy: 0.40778825233451066
Energy: 0.4883402567025581
Energy: 0.4078130172341108
Energy: 0.48834025669983616
Energy: 0.4077882523244645
Energy: 0.48834025669899483
Energy: 0.45041924838738856
Energy: 0.42622911471572833
Energy: 0.4504192483838253
Energy: 0.4262291147189946
Energy: 0.45041924838328096
Energy: 0.42622911471790587
Energy: 0.43927668374420537
Energy: 0.4747406092739357
Energy: 0.4392766837390091
Energy: 0.47474060927937944
Energy: 0.43927668373549533
Energy: 0.47474060927829065
Energy: 0.45601938698058164
Energy: 0.515526741713723
Energy: 0.4560193869808291
Energy: 0.5155267417101598
Energy: 0.45601938697622657
Energy: 0.5155267417099124
Energy: 0.4239733395125257
Energy: 0.475961244191353
Energy: 0.4239893124219641
Energy: 0.47596124418021807
Energy: 0.4239733395150001
Energy: 0.47596124417997066
Energy: 0.45960972082686524
Energy: 0.49240620835034027
Energy: 0.45960972082330204
Energy: 0.4924062083555365
Energy: 0.4596097208176109
Energy: 0.49240620835578397
Energy: 0.46075599127104344
Energy: 0.4410602316112904
Energy: 0.4607559912734684
Energy: 0.44966960647995674
Energy: 0.4607559912715878
Energy: 0.4433517334934936
Energy: 0.4715020968455103
Energy: 0.48009512962369344
Energy: 0.4715020968506571
Energy: 0.48009512961146983
Energy: 0.4715020968504097
Energy: 0.4800951296117173
Energy: 0.48500891173993393
Energy: 0.4236600863363734
Energy: 0.46266344074583765
Energy: 0.42366008634043145
Energy: 0.48500891173938954
Energy: 0.423660086340184
Energy: 0.49773975480307137
Energy: 0.40712718787103125
Energy: 0.48036835968031827
Energy: 0.4071271878604407
Energy: 0.49773975479683585
Energy: 0.407127187859352
Energy: 0.4833228463762301
Energy: 0.45995879123722994
Energy: 0.4833228463781107
Energy: 0.459958791228817
Energy: 0.4833228463846431
Energy: 0.45995879122856953
Energy: 0.45388286319484095
Energy: 0.48647328418740104
Energy: 0.4538828631809348
Energy: 0.48647328418007674
Energy: 0.4538828631942966
Energy: 0.48647328418032415
Energy: 0.45651947522718056
Energy: 0.48481826944778333
Energy: 0.456519475233713
Energy: 0.4848182694347184
Energy: 0.456519475222875
Energy: 0.48481826943417405
Energy: 0.46808530681804883
Energy: 0.4644929007264905
Energy: 0.46808530682294824
Energy: 0.46449290072129423
Energy: 0.46808530681992944
Energy: 0.4644929007215912
Energy: 0.46850070092858853
Energy: 0.469473626005797
Energy: 0.4683148880986643
Energy: 0.46947362600822184
Energy: 0.468500700928836
Energy: 0.46947362600822184
Energy: 0.4469539707628409
Energy: 0.4845836664810066
Energy: 0.4469578772870296
Energy: 0.484583666481254
Energy: 0.4469539707603665
Energy: 0.48458366648070966
Energy: 0.4946344342380176
Energy: 0.41945307570774554
Energy: 0.4946344342349988
Energy: 0.4194530757110118
Energy: 0.49463443423475134
Energy: 0.41945307571046747
Energy: 0.4234737253410517
Energy: 0.48494258567233295
Energy: 0.4234737253394186
Energy: 0.4849425856921778
Energy: 0.4234737253353111
Energy: 0.4849425856812903
Energy: 0.48233584793701695
Energy: 0.46951081842581793
Energy: 0.48233584794191625
Energy: 0.46951081842175985
Energy: 0.48233584794602385
Energy: 0.4695108184220073
Energy: 0.47697757106365035
Energy: 0.5138845767818212
Energy: 0.47697781663528954
Energy: 0.513884576797905
Energy: 0.4769775710617698
Energy: 0.5138845767984493
Energy: 0.5208071337718528
Energy: 0.40900073408422266
Energy: 0.5208071337699227
Energy: 0.40900073408258947
Energy: 0.5208071337723973
Energy: 0.4090007340820452
Energy: 0.4472029881565746
Energy: 0.5117174002319634
Energy: 0.4472029881536053
Energy: 0.5117174002305778
Energy: 0.4472029881568716
Energy: 0.5117174002300333
Energy: 0.48417726259181215
Energy: 0.4598069157819065
Energy: 0.48417726259290095
Energy: 0.4598069157832922
Energy: 0.48417726259888905
Energy: 0.45980691578353966
Energy: 0.46019894526679933
Energy: 0.439943244483106
Energy: 0.4601989452626917
Energy: 0.43994324447820665
Energy: 0.4601989452651662
Energy: 0.43994324447875105
Energy: 0.5026195230931986
Energy: 0.42762101405047437
Energy: 0.5026195230964648
Energy: 0.42762101406462805
Energy: 0.5026195230929511
Energy: 0.4276210140657168
Energy: 0.4621863456749956
Energy: 0.4532287532825276
Energy: 0.4621859731532858
Energy: 0.45322875327653944
Energy: 0.4621863456697993
Energy: 0.4532287532781726
Energy: 0.4567253625314477
Energy: 0.4930921505101542
Energy: 0.45672536253520885
Energy: 0.4930921505063436
Energy: 0.45672536253223955
Energy: 0.49309215050659105
Energy: 0.47696676969476454
Energy: 0.4645935058931765
Energy: 0.47696676969506147
Energy: 0.46459350588798026
Energy: 0.4769667696966946
Energy: 0.46459350588882153
Energy: 0.47145984409556796
Energy: 0.47137715430744
Energy: 0.4714598440950236
Energy: 0.47137715430199617
Energy: 0.4714598441047728
Energy: 0.47137715430471805
Energy: 0.4483622178900742
Energy: 0.472601395195645
Energy: 0.4483641280296587
Energy: 0.4726013952117287
Energy: 0.448362217891163
Energy: 0.4726013952111843

minimum gb energy = 0.407127187859352 eV
minimum distance =  2.60493595434407 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 0.4594755539251408
Energy: 0.41988671222452045
Energy: 0.45947555392551437
Energy: 0.41988671222377333
Energy: 0.4594755539270086
Energy: 0.41988671222452045
Energy: 0.41689358386573744
Energy: 0.4478689928148827
Energy: 0.41689358386573744
Energy: 0.4478689928148827
Energy: 0.41689358386536385
Energy: 0.4478689928145091
Energy: 0.49019715753028215
Energy: 0.43265280921721155
Energy: 0.49019715753065574
Energy: 0.43265280921347593
Energy: 0.49019715753140286
Energy: 0.4326528092149702
Energy: 0.3977700596016727
Energy: 0.4238006675720215
Energy: 0.39777005960055195
Energy: 0.4238006675720215
Energy: 0.3977700596012992
Energy: 0.4238006675716479
Energy: 0.4356753653150995
Energy: 0.4434138706678236
Energy: 0.435675365315473
Energy: 0.4434138706670765
Energy: 0.4356753653147259
Energy: 0.4434138706678236
Energy: 0.3925681255216544
Energy: 0.38318480222385765
Energy: 0.3925681255216544
Energy: 0.38318480222423124
Energy: 0.39256812552090725
Energy: 0.38318480222385765
Energy: 0.4214999134064327
Energy: 0.38420737276790795
Energy: 0.4214999134060592
Energy: 0.3842073727686551
Energy: 0.42149991340717985
Energy: 0.38420737276790795
Energy: 0.45073141216609836
Energy: 0.4845197663349886
Energy: 0.45073141216609836
Energy: 0.4845197663349886
Energy: 0.4507314121657248
Energy: 0.4845197663349886
Energy: 0.454245104858409
Energy: 0.43370186834286134
Energy: 0.45424510485803543
Energy: 0.433701868343235
Energy: 0.4542451048576619
Energy: 0.43370186834286134
Energy: 0.4572739040578728
Energy: 0.49853617074573725
Energy: 0.4572739040578728
Energy: 0.49853617073042084
Energy: 0.4572739040563786
Energy: 0.4985361707229833
Energy: 0.41826952992850036
Energy: 0.41694963004691704
Energy: 0.4182695299277532
Energy: 0.4169496300465435
Energy: 0.4182695299281268
Energy: 0.41694963004729063
Energy: 0.3832463246774807
Energy: 0.41074528690709555
Energy: 0.3832463246752393
Energy: 0.41074528690709555
Energy: 0.3832463246774807
Energy: 0.4107452869063484
Energy: 0.41562657156419486
Energy: 0.4411118936870687
Energy: 0.4156265715638213
Energy: 0.44111189368672915
Energy: 0.4156265715638213
Energy: 0.4411118936870687
Energy: 0.43195321526545455
Energy: 0.4806758742246935
Energy: 0.4319532152647074
Energy: 0.48067587422394625
Energy: 0.4319532152658281
Energy: 0.480675874225067
Energy: 0.3837225518971645
Energy: 0.4666567128729375
Energy: 0.3837225518989984
Energy: 0.4666567128729375
Energy: 0.3837225518971645
Energy: 0.4666567128729375
Energy: 0.4507023820911265
Energy: 0.3847357733643439
Energy: 0.4507023820903794
Energy: 0.38473577336359677
Energy: 0.4507023820907529
Energy: 0.3847357733643439
Energy: 0.4639205249813458
Energy: 0.3825674951058672
Energy: 0.4639205249813458
Energy: 0.38256749510213134
Energy: 0.4639205249809721
Energy: 0.38256749510399923
Energy: 0.4288408650156287
Energy: 0.43969275107086714
Energy: 0.42884086501674934
Energy: 0.43969275107124073
Energy: 0.4288408650148815
Energy: 0.43969275107161426
Energy: 0.43249375396271483
Energy: 0.510527604571375
Energy: 0.43249375396234124
Energy: 0.510527604571375
Energy: 0.43249375396271483
Energy: 0.5105276045721223
Energy: 0.4231911186774636
Energy: 0.4573833570271044
Energy: 0.4231911186785843
Energy: 0.4573833570271044
Energy: 0.4231911186789579
Energy: 0.4573833570263573
Energy: 0.43928655634663466
Energy: 0.44115717360588586
Energy: 0.4392865563451404
Energy: 0.44115717360588586
Energy: 0.439286556345514
Energy: 0.44115717360625945
Energy: 0.41849589120845787
Energy: 0.42136920309238196
Energy: 0.41849589120733716
Energy: 0.42136920309238196
Energy: 0.4184958912106993
Energy: 0.42136920309275555
Energy: 0.421640542853074
Energy: 0.4352174727405825
Energy: 0.4216405428534476
Energy: 0.43521747274095607
Energy: 0.4216405428534476
Energy: 0.4352174727405825
Energy: 0.4680536340694779
Energy: 0.4495913778096985
Energy: 0.4680536340709723
Energy: 0.4495913778104456
Energy: 0.46805363407246653
Energy: 0.44959137780932495
Energy: 0.43186762614478325
Energy: 0.45373895632941846
Energy: 0.43186762614553037
Energy: 0.45373895632941846
Energy: 0.43186762614590396
Energy: 0.4537389563301656
Energy: 0.38296425768951436
Energy: 0.5337112073284153
Energy: 0.38296425768951436
Energy: 0.5337112073284153
Energy: 0.3829642576902615
Energy: 0.5337112073284153
Energy: 0.42827420475213285
Energy: 0.39825458253945845
Energy: 0.4282742047510121
Energy: 0.39825458253983204
Energy: 0.42827420475175926
Energy: 0.39825458253833773
Energy: 0.4329736559053678
Energy: 0.3826177247285922
Energy: 0.43297365590499426
Energy: 0.3826177247289657
Energy: 0.43297365590499426
Energy: 0.38261772473045996
Energy: 0.4535460143607896
Energy: 0.4152773089135324
Energy: 0.45354601436004244
Energy: 0.4152773089142795
Energy: 0.45354601436228387
Energy: 0.4152773089142795
Energy: 0.43451135688233616
Energy: 0.4038181316993087
Energy: 0.43451135687972114
Energy: 0.4038181316989351
Energy: 0.4345113568827097
Energy: 0.4038181316993087
Energy: 0.4234991889137858
Energy: 0.46253921831471384
Energy: 0.423499188914533
Energy: 0.4625392183135931
Energy: 0.4234991889137858
Energy: 0.46253921831695527
Energy: 0.3857594796902353
Energy: 0.45064008864443494
Energy: 0.3857594796894882
Energy: 0.45064008864443494
Energy: 0.3857594796887411
Energy: 0.4506400886429406
Energy: 0.38322171553971535
Energy: 0.4602197734816994
Energy: 0.38322171553896817
Energy: 0.46021977348207305
Energy: 0.38322171553822104
Energy: 0.4602197734816994
Energy: 0.38324714644744895
Energy: 0.4213305638615027
Energy: 0.38324714644408675
Energy: 0.4213305638618763
Energy: 0.38324714644782254
Energy: 0.4213305638615027
Energy: 0.4510965693955779
Energy: 0.4234001329882587
Energy: 0.45109656939520437
Energy: 0.42340013298751145
Energy: 0.4510965693948307
Energy: 0.4234001329878851
Energy: 0.4761384709109221
Energy: 0.42477067717990347
Energy: 0.4761384709101749
Energy: 0.42477067717952993
Energy: 0.4761384709109221
Energy: 0.42477067717990347
Energy: 0.4537137228044955
Energy: 0.48057774300046385
Energy: 0.45371372280524264
Energy: 0.4805777430008375
Energy: 0.4537137228033748
Energy: 0.4805777430008375
Energy: 0.4172417641084296
Energy: 0.38415657462976877
Energy: 0.41724176410917674
Energy: 0.38415657462864805
Energy: 0.4172417641084296
Energy: 0.3841565746279009

minimum gb energy = 0.38256749510213134 eV
minimum distance =  2.7321248338593 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 0.4802739301368527
Energy: 0.4185091465562401
Energy: 0.48027393013639386
Energy: 0.4185091465557812
Energy: 0.48027393013639386
Energy: 0.4185091465557812
Energy: 0.400135216207058
Energy: 0.3818532279005023
Energy: 0.40013521620659914
Energy: 0.38185322790185805
Energy: 0.400135216207058
Energy: 0.38185322790231685
Energy: 0.4468116998364087
Energy: 0.45058774224224585
Energy: 0.44681169983594987
Energy: 0.45058774224224585
Energy: 0.4468116998364087
Energy: 0.4505877422427047
Energy: 0.4284091968940396
Energy: 0.39614619779170124
Energy: 0.42840919689449847
Energy: 0.39614619779170124
Energy: 0.42840919691652407
Energy: 0.3961461977921601
Energy: 0.43295433165445146
Energy: 0.41552863261287737
Energy: 0.4329543316549103
Energy: 0.4155286326124185
Energy: 0.43295433165445146
Energy: 0.41552863261012407
Energy: 0.4400383181918952
Energy: 0.42115729687178727
Energy: 0.4400383181918952
Energy: 0.42115729687134923
Energy: 0.4400383181918952
Energy: 0.42115729687178727
Energy: 0.4010719337530134
Energy: 0.4590936552511216
Energy: 0.4010719337548489
Energy: 0.4590936552511216
Energy: 0.4010719337525546
Energy: 0.4590936552511216
Energy: 0.38776744998954593
Energy: 0.4370152797851611
Energy: 0.3877674499886283
Energy: 0.4370152797851611
Energy: 0.38776744999000484
Energy: 0.4370152797851611
Energy: 0.45440933203969636
Energy: 0.3787101956852934
Energy: 0.4544093320401552
Energy: 0.3787101956848345
Energy: 0.45440933203969636
Energy: 0.37871019568437564
Energy: 0.4050004126126632
Energy: 0.48235465277884804
Energy: 0.4050004126126632
Energy: 0.48235465277930695
Energy: 0.4050004126131221
Energy: 0.48235465277930695
Energy: 0.47132823399568435
Energy: 0.41660779702296835
Energy: 0.47132823399293117
Energy: 0.41660779702526274
Energy: 0.47132823399476664
Energy: 0.41660779702296835
Energy: 0.3877701822289111
Energy: 0.445994053319538
Energy: 0.3877701822293699
Energy: 0.4459940533199968
Energy: 0.3877701822293699
Energy: 0.44599405331907915
Energy: 0.4405813093965694
Energy: 0.4212666760440037
Energy: 0.4405813093965694
Energy: 0.4212666760440037
Energy: 0.4405813093970283
Energy: 0.4212666760440037
Energy: 0.3829186303390888
Energy: 0.4722006571773716
Energy: 0.3829186303400066
Energy: 0.4722006571773716
Energy: 0.38291863033862994
Energy: 0.47220065717691273
Energy: 0.43424306091255777
Energy: 0.45782009416993047
Energy: 0.43424306091255777
Energy: 0.4578200941703893
Energy: 0.43424306091255777
Energy: 0.4578200941703893
Energy: 0.396101016313654
Energy: 0.4479955677596094
Energy: 0.39610101631319516
Energy: 0.4479955677596094
Energy: 0.39610101631411293
Energy: 0.4479955677596094
Energy: 0.4336765273829473
Energy: 0.38251883273641873
Energy: 0.4336765273834061
Energy: 0.38251883273825427
Energy: 0.4336765273829473
Energy: 0.38251883273825427
Energy: 0.45515816473156084
Energy: 0.40308947655332794
Energy: 0.4551581647292665
Energy: 0.4030894765524102
Energy: 0.455158164730643
Energy: 0.40308947655286903
Energy: 0.4530269822558115
Energy: 0.4354919730729534
Energy: 0.4530269822558115
Energy: 0.4354919730729534
Energy: 0.4530269822558115
Energy: 0.43549197307341225
Energy: 0.43371859238092125
Energy: 0.44551112048865693
Energy: 0.433718592378168
Energy: 0.4455111204881981
Energy: 0.43371859237954463
Energy: 0.4455111204891158
Energy: 0.3950734846826608
Energy: 0.4189498071337443
Energy: 0.3950734846826608
Energy: 0.4189498071355798
Energy: 0.395073484681743
Energy: 0.41894980713695634
Energy: 0.4542390642786267
Energy: 0.4554236062182058
Energy: 0.4542390642786267
Energy: 0.4554236062182058
Energy: 0.45423906427954436
Energy: 0.4554236062182058
Energy: 0.3828772012873566
Energy: 0.40591899381484003
Energy: 0.3828772012864389
Energy: 0.40591899381254576
Energy: 0.3828772012864389
Energy: 0.40591899381621666
Energy: 0.4405389637021168
Energy: 0.47119874848447496
Energy: 0.44053896370119905
Energy: 0.4711987484826395
Energy: 0.44053896370165796
Energy: 0.47119874848401605
Energy: 0.38784793862047307
Energy: 0.45809505283344104
Energy: 0.38784793862047307
Energy: 0.45809505283344104
Energy: 0.3878479386209319
Energy: 0.45809505283344104
Energy: 0.4386020531892177
Energy: 0.45165482289932296
Energy: 0.43860205318967654
Energy: 0.45165482289932296
Energy: 0.43860205319013545
Energy: 0.45165482289932296
Energy: 0.4194974097201769
Energy: 0.4225961267812158
Energy: 0.41949740972063576
Energy: 0.4225961267789214
Energy: 0.4194974097201769
Energy: 0.4225961267853455
Energy: 0.41476027942049676
Energy: 0.437987856428625
Energy: 0.41476027941774346
Energy: 0.43798785642954274
Energy: 0.41476027941820237
Energy: 0.43798785642954274
Energy: 0.3879159809454109
Energy: 0.4382594951530276
Energy: 0.38791598094724644
Energy: 0.4382594951525687
Energy: 0.3879159809454109
Energy: 0.4382594951525687
Energy: 0.42370670343881356
Energy: 0.4206651715207059
Energy: 0.42370670343881356
Energy: 0.4206651715216237
Energy: 0.4237067034397313
Energy: 0.4206651715211648
Energy: 0.4410975793141376
Energy: 0.4210800202972828
Energy: 0.4410975793141376
Energy: 0.42108002029682395
Energy: 0.4410975793141376
Energy: 0.4210800202972828

minimum gb energy = 0.37871019568437564 eV
minimum distance =  2.70380456567425 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 0.41396418873738206
Energy: 0.37386268622220376
Energy: 0.4139641887367879
Energy: 0.3738626862227979
Energy: 0.41396418873738206
Energy: 0.37386268622220376
Energy: 0.39451016207465855
Energy: 0.3440368468035857
Energy: 0.3945101620740645
Energy: 0.3440368468029916
Energy: 0.39451016207584677
Energy: 0.34403684680536817
Energy: 0.4486634780032953
Energy: 0.44851446597504946
Energy: 0.4486634780032953
Energy: 0.44851446597504946
Energy: 0.44866347800388945
Energy: 0.44851446597504946
Energy: 0.5624498507904244
Energy: 0.3964927758470076
Energy: 0.5624498507898302
Energy: 0.3964927758464135
Energy: 0.562449850788642
Energy: 0.39649277584879
Energy: 0.481081102602214
Energy: 0.4322982238866448
Energy: 0.48108110260280806
Energy: 0.4322982238866448
Energy: 0.481081102602214
Energy: 0.43229822388605077
Energy: 0.449600711080215
Energy: 0.4119261227279583
Energy: 0.449600711080215
Energy: 0.41192612272677004
Energy: 0.449600711080215
Energy: 0.4119261227279583
Energy: 0.43320516057644237
Energy: 0.46567638857866905
Energy: 0.43320516057703645
Energy: 0.46567638857866905
Energy: 0.43320516057525416
Energy: 0.46567638857926325
Energy: 0.41487591428283543
Energy: 0.3752169340300143
Energy: 0.41487591428283543
Energy: 0.3752169340300143
Energy: 0.4148759142786765
Energy: 0.3752169340300143
Energy: 0.4402681855361548
Energy: 0.39779059341724154
Energy: 0.44026818553674896
Energy: 0.39779059341724154
Energy: 0.4402681855373431
Energy: 0.39779059341724154
Energy: 0.3610724382935021
Energy: 0.41162350823965554
Energy: 0.3610724382940963
Energy: 0.41162350823965554
Energy: 0.3610724382940963
Energy: 0.4116235082402497
Energy: 0.43320312055143595
Energy: 0.396324905565943
Energy: 0.43320312055143595
Energy: 0.39632490556119
Energy: 0.4332031205502477
Energy: 0.396324905565943
Energy: 0.4977308381686398
Energy: 0.44277978873649926
Energy: 0.4977308381662633
Energy: 0.44277978873649926
Energy: 0.4977308381692339
Energy: 0.44277978873649926
Energy: 0.42079678801584053
Energy: 0.39786788348457974
Energy: 0.42079678801643466
Energy: 0.3978678834851739
Energy: 0.42079678801584053
Energy: 0.39786788348457974
Energy: 0.48077052205853327
Energy: 0.34783413211455433
Energy: 0.48077052205853327
Energy: 0.3478341321127719
Energy: 0.48077052205853327
Energy: 0.3478341321157426
Energy: 0.4286288684081605
Energy: 0.3743017523192356
Energy: 0.4286288684093488
Energy: 0.3743017523180474
Energy: 0.42862886840637804
Energy: 0.37430175231864155
Energy: 0.5079764803428025
Energy: 0.3981796211718627
Energy: 0.5079764803433966
Energy: 0.3981796211706744
Energy: 0.5079764803433966
Energy: 0.3981796211718627
Energy: 0.3608772919269768
Energy: 0.3943921922869493
Energy: 0.3608772919269768
Energy: 0.39439219228813754
Energy: 0.3608772919275709
Energy: 0.3943921922869493
Energy: 0.43139999437212295
Energy: 0.42091461974365785
Energy: 0.43139999437212295
Energy: 0.42091461974306377
Energy: 0.43139999437390536
Energy: 0.42091461974306377
Energy: 0.3609028128573455
Energy: 0.3945576170112441
Energy: 0.3609028128573455
Energy: 0.39455761701064995
Energy: 0.3609028128561572
Energy: 0.3945576170112441
Energy: 0.507966122699191
Energy: 0.3977555318603312
Energy: 0.507966122699785
Energy: 0.3977555318603312
Energy: 0.507966122699191
Energy: 0.3977555318603312
Energy: 0.4285317068280725
Energy: 0.37441954657982307
Energy: 0.4285317068274784
Energy: 0.3744195465804172
Energy: 0.4285317068292608
Energy: 0.37441954657982307
Energy: 0.4807034571976337
Energy: 0.3955096588375956
Energy: 0.4807034571976337
Energy: 0.3955096588364073
Energy: 0.48070345719703955
Energy: 0.3955096588381897
Energy: 0.42070936318187263
Energy: 0.3978886495019326
Energy: 0.42070936318187263
Energy: 0.3978886495019326
Energy: 0.42070936318187263
Energy: 0.3978886495025267
Energy: 0.4978792117846849
Energy: 0.44295871284353056
Energy: 0.49787921178349664
Energy: 0.442958712845907
Energy: 0.49787921178349664
Energy: 0.4429587128429364

minimum gb energy = 0.3440368468029916 eV
minimum distance =  2.67129376966357 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 0.4251361196354936
Energy: 0.3627557228905449
Energy: 0.4251361196354936
Energy: 0.3627557228913852
Energy: 0.4251361196354936
Energy: 0.3627557228905449
Energy: 0.37507184070442273
Energy: 0.4364064115380351
Energy: 0.37507184070358257
Energy: 0.43640641153719495
Energy: 0.3750718407019021
Energy: 0.4364064115380351
Energy: 0.41304574429078783
Energy: 0.3972811750292456
Energy: 0.41304574429078783
Energy: 0.3972811750292456
Energy: 0.41304574429078783
Energy: 0.3972811750292456
Energy: 0.39588774035566565
Energy: 0.4675331114348039
Energy: 0.39588774035566565
Energy: 0.4675331114348039
Energy: 0.3958877403565059
Energy: 0.4675331114356442
Energy: 0.426447019341368
Energy: 0.47007157332613436
Energy: 0.4264470193405278
Energy: 0.47007157332613436
Energy: 0.426447019341368
Energy: 0.47007157332613436
Energy: 0.45407585247260585
Energy: 0.4112308576565709
Energy: 0.4540758524717657
Energy: 0.4112308576565709
Energy: 0.45407585247260585
Energy: 0.4112308576574112
Energy: 0.42203560575352694
Energy: 0.44464929877775294
Energy: 0.4220356057510063
Energy: 0.44464929877775294
Energy: 0.4220356057510063
Energy: 0.44464929877775294
Energy: 0.39612599285400296
Energy: 0.4231027926677656
Energy: 0.39612599285316274
Energy: 0.42310279266692546
Energy: 0.3961259928523225
Energy: 0.4231027926677656
Energy: 0.3880000936643178
Energy: 0.43582925701744507
Energy: 0.3880000936643178
Energy: 0.43582925701744507
Energy: 0.3880000936643178
Energy: 0.43582925701826614
Energy: 0.44222372776655605
Energy: 0.4434474908066703
Energy: 0.4422237277673962
Energy: 0.4434474908066703
Energy: 0.44222372776655605
Energy: 0.4434474908066703
Energy: 0.4423102473970545
Energy: 0.434766171372635
Energy: 0.4423102473970545
Energy: 0.434766171372635
Energy: 0.4423102473970545
Energy: 0.434766171372635
Energy: 0.41481117801585127
Energy: 0.39764212910536423
Energy: 0.41481117801669154
Energy: 0.397642129104524
Energy: 0.41481117801753176
Energy: 0.39764212910536423
Energy: 0.4205425226662891
Energy: 0.41040449931763673
Energy: 0.4205425226671294
Energy: 0.41040449931847695
Energy: 0.4205425226662891
Energy: 0.41040449931763673
Energy: 0.37426527213464067
Energy: 0.39962037544351503
Energy: 0.3742652721354809
Energy: 0.39962037544267476
Energy: 0.37426527213464067
Energy: 0.39962037544267476
Energy: 0.3706630580092647
Energy: 0.5011019772983187
Energy: 0.3706630580084244
Energy: 0.5011019772983187
Energy: 0.3706630580084244
Energy: 0.5011019772983187
Energy: 0.4601199199348398
Energy: 0.41010665483276904
Energy: 0.4601199199348398
Energy: 0.4101066548319289
Energy: 0.46011991993567997
Energy: 0.4101066548319289
Energy: 0.37324528826423264
Energy: 0.3994697137115078
Energy: 0.3732452882633924
Energy: 0.3994697137115078
Energy: 0.3732452882633924
Energy: 0.3994697137115078

minimum gb energy = 0.3627557228905449 eV
minimum distance =  2.67853728074612 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 0.39219726899705054
Energy: 0.3549345721778069
Energy: 0.39219726899672613
Energy: 0.35493457217878027
Energy: 0.39219726899672613
Energy: 0.35493457217942925
Energy: 0.3763052949979876
Energy: 0.4021093338597011
Energy: 0.3763052949983121
Energy: 0.4021093338597011
Energy: 0.3763052949983121
Energy: 0.4021093338593767
Energy: 0.3937897877390709
Energy: 0.4032444951684843
Energy: 0.3937897877387464
Energy: 0.4032444951688088
Energy: 0.393789787738422
Energy: 0.4032444951688088
Energy: 0.3746709227610577
Energy: 0.36281849566326485
Energy: 0.37467092275781305
Energy: 0.3628184956629404
Energy: 0.3746709227581375
Energy: 0.36281849566326485
Energy: 0.4238346869905232
Energy: 0.4275850934782741
Energy: 0.4238346870148582
Energy: 0.4275850934782741
Energy: 0.4238346870132359
Energy: 0.4275850934779496
Energy: 0.3730754455821786
Energy: 0.3416307057779152
Energy: 0.3730754455818541
Energy: 0.3416307057785642
Energy: 0.3730754455815296
Energy: 0.34163070577759075
Energy: 0.3591742984062377
Energy: 0.4061003508607
Energy: 0.35917429840461546
Energy: 0.4061003508610244
Energy: 0.3591742984026687
Energy: 0.4061003508607
Energy: 0.39736610596050626
Energy: 0.47170719354815116
Energy: 0.39736610595855937
Energy: 0.47170719354782675
Energy: 0.3973661059588839
Energy: 0.4717071935484757
Energy: 0.4228372068973471
Energy: 0.36840169221767327
Energy: 0.4228372068983206
Energy: 0.36840169220858815
Energy: 0.4228372068983206
Energy: 0.36840169221572644
Energy: 0.3599596989967062
Energy: 0.38476358096026786
Energy: 0.35995969899475944
Energy: 0.3847635809605923
Energy: 0.35995969899930197
Energy: 0.38476358096124125
Energy: 0.403706662948585
Energy: 0.4563792232476048
Energy: 0.40370666295020735
Energy: 0.45637922324857816
Energy: 0.403706662948585
Energy: 0.45637922324792923
Energy: 0.38919937058747733
Energy: 0.4135844152689755
Energy: 0.3891993705855305
Energy: 0.4135844152692999
Energy: 0.389199370586504
Energy: 0.4135844152689755
Energy: 0.41202951797562304
Energy: 0.41050856075670517
Energy: 0.41202951797692083
Energy: 0.41050856075702963
Energy: 0.41202951797335174
Energy: 0.41050856075702963
Energy: 0.4121800823561143
Energy: 0.40160960369200965
Energy: 0.41218008235546544
Energy: 0.40160960369298304
Energy: 0.4121800823548165
Energy: 0.40160960369233417
Energy: 0.39367121179370795
Energy: 0.3828901882976306
Energy: 0.39367121179468145
Energy: 0.3828901882973062
Energy: 0.3936712117976016
Energy: 0.3828901882969817
Energy: 0.40208176006604546
Energy: 0.4463746866563543
Energy: 0.402081760065721
Energy: 0.4450441856812304
Energy: 0.40208176006734336
Energy: 0.4230884714877379
Energy: 0.3509029099032357
Energy: 0.3633137880222392
Energy: 0.35090290990193784
Energy: 0.3633137880222392
Energy: 0.35090290990356016
Energy: 0.36331378802191466
Energy: 0.41317667944289943
Energy: 0.4663026146881595
Energy: 0.41317667944517067
Energy: 0.4663026146881595
Energy: 0.4131766794432239
Energy: 0.46630261468880846
Energy: 0.4324445497129566
Energy: 0.4240688758331467
Energy: 0.43244454971587676
Energy: 0.4240688758331467
Energy: 0.43244454971457896
Energy: 0.4240688758331467
Energy: 0.35031591364016357
Energy: 0.37206537474897
Energy: 0.3503159136433788
Energy: 0.37206537474799656
Energy: 0.35031591364016357
Energy: 0.3755964272632403
Energy: 0.4321079763792724
Energy: 0.4241020975660234
Energy: 0.4321079763802458
Energy: 0.4241020975656989
Energy: 0.4321079763795969
Energy: 0.4241020975653744
Energy: 0.4131932078784896
Energy: 0.46630292339446533
Energy: 0.41319320787784064
Energy: 0.4663029233941409
Energy: 0.41319320787816516
Energy: 0.46630292339446533
Energy: 0.3509984214838413
Energy: 0.3632394384374733
Energy: 0.35099842148513916
Energy: 0.3632394384374733
Energy: 0.35099842148416577
Energy: 0.36323943843714884
Energy: 0.4020807800365004
Energy: 0.46866872545543015
Energy: 0.40208078003747383
Energy: 0.4686687254557546
Energy: 0.4020807800365004
Energy: 0.46866872545510563
Energy: 0.39369756552184215
Energy: 0.38300067233873314
Energy: 0.39369756552054425
Energy: 0.3830006723367863
Energy: 0.3936975655211932
Energy: 0.38300067234392454
Energy: 0.41217888481453613
Energy: 0.4017574737438619
Energy: 0.41217888481810533
Energy: 0.4017574737445108
Energy: 0.41217888481486065
Energy: 0.4017574737438619
Energy: 0.4121641566298914
Energy: 0.41039950530293007
Energy: 0.4121641566295669
Energy: 0.41039950530293007
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Energy: 0.41039950530357905
Energy: 0.3893530994228358
Energy: 0.41325932392999715
Energy: 0.38935309942413365
Energy: 0.41325932392934817
Energy: 0.38935309942348467
Energy: 0.41325932392967263
Energy: 0.40362687217560783
Energy: 0.460005229970779
Energy: 0.4036268721746345
Energy: 0.46000522997013005
Energy: 0.4036268721746345
Energy: 0.460005229970779
Energy: 0.36028333712313293
Energy: 0.3898935142026857
Energy: 0.36028333712507965
Energy: 0.3898935142026857
Energy: 0.3602833371237818
Energy: 0.3898935142023613
Energy: 0.4226367194995713
Energy: 0.36832598289654916
Energy: 0.4226367194976245
Energy: 0.3683259828975225
Energy: 0.422636719497949
Energy: 0.36832598289719803
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Energy: 0.47179806532784707
Energy: 0.3970449443071629
Energy: 0.4717980653281715
Energy: 0.3970449443055406
Energy: 0.47179806532784707
Energy: 0.3592795794386796
Energy: 0.40614348365606373
Energy: 0.3592795794377061
Energy: 0.40614348365606373
Energy: 0.35927957944127525
Energy: 0.4061434836563882
Energy: 0.3731615604156642
Energy: 0.3386010286961961
Energy: 0.3731615604146908
Energy: 0.33860102869652065
Energy: 0.3731615604146908
Energy: 0.33860102869587166
Energy: 0.4236235066756953
Energy: 0.4274277392990857
Energy: 0.4236235066763443
Energy: 0.4274277392990857
Energy: 0.4236235066873467
Energy: 0.42742773929843675
Energy: 0.3747440270294455
Energy: 0.362811366275859
Energy: 0.37474402702684984
Energy: 0.36281136627553456
Energy: 0.37474402702717424
Energy: 0.36281136627553456
Energy: 0.39381892002164653
Energy: 0.40324552632920946
Energy: 0.39381892002294444
Energy: 0.4032455263285605
Energy: 0.39381892002067315
Energy: 0.40324552632791155
Energy: 0.37632989959110646
Energy: 0.3999742282356072
Energy: 0.37632989958883517
Energy: 0.3999742282349582
Energy: 0.37632989959207985
Energy: 0.3999742282349582
Energy: 0.39219726899932184
Energy: 0.3549345721797537
Energy: 0.3921972689999708
Energy: 0.35493457217618457
Energy: 0.39219726899899743
Energy: 0.3549345721774825
Energy: 0.37630529498857807
Energy: 0.402109333856132
Energy: 0.37630529498987597
Energy: 0.4021093338558075
Energy: 0.37630529498987597
Energy: 0.4021093338558075
Energy: 0.39378978773517737
Energy: 0.4032444951668619
Energy: 0.39378978773485285
Energy: 0.403244495166213
Energy: 0.3937897877345284
Energy: 0.4032444951665375
Energy: 0.37467092276657366
Energy: 0.3736960290780135
Energy: 0.3746709227698183
Energy: 0.3736960290780135
Energy: 0.3746709227672226
Energy: 0.37369602907736454
Energy: 0.4238346870132359
Energy: 0.4275850934714603
Energy: 0.4238346869976614
Energy: 0.4275850934714603
Energy: 0.42383468702686344
Energy: 0.4275850934717847

minimum gb energy = 0.33860102869587166 eV
minimum distance =  2.61540338570502 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.37224065415957014
Energy: 0.33604399504409876
Energy: 0.3722406541611551
Energy: 0.33604399504409876
Energy: 0.3722406541590418
Energy: 0.33604399504409876
Energy: 0.392187046442009
Energy: 0.3839671309003306
Energy: 0.392187046443594
Energy: 0.3839671309008589
Energy: 0.392187046442009
Energy: 0.3839671309003306
Energy: 0.38480821960390277
Energy: 0.3829768238589195
Energy: 0.38480821960443107
Energy: 0.38297682385839116
Energy: 0.38480821960390277
Energy: 0.38297682385944776
Energy: 0.3571410508460609
Energy: 0.3666042503869927
Energy: 0.35714105085609876
Energy: 0.3666042503869927
Energy: 0.35714105085028736
Energy: 0.3666042503869927
Energy: 0.3893936159507027
Energy: 0.3812742934971065
Energy: 0.3893936159580991
Energy: 0.38127429349763486
Energy: 0.3893936159538726
Energy: 0.38127429349763486
Energy: 0.3627136850242418
Energy: 0.32718779305119255
Energy: 0.3627136850252984
Energy: 0.3271877930522492
Energy: 0.3627136850247701
Energy: 0.32718779305172085
Energy: 0.44795072936475905
Energy: 0.38605461385769085
Energy: 0.447950729366344
Energy: 0.38605461385716255
Energy: 0.44795072936528746
Energy: 0.38605461385716255
Energy: 0.4419576382314265
Energy: 0.4140022622539959
Energy: 0.44195763823036993
Energy: 0.4140022622545242
Energy: 0.44195763823089823
Energy: 0.41400226225346753
Energy: 0.3769532699099104
Energy: 0.32834180209443486
Energy: 0.3769532699099104
Energy: 0.32834180209337827
Energy: 0.37695326991043876
Energy: 0.32834180209337827
Energy: 0.381497744008185
Energy: 0.3755449434889152
Energy: 0.38149774400924147
Energy: 0.3755449434889152
Energy: 0.3814977440087132
Energy: 0.3755449434883868
Energy: 0.44789414557849344
Energy: 0.4489049133096557
Energy: 0.44789414557849344
Energy: 0.4489049133096557
Energy: 0.4478941455790217
Energy: 0.4489049133096557
Energy: 0.34777489595506256
Energy: 0.4397494159328202
Energy: 0.3477748959540059
Energy: 0.43974941593387684
Energy: 0.34777489595506256
Energy: 0.4397494159333485
Energy: 0.3374633260399749
Energy: 0.378123933436452
Energy: 0.3374633260410315
Energy: 0.3781239334359237
Energy: 0.33746332603944657
Energy: 0.3781239334359237
Energy: 0.4329897158789083
Energy: 0.3981329274224982
Energy: 0.4329897158799648
Energy: 0.3981329274224982
Energy: 0.4329897158804932
Energy: 0.3981329274251397
Energy: 0.37757695345362247
Energy: 0.44440849881853833
Energy: 0.3775769534525658
Energy: 0.4444084988174817
Energy: 0.37757695345362247
Energy: 0.4444084988180099
Energy: 0.395337567011132
Energy: 0.4008959105890135
Energy: 0.3953375670106037
Energy: 0.4008959105900701
Energy: 0.3953375670137736
Energy: 0.4008959105895418
Energy: 0.39584488496014936
Energy: 0.4004426163791539
Energy: 0.3958448849606776
Energy: 0.40044261637862555
Energy: 0.39584488496014936
Energy: 0.4004426163791539
Energy: 0.42390892247341366
Energy: 0.3660565485308267
Energy: 0.42390892247182876
Energy: 0.36605654853558145
Energy: 0.42390892247235706
Energy: 0.3660565485318833
Energy: 0.38317891520883596
Energy: 0.41076479305771363
Energy: 0.3831789152093643
Energy: 0.4107647930571853
Energy: 0.3831789152104209
Energy: 0.41076479305771363
Energy: 0.38390784663731975
Energy: 0.36421803833096855
Energy: 0.38390784663362165
Energy: 0.36421803833044025
Energy: 0.3839078466367915
Energy: 0.36421803833044025
Energy: 0.3895214917641231
Energy: 0.4394988454442851
Energy: 0.38952149176306655
Energy: 0.43949884544322854
Energy: 0.3895214917614816
Energy: 0.4394988454437568
Energy: 0.35619744274237236
Energy: 0.41291147376894016
Energy: 0.3561974427392025
Energy: 0.41291147377950643
Energy: 0.35619744274237236
Energy: 0.4129114737699968
Energy: 0.3363629904713379
Energy: 0.34780673473447965
Energy: 0.3363629904718662
Energy: 0.34780673473500795
Energy: 0.3363629904723945
Energy: 0.34780673473500795
Energy: 0.3830754824558538
Energy: 0.4126048749722335
Energy: 0.3830754824569105
Energy: 0.4126048749727618
Energy: 0.3830754824553255
Energy: 0.4126048749732901
Energy: 0.42041855334837885
Energy: 0.45809221222620106
Energy: 0.4204185533489072
Energy: 0.45809221222567276
Energy: 0.4204185533499637
Energy: 0.45809221222620106
Energy: 0.3355123648979187
Energy: 0.34779370751054467
Energy: 0.3355123648989753
Energy: 0.34779370751054467
Energy: 0.3355123648995036
Energy: 0.34779370751001637
Energy: 0.356274103078172
Energy: 0.4106760428368221
Energy: 0.35627410307500207
Energy: 0.4106760428373504
Energy: 0.3562741030771153
Energy: 0.4106760428373504

minimum gb energy = 0.32718779305119255 eV
minimum distance =  2.64561367479179 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.40957494815378553
Energy: 0.31439527856858396
Energy: 0.40957494815340056
Energy: 0.3143952785705086
Energy: 0.4095749481541704
Energy: 0.3143952785689689
Energy: 0.34865441605592096
Energy: 0.34875131632252654
Energy: 0.34865441605592096
Energy: 0.34875131632252654
Energy: 0.34865441605553604
Energy: 0.3487513163236813
Energy: 0.34973572193525393
Energy: 0.3501279680424625
Energy: 0.3497357219360238
Energy: 0.3501279680428474
Energy: 0.349735721934869
Energy: 0.3501279680428474
Energy: 0.3966064053968223
Energy: 0.32685061798121434
Energy: 0.3966064053968223
Energy: 0.32685061798005954
Energy: 0.3966064053975921
Energy: 0.3268506179785198
Energy: 0.40306005138416634
Energy: 0.33895059923574866
Energy: 0.40306005138416634
Energy: 0.33895059923574866
Energy: 0.4030600513837814
Energy: 0.33895059923574866
Energy: 0.3294405698418707
Energy: 0.33654233290154806
Energy: 0.3294405698426406
Energy: 0.33654233290154806
Energy: 0.3294405698418707
Energy: 0.33654233290116314
Energy: 0.3846906575120004
Energy: 0.3415839492584215
Energy: 0.3846906575108456
Energy: 0.3415839492584215
Energy: 0.3846906575112305
Energy: 0.3415839492584215
Energy: 0.423772381663202
Energy: 0.38029472528815533
Energy: 0.42377238166358694
Energy: 0.38029472528815533
Energy: 0.423772381663202
Energy: 0.38029472528815533
Energy: 0.31526722008275776
Energy: 0.33534741136285523
Energy: 0.3152672200842975
Energy: 0.3353474113624703
Energy: 0.31526722008352764
Energy: 0.3353474113624703
Energy: 0.34350880155559393
Energy: 0.32725830190718097
Energy: 0.34350880155674873
Energy: 0.32725830190718097
Energy: 0.34350880155559393
Energy: 0.327258301906796
Energy: 0.3946309790583374
Energy: 0.3836855337570053
Energy: 0.3946309790583374
Energy: 0.3836855337573903
Energy: 0.3946309790591073
Energy: 0.3836855337573903
Energy: 0.3445158143685569
Energy: 0.3348871832086586
Energy: 0.34451581436778705
Energy: 0.33488718320788874
Energy: 0.3445158143685569
Energy: 0.3348871832082737
Energy: 0.3434383230015313
Energy: 0.3282368166803497
Energy: 0.3434383230007615
Energy: 0.3282368166803497
Energy: 0.34343832300114646
Energy: 0.3282368166803497
Energy: 0.39135337171912316
Energy: 0.3830209339624715
Energy: 0.3913533717195081
Energy: 0.3830209339628564
Energy: 0.39135337171912316
Energy: 0.3830209339628564
Energy: 0.3274276672249961
Energy: 0.3348010234678155
Energy: 0.3274276672242262
Energy: 0.3348010234674306
Energy: 0.3274276672234564
Energy: 0.33480102346858537
Energy: 0.34371686251057404
Energy: 0.3267244716854217
Energy: 0.34371686250980416
Energy: 0.32672447168619156
Energy: 0.3437168625090343
Energy: 0.3267244716854217
Energy: 0.38644583362025725
Energy: 0.3825713201028024
Energy: 0.3864458336198724
Energy: 0.38257132010241746
Energy: 0.3864458336198724
Energy: 0.3825713201028024
Energy: 0.3159381722446721
Energy: 0.3790237607542597
Energy: 0.31593817224390225
Energy: 0.3790237607542597
Energy: 0.31593817224390225
Energy: 0.3790237607546446
Energy: 0.33550117088056736
Energy: 0.336450071741447
Energy: 0.33550117088210707
Energy: 0.336450071741447
Energy: 0.33550117088095227
Energy: 0.33645007174106206
Energy: 0.3895820908911074
Energy: 0.39371222055614896
Energy: 0.38958209089341694
Energy: 0.39371222055614896
Energy: 0.3895820908926471
Energy: 0.39371222055614896
Energy: 0.3388381078495484
Energy: 0.36508991251531114
Energy: 0.33883810784762375
Energy: 0.36508991251492623
Energy: 0.33883810784839363
Energy: 0.36508991251492623
Energy: 0.3530710008993825
Energy: 0.35275704085405063
Energy: 0.35307100089899757
Energy: 0.3527570408528959
Energy: 0.3530710008997674
Energy: 0.35275704085366577
Energy: 0.3549727670096737
Energy: 0.3508412471344083
Energy: 0.35497276700928876
Energy: 0.3508412471347932
Energy: 0.3549727670096737
Energy: 0.3508412471351781
Energy: 0.37326193850326506
Energy: 0.3996364405260735
Energy: 0.37326193850403494
Energy: 0.3996364405260735
Energy: 0.37326193850403494
Energy: 0.3996364405260735
Energy: 0.3397833918375426
Energy: 0.3474645197278537
Energy: 0.33978339183831247
Energy: 0.3474645197282386
Energy: 0.33978339183831247
Energy: 0.3474645197278537
Energy: 0.3389288300486997
Energy: 0.3352927497790767
Energy: 0.3389288300490847
Energy: 0.3352927497794616
Energy: 0.3389288300486997
Energy: 0.3352927497798466
Energy: 0.32179065131382095
Energy: 0.38791773193884105
Energy: 0.32179065131420587
Energy: 0.38791773193922596
Energy: 0.32829413183507433
Energy: 0.38791773193922596
Energy: 0.33386712469843155
Energy: 0.3430604064584793
Energy: 0.33386712469265756
Energy: 0.3430604064577094
Energy: 0.33386712468842333
Energy: 0.3430604064584793
Energy: 0.29718852504915805
Energy: 0.3138887776297206
Energy: 0.2971885250503128
Energy: 0.3138887776293357
Energy: 0.29718852504761833
Energy: 0.3138887776293357
Energy: 0.33009862427227077
Energy: 0.3856819810834297
Energy: 0.33009862427227077
Energy: 0.3856819810830448
Energy: 0.33009862427227077
Energy: 0.3856819810838147
Energy: 0.3370488682310907
Energy: 0.4359400430641593
Energy: 0.3370488682318606
Energy: 0.4359400430641593
Energy: 0.34025913773748734
Energy: 0.43594004306454426
Energy: 0.29791077751625605
Energy: 0.30642662065950454
Energy: 0.29791077751702594
Energy: 0.30642662065950454
Energy: 0.29791077751587114
Energy: 0.30642662065950454
Energy: 0.3425047657447845
Energy: 0.3400511351702116
Energy: 0.3425047657455544
Energy: 0.3400511351713664
Energy: 0.3425047657455544
Energy: 0.3400511351702116
Energy: 0.3920662465429683
Energy: 0.3872166474422177
Energy: 0.3920662465425834
Energy: 0.3872166474433724
Energy: 0.39206624654219846
Energy: 0.3872166474433724
Energy: 0.33054399724577
Energy: 0.3262142537670379
Energy: 0.3305439972450001
Energy: 0.326214253766268
Energy: 0.33054399724461525
Energy: 0.326214253766653
Energy: 0.30321282448174863
Energy: 0.33905420058156693
Energy: 0.30321282448213355
Energy: 0.33905420058657104
Energy: 0.30321282448136366
Energy: 0.3390542005827217

minimum gb energy = 0.29718852504761833 eV
minimum distance =  2.63786624189575 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.06658591062307148
Energy: 0.09097890406244022
Energy: 0.06658591062292683
Energy: 0.09097890406231164
Energy: 0.06658591062307148
Energy: 0.09097890406244022
Energy: 0.36549117919032026
Energy: 0.06741558182746434
Energy: 0.365491179190031
Energy: 0.0674155818305662
Energy: 0.365491179190031
Energy: 0.06741558182802684
Energy: 0.3654911524501709
Energy: 0.0676729219625024
Energy: 0.36549115245568353
Energy: 0.06767292196745252
Energy: 0.3654911524528549
Energy: 0.06767292196872221
Energy: 0.06658591062307148
Energy: 0.090978904062167
Energy: 0.06658591062307148
Energy: 0.09097890406231164
Energy: 0.0665859106233447
Energy: 0.09097890406231164
Energy: 0.3654911791898863
Energy: 0.0674155818145908
Energy: 0.3654911791898863
Energy: 0.06741558180822635
Energy: 0.36549117918946844
Energy: 0.06741558181402829
Energy: 0.36549115244480285
Energy: 0.06767292190411343
Energy: 0.3654911524531442
Energy: 0.06767292189901868
Energy: 0.36549115244480285
Energy: 0.06767292189606146
Energy: 0.06658591062320006
Energy: 0.090978904062167
Energy: 0.06658591062320006
Energy: 0.09097890406231164
Energy: 0.06658591062320006
Energy: 0.09097890406231164
Energy: 0.3654911791893238
Energy: 0.06741558178321859
Energy: 0.36549117919017554
Energy: 0.06741558178419897
Energy: 0.3654911791898863
Energy: 0.06741558178476148
Energy: 0.3654911524442404
Energy: 0.06767292182720974
Energy: 0.3654911524446582
Energy: 0.06767292182523289
Energy: 0.36549115245582814
Energy: 0.06767292183145271
Energy: 0.0665859106233447
Energy: 0.09097890406231164
Energy: 0.06658591062320006
Energy: 0.09097890406231164
Energy: 0.06658591062307148
Energy: 0.090978904062167

minimum gb energy = 0.06658591062292683 eV
minimum distance =  2.83246530142189 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.3176103341474767
Energy: 0.31416985854282514
Energy: 0.317610334146207
Energy: 0.3141698585424019
Energy: 0.31761033415001616
Energy: 0.31416985854282514
Energy: 0.3372366749548893
Energy: 0.32981643499214397
Energy: 0.3372366749548893
Energy: 0.32981643499214397
Energy: 0.3372366749544661
Energy: 0.32981643499214397
Energy: 0.35920170136021184
Energy: 0.3295320173758297
Energy: 0.3675573655293806
Energy: 0.3295320173758297
Energy: 0.3554718203426466
Energy: 0.32953201737625293
Energy: 0.33385390969677
Energy: 0.32510034155232953
Energy: 0.33385390969677
Energy: 0.32510034155232953
Energy: 0.3338539096980397
Energy: 0.32510034155232953
Energy: 0.2829370299399191
Energy: 0.33683949491092746
Energy: 0.28293702994161213
Energy: 0.33683949491304366
Energy: 0.2829370299407656
Energy: 0.3368394949113507
Energy: 0.35597559998991124
Energy: 0.36185204764507184
Energy: 0.35597559998906475
Energy: 0.36185204764549517
Energy: 0.355975599989488
Energy: 0.36185204764549517
Energy: 0.36010153340495354
Energy: 0.3509387002936893
Energy: 0.36010153340580003
Energy: 0.35093870029411256
Energy: 0.3601015334053768
Energy: 0.3509387002936893
Energy: 0.2833246290098241
Energy: 0.3314068844181944
Energy: 0.2833246290081311
Energy: 0.3314068844186176
Energy: 0.2833246290077079
Energy: 0.3314068844181944
Energy: 0.3574885866753647
Energy: 0.36871576333658174
Energy: 0.3574885866762112
Energy: 0.36871576333658174
Energy: 0.3574885866757879
Energy: 0.3687157633361585
Energy: 0.3256803322740032
Energy: 0.3410816201813545
Energy: 0.3256803322756962
Energy: 0.3410816201809313
Energy: 0.3256803322731567
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Energy: 0.3467530376395224
Energy: 0.33065879599565434
Energy: 0.3467530376395224
Energy: 0.33065879599565434
Energy: 0.3467530376390992
Energy: 0.33065879599607756
Energy: 0.36798219860382125
Energy: 0.3782231031431616
Energy: 0.36798219860382125
Energy: 0.3782231031431616
Energy: 0.36798219860382125
Energy: 0.3782231031431616
Energy: 0.3664327357036112
Energy: 0.3272300274691287
Energy: 0.3664327357036112
Energy: 0.3272300274691287
Energy: 0.36643273570530416
Energy: 0.32723002746955193
Energy: 0.3029642236275042
Energy: 0.32588533845805917
Energy: 0.3029642236266577
Energy: 0.3258853384572127
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Energy: 0.3258853384576359
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Energy: 0.3273042437767908
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Energy: 0.3273042437742514
Energy: 0.36534220702790376
Energy: 0.2809467196771432
Energy: 0.3653422070274805
Energy: 0.2809467196779897
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Energy: 0.2809467196724876
Energy: 0.33184342414278883
Energy: 0.2906926777064742
Energy: 0.33184342414278883
Energy: 0.2906926777052045
Energy: 0.3318434241423656
Energy: 0.29069267770689755
Energy: 0.3320665920238392
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Energy: 0.3142238355689293
Energy: 0.33206659202299277
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Energy: 0.3617256439837792
Energy: 0.36440021502203446
Energy: 0.3617256439842025
Energy: 0.36440021502203446
Energy: 0.36172564398462576
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Energy: 0.3571679541410625
Energy: 0.3449146443827504
Energy: 0.35716795414063923
Energy: 0.3449146443780947
Energy: 0.3571679541410625
Energy: 0.34491464438021097
Energy: 0.34077385520229503
Energy: 0.2951229773171308
Energy: 0.3407738552014486
Energy: 0.2951229773162843
Energy: 0.3407738552027183
Energy: 0.2951229773171308
Energy: 0.3396986232082366
Energy: 0.34562317809786763
Energy: 0.33969862320865984
Energy: 0.3456231780974444
Energy: 0.3396986232078326
Energy: 0.34562317809829085
Energy: 0.3391454114443395
Energy: 0.3718351990663827
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Energy: 0.37183519906680584
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Energy: 0.3718351990663827
Energy: 0.36156196817289254
Energy: 0.2866502246008777
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Energy: 0.2866502246004544
Energy: 0.3615619681733158
Energy: 0.28665022460130085
Energy: 0.3644557119198842
Energy: 0.3561778009445325
Energy: 0.3644557119203074
Energy: 0.3561778009441093
Energy: 0.3644557119207306
Energy: 0.3561778009445325
Energy: 0.31427877602973964
Energy: 0.3675778755224589
Energy: 0.3142787760293164
Energy: 0.3675778755224589
Energy: 0.31427877602973964
Energy: 0.3675778755216124
Energy: 0.36759597810503136
Energy: 0.2865522005436966
Energy: 0.36759597810503136
Energy: 0.2865522005411571
Energy: 0.36759597810503136
Energy: 0.2865522005436966
Energy: 0.36252414981278497
Energy: 0.3602539447158964
Energy: 0.3625241498132082
Energy: 0.36025394471631966
Energy: 0.3625241498123617
Energy: 0.36025394471631966
Energy: 0.3014763468776278
Energy: 0.336857733359812
Energy: 0.3014763468776278
Energy: 0.3368577333606585
Energy: 0.301476346878051
Energy: 0.3368577333593888
Energy: 0.3724897102307908
Energy: 0.30832687073289067
Energy: 0.3724897102307908
Energy: 0.3083268707345836
Energy: 0.37248971023036764
Energy: 0.30832687073289067
Energy: 0.36494447734532204
Energy: 0.3521020288279112
Energy: 0.36494447734532204
Energy: 0.3521020288274879
Energy: 0.36494447734574526
Energy: 0.3521020288274879
Energy: 0.3420965815213854
Energy: 0.3321156525031395
Energy: 0.3420965815213854
Energy: 0.33211565250356284
Energy: 0.3420965815209622
Energy: 0.3321156525031395
Energy: 0.2836857211390897
Energy: 0.3072873975475551
Energy: 0.2836857211395129
Energy: 0.3072873975437459
Energy: 0.2836857211395129
Energy: 0.3072873975445924

minimum gb energy = 0.2809467196724876 eV
minimum distance =  2.68011341104343 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 0.43027152976219235
Energy: 0.3720415362803557
Energy: 0.4302715297615892
Energy: 0.3720415362803557
Energy: 0.43027152976219235
Energy: 0.37204153628156184
Energy: 0.3881058923393904
Energy: 0.38050957547564807
Energy: 0.38810589233818427
Energy: 0.38050957547504505
Energy: 0.3881058923393904
Energy: 0.38050957547564807
Energy: 0.42747279084294026
Energy: 0.4110328277012425
Energy: 0.4274727908423373
Energy: 0.4110328277012425
Energy: 0.43947080248854076
Energy: 0.4110328277012425
Energy: 0.44198162672889774
Energy: 0.36405316320276826
Energy: 0.44198162673010394
Energy: 0.3640531632033713
Energy: 0.4419816267295008
Energy: 0.3640531632033713
Energy: 0.3797595824477517
Energy: 0.3753401464526595
Energy: 0.3797595824477517
Energy: 0.3753401464526595
Energy: 0.3797595824477517
Energy: 0.3753401464526595
Energy: 0.4100016342390397
Energy: 0.4216367163200738
Energy: 0.4100016342396427
Energy: 0.4216367163200738
Energy: 0.4100016342396427
Energy: 0.42163671632067684
Energy: 0.38005939396173893
Energy: 0.4075671259897635
Energy: 0.3800593939629451
Energy: 0.40756712598916045
Energy: 0.38005939396234195
Energy: 0.4075671259897635
Energy: 0.41275611964847764
Energy: 0.3726842606775078
Energy: 0.41275611964847764
Energy: 0.3726842606775078
Energy: 0.4127561196472989
Energy: 0.3726842606781109
Energy: 0.4225028062483054
Energy: 0.4416681277237654
Energy: 0.4225028062483054
Energy: 0.4416681277237654
Energy: 0.42250280624772973
Energy: 0.4416681277237654
Energy: 0.35144819831885166
Energy: 0.38365020898245206
Energy: 0.35144819832005786
Energy: 0.3836502089830551
Energy: 0.35144819831945473
Energy: 0.3836502089830551
Energy: 0.4136354133968274
Energy: 0.4150146714172967
Energy: 0.41363541339622434
Energy: 0.4150146714172967
Energy: 0.41363541339562127
Energy: 0.4150146714172967
Energy: 0.37498134735506256
Energy: 0.4060741020055856
Energy: 0.37498134735626865
Energy: 0.4060741020049825
Energy: 0.3749813473574748
Energy: 0.4060741020049825
Energy: 0.40712908595544356
Energy: 0.4050051610304893
Energy: 0.4071290859560465
Energy: 0.40500516103109235
Energy: 0.40712908595544356
Energy: 0.40500516103109235
Energy: 0.3716618889744423
Energy: 0.4220842541198523
Energy: 0.3716618889750454
Energy: 0.4220842541228677
Energy: 0.3716618889744423
Energy: 0.4220842541228677
Energy: 0.37622144648436967
Energy: 0.3749826154632501
Energy: 0.3762214464849728
Energy: 0.37498261546385314
Energy: 0.37622144648436967
Energy: 0.37498261546385314
Energy: 0.37253969012210775
Energy: 0.3965796256180386
Energy: 0.37253969012210775
Energy: 0.3965796256180386
Energy: 0.3725396901227108
Energy: 0.3965796256180386
Energy: 0.374245699803054
Energy: 0.38221335412681795
Energy: 0.374245699803054
Energy: 0.38221335412681795
Energy: 0.3742456998024509
Energy: 0.3822133541250088
Energy: 0.39109824772838103
Energy: 0.31795400030047216
Energy: 0.39109824772838103
Energy: 0.3179540002998691
Energy: 0.391098247727778
Energy: 0.3179540003022813
Energy: 0.37730518632469384
Energy: 0.42147523934429965
Energy: 0.37730518632348764
Energy: 0.42147523934490266
Energy: 0.37730518632529686
Energy: 0.42147523934429965
Energy: 0.3942681449127844
Energy: 0.3567059536791844
Energy: 0.3942681449127844
Energy: 0.35670595367978747
Energy: 0.3942681449121814
Energy: 0.3567059536785813
Energy: 0.3800492724245458
Energy: 0.3755050614576308
Energy: 0.3800492724299734
Energy: 0.3755050614576308
Energy: 0.3800492724275611
Energy: 0.3755050614570277
Energy: 0.38831908475537696
Energy: 0.4442546547623319
Energy: 0.38831908475778926
Energy: 0.4442546547623319
Energy: 0.38831908475718624
Energy: 0.4442546547623319
Energy: 0.343317109838613
Energy: 0.35586001378697335
Energy: 0.36321599742964034
Energy: 0.3558600137899887
Energy: 0.3714746280780282
Energy: 0.35586001378938564

minimum gb energy = 0.3179540002998691 eV
minimum distance =  2.71035554153189 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 0.45235372175903743
Energy: 0.36624305511844496
Energy: 0.4523537217598025
Energy: 0.3662430551180623
Energy: 0.4523537217609503
Energy: 0.36624305511844496
Energy: 0.3995061879989287
Energy: 0.40278125541062465
Energy: 0.3995061879993112
Energy: 0.40278125541100723
Energy: 0.3995061879993112
Energy: 0.40278125541100723
Energy: 0.4429560933378564
Energy: 0.4011989696911047
Energy: 0.442956093338239
Energy: 0.40119896969033964
Energy: 0.44295609333862146
Energy: 0.40119896969033964
Energy: 0.45647077019897103
Energy: 0.37253219416248534
Energy: 0.4564707701982058
Energy: 0.37253219416210276
Energy: 0.4564707701985884
Energy: 0.37253219416248534
Energy: 0.4197398703781387
Energy: 0.4008246439223269
Energy: 0.4197398703792864
Energy: 0.4008246439200315
Energy: 0.4197398703781387
Energy: 0.40082464392194433
Energy: 0.4964293316328511
Energy: 0.45344353937112997
Energy: 0.4964293316328511
Energy: 0.45344353937112997
Energy: 0.49642933163323366
Energy: 0.47166894806683235
Energy: 0.39694634215070557
Energy: 0.43669933639576763
Energy: 0.39694634215070557
Energy: 0.43669933639538505
Energy: 0.396946342150323
Energy: 0.43669933639538505
Energy: 0.4404802151815933
Energy: 0.461037611055331
Energy: 0.4404802151815933
Energy: 0.4610376110568613
Energy: 0.4404802151819758
Energy: 0.46103761105571356
Energy: 0.406555812403883
Energy: 0.44760255281949385
Energy: 0.406555812403883
Energy: 0.44760255281949385
Energy: 0.40655581240426547
Energy: 0.44760255281949385
Energy: 0.40166110340405303
Energy: 0.44086229450461883
Energy: 0.40166110340175754
Energy: 0.44900801328924883
Energy: 0.4016611034036704
Energy: 0.4455157165555131
Energy: 0.4008918210125482
Energy: 0.4451850247156535
Energy: 0.40089182101178317
Energy: 0.4451850247156535
Energy: 0.4008918210125482
Energy: 0.44518502471527105
Energy: 0.39536550146488286
Energy: 0.40790220862158366
Energy: 0.3953655014667958
Energy: 0.40790220862158366
Energy: 0.3953655014645003
Energy: 0.40790220862158366
Energy: 0.4150229593959148
Energy: 0.3674808221616703
Energy: 0.4150229593951496
Energy: 0.3674808221616703
Energy: 0.4150229593951496
Energy: 0.3674808221616703
Energy: 0.4142003555498332
Energy: 0.4009668769347089
Energy: 0.41420035555098095
Energy: 0.40096687693509137
Energy: 0.4142003555494506
Energy: 0.40096687693509137
Energy: 0.4074211064326317
Energy: 0.40100989332816583
Energy: 0.4074211064330143
Energy: 0.4010098933293136
Energy: 0.4074211064326317
Energy: 0.40100989333007875
Energy: 0.45636064466953236
Energy: 0.4334325347505103
Energy: 0.4563606446702975
Energy: 0.4334325347505103
Energy: 0.45636064466914983
Energy: 0.4334325347508929
Energy: 0.41633928989171065
Energy: 0.38693743836074007
Energy: 0.41633928989171065
Energy: 0.38693743836112265
Energy: 0.41633928989171065
Energy: 0.3869374383618878
Energy: 0.44834877285059344
Energy: 0.457668175827114
Energy: 0.4483487728517412
Energy: 0.457668175827114
Energy: 0.44834877285021085
Energy: 0.457668175827114
Energy: 0.39079078876038753
Energy: 0.45378704473128434
Energy: 0.39079078875617923
Energy: 0.45378704473090176
Energy: 0.3907907887580921
Energy: 0.45378704473128434
Energy: 0.44932484290496433
Energy: 0.3879978871022395
Energy: 0.44932484290534686
Energy: 0.3879978871018569
Energy: 0.449324842906112
Energy: 0.38799788710262206
Energy: 0.44793277435495976
Energy: 0.43378190806396594
Energy: 0.44793277435534223
Energy: 0.43378190806396594
Energy: 0.4479327743545772
Energy: 0.43378190806396594
Energy: 0.41716329563520893
Energy: 0.33150292262555625
Energy: 0.41716329563597404
Energy: 0.3315029226263215
Energy: 0.41716329563597404
Energy: 0.33150292262479114
Energy: 0.3987623907367919
Energy: 0.4452735617436783
Energy: 0.3987623907367919
Energy: 0.4452735617440609
Energy: 0.39876239073526154
Energy: 0.4452735617436783
Energy: 0.4155209654726546
Energy: 0.40094851578261115
Energy: 0.41552096547456746
Energy: 0.40094851578261115
Energy: 0.4155209654711243
Energy: 0.40094851578222857
Energy: 0.3954865266862362
Energy: 0.4104462027065764
Energy: 0.39548652668776646
Energy: 0.4104462027069589
Energy: 0.3954865266862362
Energy: 0.4104462027069589
Energy: 0.4009418059318866
Energy: 0.44246194171204495
Energy: 0.40094180593226914
Energy: 0.4424619417116624
Energy: 0.40094180593226914
Energy: 0.4424619417082192
Energy: 0.3948691749131039
Energy: 0.41295300004386515
Energy: 0.3948691749138691
Energy: 0.41295300004386515
Energy: 0.3948691749138691
Energy: 0.41295300004386515
Energy: 0.46241983572582823
Energy: 0.48916915684169715
Energy: 0.4624198357262108
Energy: 0.48916915684169715
Energy: 0.4624198357262108
Energy: 0.48916915684169715
Energy: 0.4505892495929474
Energy: 0.4015382968316221
Energy: 0.4505892495929474
Energy: 0.40153829683276987
Energy: 0.4505892495933299
Energy: 0.4015382968316221
Energy: 0.3995419051069663
Energy: 0.43924245207527424
Energy: 0.39954190510237536
Energy: 0.4392424520756568
Energy: 0.3995419051050534
Energy: 0.4392424520756568
Energy: 0.49625281708501195
Energy: 0.45849282248485473
Energy: 0.4962528170842468
Energy: 0.45849282248408957
Energy: 0.49625281708462937
Energy: 0.45849282248447215
Energy: 0.4184589859509532
Energy: 0.3877762617393132
Energy: 0.41845898595210096
Energy: 0.3877762617393132
Energy: 0.41845898595133574
Energy: 0.3877762617393132
Energy: 0.45007222520242485
Energy: 0.4359020856170889
Energy: 0.4500722252020423
Energy: 0.4359020856167064
Energy: 0.45007222520280743
Energy: 0.43590208561632376
Energy: 0.40730302002385205
Energy: 0.4029508640682633
Energy: 0.4073030200249998
Energy: 0.40295086406788067
Energy: 0.40730302002346946
Energy: 0.40295086406788067
Energy: 0.40092542949738574
Energy: 0.40119153394288937
Energy: 0.4009254294966206
Energy: 0.40119153394633256
Energy: 0.40092542949738574
Energy: 0.4011915339448023
Energy: 0.45679489419751046
Energy: 0.36796589690703746
Energy: 0.4567948941971278
Energy: 0.36796589690742
Energy: 0.45679489419827557
Energy: 0.3679658969078026
Energy: 0.39362618782540537
Energy: 0.39511937276614106
Energy: 0.3936261878246403
Energy: 0.39511937276575854
Energy: 0.39362618782540537
Energy: 0.39511937276614106

minimum gb energy = 0.33150292262479114 eV
minimum distance =  2.67563592155134 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 0.46679668220425174
Energy: 0.4234590904746002
Energy: 0.46679668220425174
Energy: 0.4234590904746002
Energy: 0.46679668220216264
Energy: 0.4234590904735556
Energy: 0.4256790293684774
Energy: 0.4466085984165572
Energy: 0.42567902936952196
Energy: 0.4466085984176017
Energy: 0.4256790293684774
Energy: 0.4466085984176017
Energy: 0.5585991932658599
Energy: 0.4613267492849941
Energy: 0.574458497813243
Energy: 0.4613267492849941
Energy: 0.5305216659636307
Energy: 0.4613267492849941
Energy: 0.4626757486782968
Energy: 0.5156305959591337
Energy: 0.4626757486626523
Energy: 0.5156305959591337
Energy: 0.4626757486647414
Energy: 0.5156305959591337
Energy: 0.4824012330392777
Energy: 0.4557903289763929
Energy: 0.4824012330392777
Energy: 0.4557903289763929
Energy: 0.4824012330392777
Energy: 0.4557903289763929
Energy: 0.4967438436604722
Energy: 0.4550872438574162
Energy: 0.4967438436604722
Energy: 0.4550872438574162
Energy: 0.4967438436604722
Energy: 0.4550872438574162
Energy: 0.45319758541033234
Energy: 0.46418449692670094
Energy: 0.45319758541033234
Energy: 0.46418449692670094
Energy: 0.45319758541033234
Energy: 0.4641844969256564
Energy: 0.44346982568000276
Energy: 0.45572040276093173
Energy: 0.44346982568000276
Energy: 0.45572040276093173
Energy: 0.44346982568104726
Energy: 0.45572040275988723
Energy: 0.4291064812961468
Energy: 0.42340637453243857
Energy: 0.4291064812940577
Energy: 0.42340637453243857
Energy: 0.42910648129196866
Energy: 0.42340637453243857
Energy: 0.47662573126933294
Energy: 0.426480728823485
Energy: 0.47662573126933294
Energy: 0.42648072882244054
Energy: 0.47662573126933294
Energy: 0.42648072882244054
Energy: 0.42743553670789647
Energy: 0.4614201855260397
Energy: 0.42743553670789647
Energy: 0.4614201855260397
Energy: 0.4274355367068519
Energy: 0.4614201855260397
Energy: 0.4583571324675078
Energy: 0.44645468060051297
Energy: 0.4583571324675078
Energy: 0.44645468060051297
Energy: 0.4583571324675078
Energy: 0.44645468060051297
Energy: 0.4997714865353266
Energy: 0.48786800243061323
Energy: 0.4997714865353266
Energy: 0.48786800243165773
Energy: 0.4997714865353266
Energy: 0.48786800243165773
Energy: 0.5054535684505773
Energy: 0.4446677402545192
Energy: 0.5054535684505773
Energy: 0.4446677402545192
Energy: 0.5054535684505773
Energy: 0.4446677402555637

minimum gb energy = 0.42340637453243857 eV
minimum distance =  2.63069483218433 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 0.5253890254234184
Energy: 0.5183019880427246
Energy: 0.5253890254234184
Energy: 0.5183019880427246
Energy: 0.5253890254234184
Energy: 0.5183019880427246
Energy: 0.4334782947586161
Energy: 0.4990887152339931
Energy: 0.43347829475907496
Energy: 0.4990887152339931
Energy: 0.43347829475769833
Energy: 0.4990887152339931
Energy: 0.5401228312506204
Energy: 0.4793365874489969
Energy: 0.5401228312492439
Energy: 0.4793365874489969
Energy: 0.519036889068748
Energy: 0.4793365874489969
Energy: 0.4786563220847587
Energy: 0.47299916920392726
Energy: 0.47865632208521763
Energy: 0.47299916920392726
Energy: 0.4786563220847587
Energy: 0.47299916920392726
Energy: 0.5057233340490795
Energy: 0.4831301309308047
Energy: 0.5057233340486207
Energy: 0.4831301309308047
Energy: 0.5057233340481618
Energy: 0.4831301309308047
Energy: 0.46742640801201146
Energy: 0.49776692700201064
Energy: 0.46742640801201146
Energy: 0.49776692700155173
Energy: 0.46742640801201146
Energy: 0.49776692700201064
Energy: 0.48483427920520034
Energy: 0.48901164029884747
Energy: 0.4848342792056592
Energy: 0.4890116402993063
Energy: 0.4848342792056592
Energy: 0.4890116402993063
Energy: 0.47225145160731535
Energy: 0.4695809061027803
Energy: 0.47225145160731535
Energy: 0.4695809061027803
Energy: 0.47225145160731535
Energy: 0.46958090610323916
Energy: 0.4709157874632312
Energy: 0.4698041102146866
Energy: 0.4709157874632312
Energy: 0.46980411021606316
Energy: 0.47091578746369006
Energy: 0.4698041102146866
Energy: 0.4752296878989405
Energy: 0.5166036800405388
Energy: 0.4752296878989405
Energy: 0.5166036800405388
Energy: 0.4752296878993994
Energy: 0.51660368004008
Energy: 0.4912602616791893
Energy: 0.50212523371636
Energy: 0.4912602616787305
Energy: 0.50212523371636
Energy: 0.4912602616791893
Energy: 0.50212523371636
Energy: 0.48858917900562576
Energy: 0.5067217619970227
Energy: 0.48858917900608456
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Energy: 0.48858917900608456
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Energy: 0.47527422387452095
Energy: 0.4686916768190942
Energy: 0.4752742238754387
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Energy: 0.47527422387406215
Energy: 0.46869167681863527
Energy: 0.472897094581326
Energy: 0.4790936772811897
Energy: 0.4728970945827026
Energy: 0.4790936772816486
Energy: 0.47289709458224377
Energy: 0.4790936772816486
Energy: 0.43159556036758073
Energy: 0.4548954575993835
Energy: 0.44838007606202845
Energy: 0.45489545759984235
Energy: 0.4505210988606166
Energy: 0.45489545759984235
Energy: 0.4855511157652885
Energy: 0.4878272419884331
Energy: 0.4855511157648296
Energy: 0.4878272419884331
Energy: 0.48555111576437077
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Energy: 0.44990651726673153
Energy: 0.4892095873049413
Energy: 0.4499065172648961
Energy: 0.4892095873049413
Energy: 0.4499065172644372
Energy: 0.4892095873049413
Energy: 0.50885498629865
Energy: 0.5044083250397721
Energy: 0.5088549862972733
Energy: 0.5044083250402309
Energy: 0.5088549862977322
Energy: 0.5044083250397721
Energy: 0.4673927502784206
Energy: 0.476910467202258
Energy: 0.46739275027887944
Energy: 0.47691046720179914
Energy: 0.4673927502793383
Energy: 0.47691046720271685
Energy: 0.5051155556877371
Energy: 0.49201513246066214
Energy: 0.5051155556886341
Energy: 0.49201513246066214
Energy: 0.5051155556877371
Energy: 0.49201513246066214
Energy: 0.4366165451631269
Energy: 0.4505416041358873
Energy: 0.4366165451635858
Energy: 0.4505416041358873
Energy: 0.4366165451635858
Energy: 0.4505416041358873
Energy: 0.48612399266128714
Energy: 0.5210314402229511
Energy: 0.48612399266128714
Energy: 0.5210314402229511
Energy: 0.48612399266128714
Energy: 0.5210314402229511
Energy: 0.4701256989346021
Energy: 0.4793083492717902
Energy: 0.47012569893368444
Energy: 0.4793083492717902
Energy: 0.470125698935061
Energy: 0.4793083492717902
Energy: 0.5039455977807515
Energy: 0.4995712162522633
Energy: 0.5039455977812104
Energy: 0.4995712162527222
Energy: 0.5039455977807515
Energy: 0.4995712162518045
Energy: 0.47583799862493925
Energy: 0.505862456216143
Energy: 0.47583799862493925
Energy: 0.5058624562166019
Energy: 0.4758379986253981
Energy: 0.5058624562166019
Energy: 0.4843629065007014
Energy: 0.48500021503101765
Energy: 0.48436290649978375
Energy: 0.48500021503101765
Energy: 0.48436290649978375
Energy: 0.48500021503101765
Energy: 0.4683092345019904
Energy: 0.49293060487029944
Energy: 0.4683092345010726
Energy: 0.49293060487029944
Energy: 0.4683092345019904
Energy: 0.49293060487029944
Energy: 0.4855297944265203
Energy: 0.4505311782818035
Energy: 0.4855297944260614
Energy: 0.4505311782822624
Energy: 0.4855297944265203
Energy: 0.4505311782818035
Energy: 0.47413883795728284
Energy: 0.47932242429531424
Energy: 0.47413883795728284
Energy: 0.479322424296232
Energy: 0.474138837956824
Energy: 0.4793224242943965
Energy: 0.4467000382945581
Energy: 0.433285927485229
Energy: 0.4467000382950169
Energy: 0.433285927485229
Energy: 0.4467000382936403
Energy: 0.433285927485229
Energy: 0.47667769829972223
Energy: 0.5271032174621046
Energy: 0.47667769829972223
Energy: 0.5271032174625635
Energy: 0.47667769829972223
Energy: 0.5271032174621046

minimum gb energy = 0.43159556036758073 eV
minimum distance =  2.60947680469113 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 0.4241491384363253
Energy: 0.39272250749924226
Energy: 0.4241491384363253
Energy: 0.3927225074984257
Energy: 0.42414913843714186
Energy: 0.39272250749924226
Energy: 0.47032224568103703
Energy: 0.4609808387427786
Energy: 0.4703222456802205
Energy: 0.4609808387435952
Energy: 0.4703222456802205
Energy: 0.4609808387435952
Energy: 0.4856184810118683
Energy: 0.45627261765606175
Energy: 0.4856184810102352
Energy: 0.45627261765606175
Energy: 0.4856184810110517
Energy: 0.45627261765606175
Energy: 0.417568704799886
Energy: 0.5939126527849213
Energy: 0.41756870479906943
Energy: 0.6238368142917136
Energy: 0.41756870479906943
Energy: 0.4959249345995593
Energy: 0.4854563187549234
Energy: 0.45631967719758176
Energy: 0.48545631875573997
Energy: 0.4563196771967652
Energy: 0.48545631875410683
Energy: 0.45631967719758176
Energy: 0.4702942243701863
Energy: 0.4609776014854878
Energy: 0.4702942243701863
Energy: 0.5254167359542294
Energy: 0.4702942243693698
Energy: 0.48968956949364745
Energy: 0.42414913843877494
Energy: 0.3927225074959761
Energy: 0.42414913843877494
Energy: 0.3927225074959761
Energy: 0.42414913843877494
Energy: 0.3927225074959761
Energy: 0.4703222456785874
Energy: 0.4609808387476779
Energy: 0.4703222456785874
Energy: 0.46098083874686135
Energy: 0.4703222456785874
Energy: 0.4609808387476779
Energy: 0.4856184810102352
Energy: 0.45627261765606175
Energy: 0.4856184810102352
Energy: 0.4562726176552452
Energy: 0.4856184810110517
Energy: 0.45627261765606175
Energy: 0.41756870479906943
Energy: 0.601774947775572
Energy: 0.41756870479906943
Energy: 0.5666167785670407
Energy: 0.41756870479906943
Energy: 0.49592493460037584
Energy: 0.4854563187549234
Energy: 0.4563196771967652
Energy: 0.48545631875573997
Energy: 0.4563196771967652
Energy: 0.48545631875410683
Energy: 0.4563196771967652
Energy: 0.4702942243693698
Energy: 0.4609776014846712
Energy: 0.4702942243693698
Energy: 0.4609776014846712
Energy: 0.4702942243701863
Energy: 0.4609776014838547
Energy: 0.4241491384363253
Energy: 0.39272250749924226
Energy: 0.4241491384363253
Energy: 0.3927225075000588
Energy: 0.42414913843714186
Energy: 0.39272250749924226
Energy: 0.47032224567940395
Energy: 0.4609808387427786
Energy: 0.4703222456802205
Energy: 0.4609808387435952
Energy: 0.47032224568103703
Energy: 0.4609808387435952
Energy: 0.4856184810118683
Energy: 0.45627261765606175
Energy: 0.4856184810118683
Energy: 0.45627261765606175
Energy: 0.4856184810118683
Energy: 0.45627261765606175
Energy: 0.41756870479906943
Energy: 0.4959249345995593
Energy: 0.41756870479906943
Energy: 0.4959249345995593
Energy: 0.41756870479906943
Energy: 0.4959249345995593
Energy: 0.4854563187549234
Energy: 0.45631967719758176
Energy: 0.48545631875573997
Energy: 0.45631967719758176
Energy: 0.4854563187549234
Energy: 0.45631967719758176

minimum gb energy = 0.3927225074959761 eV
minimum distance =  2.67749555607422 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 0.47661704847254505
Energy: 0.5408730889167047
Energy: 0.47661704847254505
Energy: 0.5408730889167047
Energy: 0.47661704847254505
Energy: 0.5408730889167047
Energy: 0.495264942880074
Energy: 0.4877887335078617
Energy: 0.49526494288074063
Energy: 0.4877887335071949
Energy: 0.495264942880074
Energy: 0.4877887335078617
Energy: 0.511453990327269
Energy: 0.4872070872897819
Energy: 0.5454943588073914
Energy: 0.4872070872897819
Energy: 0.5160701503065271
Energy: 0.4872070872897819
Energy: 0.4690699463838061
Energy: 0.5308587579992478
Energy: 0.46906994638313937
Energy: 0.5308587579992478
Energy: 0.4690699463838061
Energy: 0.5308587579992478
Energy: 0.4676315819982401
Energy: 0.47460901844781916
Energy: 0.46763158200157373
Energy: 0.4746090184484859
Energy: 0.46763158199957355
Energy: 0.47460901844781916
Energy: 0.5288486757021011
Energy: 0.46781410927882555
Energy: 0.5288486757034346
Energy: 0.46781410927949235
Energy: 0.5288486757014345
Energy: 0.46781410927882555
Energy: 0.46326109770768914
Energy: 0.49031776536137506
Energy: 0.46326109770902263
Energy: 0.4903177653647086
Energy: 0.46326109770768914
Energy: 0.49031776535470795
Energy: 0.5183773915591822
Energy: 0.5173426968781834
Energy: 0.5183773915591822
Energy: 0.5173426968781834
Energy: 0.5183773915591822
Energy: 0.5173426968781834
Energy: 0.5347615790696365
Energy: 0.4875465783490238
Energy: 0.5347615790689697
Energy: 0.48754657834835713
Energy: 0.5347615790689697
Energy: 0.48754657834835713
Energy: 0.46085586187959243
Energy: 0.5001231326173405
Energy: 0.46085586187959243
Energy: 0.5001231326166738
Energy: 0.46085586188025923
Energy: 0.5001231326166738
Energy: 0.5196911652479017
Energy: 0.49518872705319533
Energy: 0.5196911652465683
Energy: 0.49518872705252864
Energy: 0.5196911652479017
Energy: 0.49518872705252864
Energy: 0.5135973913210012
Energy: 0.46225331397601166
Energy: 0.5135973913203346
Energy: 0.462253313975345
Energy: 0.5135973913210012
Energy: 0.462253313975345
Energy: 0.4638461752304963
Energy: 0.497707226873134
Energy: 0.4638461752324965
Energy: 0.4977072268744674
Energy: 0.4638461752304963
Energy: 0.4977072268744674
Energy: 0.48233610115258946
Energy: 0.5253340104576721
Energy: 0.4823361011505893
Energy: 0.5253340104576721
Energy: 0.48233610115192277
Energy: 0.5253340104576721
Energy: 0.5215917543492695
Energy: 0.4720220938812328
Energy: 0.5215917543492695
Energy: 0.4720220938818995
Energy: 0.5215917543492695
Energy: 0.4720220938818995
Energy: 0.47627852150099687
Energy: 0.5155294886920574
Energy: 0.4762785215003301
Energy: 0.5155294886927241
Energy: 0.47627852150099687
Energy: 0.5155294886920574
Energy: 0.4791819523521586
Energy: 0.4852240540274769
Energy: 0.47918195235149186
Energy: 0.4852240540274769
Energy: 0.4791819523521586
Energy: 0.4852240540274769
Energy: 0.5663723196442382
Energy: 0.4703365755320834
Energy: 0.5663723196442382
Energy: 0.47033657553275005
Energy: 0.5663723196442382
Energy: 0.4703365755320834
Energy: 0.48115976497956314
Energy: 0.5252566208022876
Energy: 0.4811597649808966
Energy: 0.5252566208029543
Energy: 0.48115976497956314
Energy: 0.5252566208029543
Energy: 0.47137936810434766
Energy: 0.5212955550755443
Energy: 0.47137936810368103
Energy: 0.5212955550735441
Energy: 0.47137936810301423
Energy: 0.5212955550742108
Energy: 0.5109853754219915
Energy: 0.4612042844328811
Energy: 0.5109853754219915
Energy: 0.4612042844335478
Energy: 0.5109853754219915
Energy: 0.4612042844335478

minimum gb energy = 0.46085586187959243 eV
minimum distance =  2.6201553432993 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 0.458175326750279
Energy: 0.48776584311639015
Energy: 0.45817532674915495
Energy: 0.4877658431152661
Energy: 0.45817532674971695
Energy: 0.48776584311582816
Energy: 0.4664507165961578
Energy: 0.4622234538896165
Energy: 0.46645071659559584
Energy: 0.4622234538896165
Energy: 0.46645071659559584
Energy: 0.46222345389017844
Energy: 0.4687087973390508
Energy: 0.47614724154326216
Energy: 0.46870879733961274
Energy: 0.47614724154326216
Energy: 0.4687087973390508
Energy: 0.47614724154326216
Energy: 0.4306413494218089
Energy: 0.44330612395641417
Energy: 0.4306413494218089
Energy: 0.44330612395529023
Energy: 0.4306413494206849
Energy: 0.4433061239558522
Energy: 0.44906997638046214
Energy: 0.4812628422092923
Energy: 0.4490699763799001
Energy: 0.4812628422087302
Energy: 0.44906997637933815
Energy: 0.4812628422092923
Energy: 0.4691889695551552
Energy: 0.4328097172872052
Energy: 0.46918896955459327
Energy: 0.4328097172872052
Energy: 0.4691889695551552
Energy: 0.4328097172872052
Energy: 0.4363467164501766
Energy: 0.48551831613028346
Energy: 0.4363467164501766
Energy: 0.4855183161297215
Energy: 0.4363467164501766
Energy: 0.48551831613028346
Energy: 0.45998523346112385
Energy: 0.4639859824027582
Energy: 0.45998523346112385
Energy: 0.4639859824033202
Energy: 0.45998523346112385
Energy: 0.46398598240388217
Energy: 0.48491898265197386
Energy: 0.4327315622665525
Energy: 0.48491898265197386
Energy: 0.43273156226599047
Energy: 0.4849189826514119
Energy: 0.43273156226599047
Energy: 0.430620334521735
Energy: 0.49581797834515096
Energy: 0.430620334521735
Energy: 0.49581797834515096
Energy: 0.430620334521735
Energy: 0.49581797834515096
Energy: 0.43075003221551883
Energy: 0.4977354771911001
Energy: 0.43075003221551883
Energy: 0.4977354771911001
Energy: 0.4307500322160809
Energy: 0.4977354771905381
Energy: 0.48354481130459176
Energy: 0.4365103956810666
Energy: 0.48354481130515375
Energy: 0.4365103956810666
Energy: 0.48354481130459176
Energy: 0.4365103956805047
Energy: 0.4655389295221305
Energy: 0.458162427437365
Energy: 0.46553892952156845
Energy: 0.458162427437365
Energy: 0.46553892952269244
Energy: 0.458162427437365
Energy: 0.4308279526325185
Energy: 0.48477577516461384
Energy: 0.43082795263308044
Energy: 0.4847757751651759
Energy: 0.4308279526325185
Energy: 0.48477577516573783
Energy: 0.4691319899862489
Energy: 0.432718597402382
Energy: 0.46913198998568684
Energy: 0.4327185974029439
Energy: 0.4691319899862489
Energy: 0.4327185974029439
Energy: 0.4604936739171765
Energy: 0.4820744584500386
Energy: 0.4604936739171765
Energy: 0.4820744584500386
Energy: 0.46049367391661455
Energy: 0.4820744584500386
Energy: 0.4384142092048266
Energy: 0.4751991758452657
Energy: 0.43841420920314056
Energy: 0.4751991758447037
Energy: 0.4384142092042646
Energy: 0.4751991758441418
Energy: 0.4603329383053041
Energy: 0.47188008764105155
Energy: 0.46033293830586614
Energy: 0.47188008764105155
Energy: 0.4603329383053041
Energy: 0.4718800876416136
Energy: 0.46976323164736705
Energy: 0.4644537696785557
Energy: 0.4697632316468051
Energy: 0.46445376967799373
Energy: 0.4697632316468051
Energy: 0.4644537696785557
Energy: 0.458175326750279
Energy: 0.48776584311639015
Energy: 0.458175326750279
Energy: 0.4877658431169521
Energy: 0.45817532674971695
Energy: 0.48776584311639015
Energy: 0.4664507165939098
Energy: 0.4622234538969224
Energy: 0.46645071659447185
Energy: 0.4622234538969224
Energy: 0.4664507165950338
Energy: 0.4622234538969224
Energy: 0.46870879733961274
Energy: 0.47614724153989013
Energy: 0.46870879733961274
Energy: 0.4761472415404521
Energy: 0.46870879733961274
Energy: 0.4761472415404521
Energy: 0.43064134942518084
Energy: 0.4433061239569762
Energy: 0.43064134942574284
Energy: 0.44330612395641417
Energy: 0.43064134942574284
Energy: 0.44330612395641417
Energy: 0.4490699763827101
Energy: 0.4812628422121022
Energy: 0.4490699763832721
Energy: 0.48126284221266413
Energy: 0.44906997638214813
Energy: 0.4812628422121022
Energy: 0.46918896955122125
Energy: 0.4328097172905771
Energy: 0.46918896955065925
Energy: 0.43280971729113915
Energy: 0.4691889695517833
Energy: 0.4328097172905771

minimum gb energy = 0.430620334521735 eV
minimum distance =  2.65564081341711 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 0.4398253441262299
Energy: 0.5289821021245869
Energy: 0.4398253441262299
Energy: 0.5289821021245869
Energy: 0.4398253441262299
Energy: 0.5289821021245869
Energy: 0.49177055181750584
Energy: 0.4436687939160862
Energy: 0.49177055181653556
Energy: 0.44366879391560105
Energy: 0.49177055181750584
Energy: 0.4436687939160862
Energy: 0.5522011472274911
Energy: 0.4284126731279594
Energy: 0.5556814354693196
Energy: 0.4284126731279594
Energy: 0.5251783337019258
Energy: 0.42841267312844444
Energy: 0.42905397435087017
Energy: 0.515345023917113
Energy: 0.429053974350385
Energy: 0.5153450239175982
Energy: 0.42905397435087017
Energy: 0.515345023917113
Energy: 0.43328230659223965
Energy: 0.49286410081312376
Energy: 0.43328230659223965
Energy: 0.49286410081312376
Energy: 0.43328230659223965
Energy: 0.49286410081312376
Energy: 0.5159034641477575
Energy: 0.4292638356031743
Energy: 0.5159034641477575
Energy: 0.42926383560268916
Energy: 0.5159034641482425
Energy: 0.4292638356031743
Energy: 0.43292273096476025
Energy: 0.5089515647732578
Energy: 0.43292273096476025
Energy: 0.5089515647737429
Energy: 0.43292273096476025
Energy: 0.508951564774228
Energy: 0.4506548494028872
Energy: 0.5123638060334156
Energy: 0.4506548494028872
Energy: 0.5123638060324455
Energy: 0.45065484940337236
Energy: 0.5123638060314752
Energy: 0.5313417824509375
Energy: 0.4212853627147203
Energy: 0.5313417824514226
Energy: 0.4212853627147203
Energy: 0.5313417824509375
Energy: 0.42128536271423517
Energy: 0.4362309320652164
Energy: 0.48677199359710843
Energy: 0.4362309320657015
Energy: 0.4867719935975935
Energy: 0.4362309320647313
Energy: 0.4867719935975935
Energy: 0.42534790770012976
Energy: 0.5476091736078352
Energy: 0.42534790770012976
Energy: 0.5476091736078352
Energy: 0.42534790769964465
Energy: 0.5476091736083203
Energy: 0.5027953905678658
Energy: 0.4294002543320134
Energy: 0.5027953905678658
Energy: 0.4294002543315504
Energy: 0.5027953905673807
Energy: 0.4294002543320134
Energy: 0.4912501243801524
Energy: 0.4361192376210805
Energy: 0.49125012439033966
Energy: 0.4361192376210805
Energy: 0.49125012438742904
Energy: 0.4361192376215657
Energy: 0.42578947029758646
Energy: 0.517868797386298
Energy: 0.4257894702966162
Energy: 0.517868797386298
Energy: 0.4257894702980715
Energy: 0.517868797386298
Energy: 0.4826693428689149
Energy: 0.4212911866366487
Energy: 0.4826693428689149
Energy: 0.4212911866366487
Energy: 0.4826693428689149
Energy: 0.4212911866366487
Energy: 0.551424187894728
Energy: 0.42116749156931194
Energy: 0.551424187894728
Energy: 0.42116749156979705
Energy: 0.5514241878956982
Energy: 0.42116749156979705
Energy: 0.4349618029720304
Energy: 0.5448463858860078
Energy: 0.4349618029720304
Energy: 0.544846385886978
Energy: 0.4349618029720304
Energy: 0.5448463858864928
Energy: 0.47268849361284726
Energy: 0.5122126874913608
Energy: 0.4726884936133324
Energy: 0.5122126874918459
Energy: 0.47268849361284726
Energy: 0.5122126874918459
Energy: 0.5286389346245034
Energy: 0.42887064460049584
Energy: 0.5286389346245034
Energy: 0.4288706446009809
Energy: 0.5443670919869762
Energy: 0.42887064460049584
Energy: 0.43261678618987626
Energy: 0.49731744495255986
Energy: 0.4326167861893911
Energy: 0.49731744495255986
Energy: 0.43261678618987626
Energy: 0.49731744495255986
Energy: 0.4255625730673863
Energy: 0.5103813638760145
Energy: 0.4255625730678715
Energy: 0.5103813638745593
Energy: 0.4255625730678715
Energy: 0.5103813638779551
Energy: 0.5545653534094637
Energy: 0.42819340544578166
Energy: 0.5545653534089785
Energy: 0.42819340544578166
Energy: 0.5545653534089785
Energy: 0.42819340544578166
Energy: 0.44958580562251177
Energy: 0.43912552175087055
Energy: 0.44958580562299694
Energy: 0.4391255217503854
Energy: 0.44958580562299694
Energy: 0.4391255217503854
Energy: 0.44926278164252054
Energy: 0.5282185679382086
Energy: 0.44926278164494604
Energy: 0.5282185679382086
Energy: 0.44926278164349076
Energy: 0.5282185679386938
Energy: 0.5191608630260797
Energy: 0.4282007838421377
Energy: 0.5191608630265648
Energy: 0.4282007838421377
Energy: 0.5191608630255946
Energy: 0.4282007838426229
Energy: 0.43350571361211027
Energy: 0.4332152013039388
Energy: 0.43350571361211027
Energy: 0.4332152013044239
Energy: 0.4335057136111401
Energy: 0.4332152013039388
Energy: 0.4265376699755059
Energy: 0.507274131835929
Energy: 0.4265376699750208
Energy: 0.507274131835929
Energy: 0.4265376699750208
Energy: 0.507274131835929
Energy: 0.49623983819297707
Energy: 0.428861314332484
Energy: 0.4962398381924919
Energy: 0.428861314332484
Energy: 0.49623983819297707
Energy: 0.428861314332484
Energy: 0.5247722727438046
Energy: 0.4288657276224091
Energy: 0.5247722727457229
Energy: 0.42886572762289416
Energy: 0.5247722727452379
Energy: 0.42886572762289416

minimum gb energy = 0.42116749156931194 eV
minimum distance =  2.62979367926141 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 0.43012166693771137
Energy: 0.5303020195638567
Energy: 0.43012166693728493
Energy: 0.530302019564283
Energy: 0.43012166693728493
Energy: 0.5303020195638567
Energy: 0.5116682710967708
Energy: 0.4466510510145885
Energy: 0.511668271095918
Energy: 0.4488102591043313
Energy: 0.5116682710963444
Energy: 0.43328164697634886
Energy: 0.5233658939865473
Energy: 0.40923157722132414
Energy: 0.5233658939869736
Energy: 0.40923157722132414
Energy: 0.5233658939874002
Energy: 0.40923157722047127
Energy: 0.40707003654749874
Energy: 0.5837383020829592
Energy: 0.40707003654707224
Energy: 0.6090910672984634
Energy: 0.40707003654621937
Energy: 0.5647116679500803
Energy: 0.4152727181709451
Energy: 0.48061008393325805
Energy: 0.4152727181709451
Energy: 0.48061008393325805
Energy: 0.4152727181709451
Energy: 0.48061008393325805
Energy: 0.5199247216071865
Energy: 0.4037966635262095
Energy: 0.5199247216076129
Energy: 0.4037966635262095
Energy: 0.51992472160676
Energy: 0.40379666352578303
Energy: 0.4191439835621863
Energy: 0.514722142923367
Energy: 0.4191439835621863
Energy: 0.5147221429225141
Energy: 0.4191439835630392
Energy: 0.5147221429225141
Energy: 0.4118675586109233
Energy: 0.5162202887107914
Energy: 0.411867558609644
Energy: 0.5589963942962106
Energy: 0.411867558609644
Energy: 0.4983775226801309
Energy: 0.5210153117841207
Energy: 0.4046016627404603
Energy: 0.5210153117849735
Energy: 0.4046016627400339
Energy: 0.5210153117845471
Energy: 0.4046016627404603
Energy: 0.4155924389456062
Energy: 0.4355793757710737
Energy: 0.4155924389460326
Energy: 0.4576518765850986
Energy: 0.4155924389460326
Energy: 0.4359168139618679
Energy: 0.4059623353600428
Energy: 0.5638568148888123
Energy: 0.40596233535833703
Energy: 0.5638568148888123
Energy: 0.40596233535961634
Energy: 0.5638568148888123
Energy: 0.5040220805803686
Energy: 0.4426281572442535
Energy: 0.5040220805812214
Energy: 0.44541475927875224
Energy: 0.504022080580795
Energy: 0.4190751378596736
Energy: 0.5373922175011667
Energy: 0.4091712967895328
Energy: 0.5373922175015932
Energy: 0.4091712967895328
Energy: 0.5373922175020196
Energy: 0.4091712967895328
Energy: 0.4328609325882077
Energy: 0.5512560137318725
Energy: 0.43286093258863406
Energy: 0.5512560137322988
Energy: 0.43286093258906055
Energy: 0.5635115443999607
Energy: 0.43035473297368204
Energy: 0.42272579502146385
Energy: 0.43035473297240273
Energy: 0.42272579502103746
Energy: 0.43035473297368204
Energy: 0.4227257950201846
Energy: 0.5546614393176948
Energy: 0.41051776957650604
Energy: 0.5546614393185477
Energy: 0.41051776957650604
Energy: 0.5546614393164156
Energy: 0.41051776957650604
Energy: 0.40621934842760915
Energy: 0.5843094792228469
Energy: 0.4062193484297412
Energy: 0.5843094792236998
Energy: 0.406219348428462
Energy: 0.5843094792232734
Energy: 0.40604424923009313
Energy: 0.4787526138214562
Energy: 0.40604424923009313
Energy: 0.47875261382230905
Energy: 0.40604424923009313
Energy: 0.47875261382102974
Energy: 0.519561902960223
Energy: 0.4046191942420473
Energy: 0.5195619029597967
Energy: 0.4046191942420473
Energy: 0.5195619029597967
Energy: 0.4046191942420473
Energy: 0.4191553316852515
Energy: 0.4497415371852317
Energy: 0.41915533168482505
Energy: 0.4475462735794435
Energy: 0.4191553316852515
Energy: 0.44974153718779036
Energy: 0.41344486923303225
Energy: 0.5950929240574838
Energy: 0.4134448692338851
Energy: 0.5950929240574838
Energy: 0.41344486923303225
Energy: 0.5950929240574838
Energy: 0.5967760009920712
Energy: 0.40400987691546236
Energy: 0.5967760009920712
Energy: 0.40400987691759455
Energy: 0.5967760009929242
Energy: 0.4040098769184474
Energy: 0.48034979660757776
Energy: 0.4039043932721673
Energy: 0.48034979660757776
Energy: 0.4039043932721673
Energy: 0.4803497966080042
Energy: 0.4039043932721673
Energy: 0.4071462105153022
Energy: 0.517004448273621
Energy: 0.4071462105153022
Energy: 0.517004448273621
Energy: 0.4071462105140229
Energy: 0.5170044482731946
Energy: 0.5055026578362235
Energy: 0.42268043868075134
Energy: 0.5055026578357972
Energy: 0.4226804386811778
Energy: 0.5055026578357972
Energy: 0.42268043868075134
Energy: 0.5349774373581778
Energy: 0.4105179899713479
Energy: 0.5349774373590305
Energy: 0.4105179899722008
Energy: 0.5349774373577514
Energy: 0.41051798997177436
Energy: 0.43032612895108063
Energy: 0.5507622557435994
Energy: 0.430326128951507
Energy: 0.5507622557435994
Energy: 0.43032612895108063
Energy: 0.5507622557435994
Energy: 0.4305146254075632
Energy: 0.43310409719719556
Energy: 0.4305146254067103
Energy: 0.4331040972010335
Energy: 0.4305146254075632
Energy: 0.43310409719890125
Energy: 0.517018198491169
Energy: 0.40907381613313787
Energy: 0.5170181984907426
Energy: 0.40907381613313787
Energy: 0.5170181984915955
Energy: 0.40907381613313787
Energy: 0.40596389377814734
Energy: 0.45588877203499945
Energy: 0.4059638937785737
Energy: 0.4561633325445788
Energy: 0.4059638937794266
Energy: 0.45588877203414657
Energy: 0.40648231408234065
Energy: 0.5175330932761762
Energy: 0.40648231408148777
Energy: 0.5175330932753233
Energy: 0.406482314082767
Energy: 0.5175330932757498
Energy: 0.5187500585171453
Energy: 0.404097362361244
Energy: 0.518750058516719
Energy: 0.404097362361244
Energy: 0.5187500585175717
Energy: 0.40409736236081756
Energy: 0.48762086758969436
Energy: 0.4036178071547385
Energy: 0.4876208675875622
Energy: 0.4036178071551649
Energy: 0.48762086758841505
Energy: 0.4036178071551649

minimum gb energy = 0.4036178071547385 eV
minimum distance =  2.64944105124843 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.011570404827456917
Energy: 0.5685230232283687
Energy: 0.011570404827122288
Energy: 0.5685230232290578
Energy: 0.011570404827122288
Energy: 0.5685230232290578
Energy: 0.011951291876145265
Energy: 0.16561492497445107
Energy: 0.011951291876145265
Energy: 0.16561492497445107
Energy: 0.011951291876145265
Energy: 0.1656149249748054
Energy: 0.8091364192813283
Energy: 0.16549463600629014
Energy: 0.9853313914362354
Energy: 0.1654946352167693
Energy: 1.100830372854699
Energy: 0.16549463527633274
Energy: 0.011951291876145265
Energy: 0.16561492497514002
Energy: 0.011951291876145265
Energy: 0.16561492497514002
Energy: 0.011951291875456327
Energy: 0.1656149249748054

minimum gb energy = 0.011570404827122288 eV
minimum distance =  2.83848480241204 Angstroms
sigma value = 1