Model name: model_name=EAM_Dynamo_MendelevBorovikov_2020_FeNiCr__MO_922363340570_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.518474650382997
cohesive_energy=4.34606645024629
mass=58.6934
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: 0.01774951477849626
Energy: 1.2080883243600644
Energy: 0.01774951477849626
Energy: 1.2080883243600644
Energy: 0.01774951477849626
Energy: 1.2080883243600644
Energy: 1.2080883243603955
Energy: 1.1693218923168454
Energy: 1.2080883243603955
Energy: 1.1693218923171764
Energy: 1.2080883243597702
Energy: 1.1693218923190891
Energy: 0.01774951477849626
Energy: 1.2080883243603955
Energy: 0.01774951477849626
Energy: 1.2080883243603955
Energy: 0.01774951477849626
Energy: 1.2080883243600644
Energy: 1.2080883243597702
Energy: 1.1693218923194202
Energy: 1.2080883243603955
Energy: 1.1693218923190891
Energy: 1.2080883243603955
Energy: 1.1693218923194202
Energy: 0.01774951477849626
Energy: 1.2080883243600644
Energy: 0.01774951477849626
Energy: 1.2080883243597702
Energy: 0.01774951477849626
Energy: 1.2080883243600644
Energy: 1.2080883243603955
Energy: 1.1693218923197515
Energy: 1.2080883243597702
Energy: 1.1693218923207076
Energy: 1.2080883243597702
Energy: 1.1693218923184638

minimum gb energy = 0.01774951477849626 eV
minimum distance =  2.19399517208679 Angstroms
sigma value = 1


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

Energy: 1.4150324012163122
Energy: 1.351716237290741
Energy: 1.3466035921142125
Energy: 1.3517162372891474
Energy: 1.4150324012083433
Energy: 1.3517162372891474
Energy: 1.590724021660892
Energy: 1.2609762876102377
Energy: 1.590724021654517
Energy: 1.2609762875982846
Energy: 1.5907240216569078
Energy: 1.2609762875966908
Energy: 1.328821426576161
Energy: 1.3639305446309524
Energy: 1.3288214265681924
Energy: 1.3639305446277652
Energy: 1.3288214265673954
Energy: 1.363930544628562
Energy: 1.5715449528544951
Energy: 1.2920511893111164
Energy: 1.5715449528497138
Energy: 1.2920511893103193
Energy: 1.5715449528393544
Energy: 1.2920511893111164
Energy: 1.3648849254383666
Energy: 1.3877418576975027
Energy: 1.3648849254335855
Energy: 1.3877418576943152
Energy: 1.3648849254303979
Energy: 1.3877418576935183
Energy: 1.4178520399936188
Energy: 1.2888977605233247
Energy: 1.4178520399832595
Energy: 1.288897760528903
Energy: 1.4178520399792751
Energy: 1.288897760528106
Energy: 1.3274369187721602
Energy: 1.3809189546306861
Energy: 1.327436918781723
Energy: 1.3809189546219203
Energy: 1.327436918781723
Energy: 1.3809189546219203
Energy: 1.3076658735688544
Energy: 1.4214468186770548
Energy: 1.3076658734995985
Energy: 1.4214468186754612
Energy: 1.3076658735752296
Energy: 1.4214468186714768
Energy: 1.4105509352774819
Energy: 1.3908845785103807
Energy: 1.4105509352758883
Energy: 1.3908845785199433
Energy: 1.4105509352711068
Energy: 1.3908845785199433
Energy: 1.2384030460075142
Energy: 1.4833435838894062
Energy: 1.238403046008311
Energy: 1.4833435839037499
Energy: 1.238403046008311
Energy: 1.4833435839101248
Energy: 1.463098660821591
Energy: 1.2891744963007155
Energy: 1.4630986608192003
Energy: 1.2891744963031062
Energy: 1.4630986608121006
Energy: 1.2891744963023093
Energy: 1.2893406250834338
Energy: 1.497363095786239
Energy: 1.289362045064681
Energy: 1.497363095780661
Energy: 1.289340625075465
Energy: 1.497363095785442
Energy: 1.5877387607530264
Energy: 1.2705489329655049
Energy: 1.5877387607522295
Energy: 1.2705489329631143
Energy: 1.5877387607530264
Energy: 1.2705489329623176
Energy: 1.3166811214473224
Energy: 1.3580779600099067
Energy: 1.3165379306893077
Energy: 1.3580779600043287
Energy: 1.3166811214401504
Energy: 1.3580779600051254
Energy: 1.5843038737491548
Energy: 1.2963330261751593
Energy: 1.498509100077271
Energy: 1.2963330261727688
Energy: 1.5843038737491548
Energy: 1.296333026171972
Energy: 1.587337658129885
Energy: 1.3839080159758992
Energy: 1.508062086398569
Energy: 1.3839080159782897
Energy: 1.5873376581338694
Energy: 1.3839080159758992
Energy: 1.3593871561657305
Energy: 1.3247578192793732
Energy: 1.359387156155371
Energy: 1.3247578192738674
Energy: 1.359387156156168
Energy: 1.3247578192738674
Energy: 1.359318870208197
Energy: 1.3040453243605392
Energy: 1.3593188702026187
Energy: 1.3040453243645238
Energy: 1.3593188702058066
Energy: 1.3040453243661176
Energy: 1.2762495103630775
Energy: 1.2905160302464758
Energy: 1.2762495103582965
Energy: 1.2905160302440852
Energy: 1.2762495103590932
Energy: 1.2905160302432883
Energy: 1.450487748296192
Energy: 1.2888373295022313
Energy: 1.450487748288223
Energy: 1.2888373295125906
Energy: 1.4504877482850356
Energy: 1.2888373295109972
Energy: 1.3241164790464484
Energy: 1.4009863197424715
Energy: 1.324116479048839
Energy: 1.400986319745659
Energy: 1.3241164790432607
Energy: 1.4009863197472525
Energy: 1.4435777624180262
Energy: 1.384473411626719
Energy: 1.443809259691849
Energy: 1.3844734116099844
Energy: 1.4435777624220107
Energy: 1.3844734116107813
Energy: 1.2337626817074507
Energy: 1.7658223220857188
Energy: 1.2337626817098415
Energy: 1.7658223220857188
Energy: 1.233762681718607
Energy: 1.7658223220865157

minimum gb energy = 1.2337626817074507 eV
minimum distance =  2.20466821851212 Angstroms
sigma value = 33


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

Energy: 1.470975819568018
Energy: 1.442916205262649
Energy: 1.31936384776283
Energy: 1.4429162052603826
Energy: 1.4709758195689246
Energy: 1.4429162052585696
Energy: 1.4929934595637417
Energy: 1.2902283294946284
Energy: 1.4929934595623822
Energy: 1.2902283294846566
Energy: 1.4929934595614756
Energy: 1.2902283294755914
Energy: 1.318953534984784
Energy: 1.252162113870656
Energy: 1.3189535350006483
Energy: 1.2521621138683896
Energy: 1.3189535349884103
Energy: 1.2521621138634036
Energy: 1.341233213158345
Energy: 1.4259471394870582
Energy: 1.341233213154719
Energy: 1.4259471394802592
Energy: 1.3412332131578921
Energy: 1.4259471394902312
Energy: 1.4000345928331914
Energy: 1.3711020597406327
Energy: 1.400034592825527
Energy: 1.3711020597365533
Energy: 1.4000345928214475
Energy: 1.3711020597492445
Energy: 1.3408408276367556
Energy: 1.318762202411259
Energy: 1.340840827625424
Energy: 1.3188031611253102
Energy: 1.34084082762905
Energy: 1.3187622024094459
Energy: 1.4448061594180408
Energy: 1.3703727555345167
Energy: 1.4448061594298256
Energy: 1.3701902742208194
Energy: 1.4448061594189472
Energy: 1.3703727555412744
Energy: 1.2283451157225642
Energy: 1.4379107479600022
Energy: 1.228345115718073
Energy: 1.4379107479636282
Energy: 1.2283451157243772
Energy: 1.4379107479681608
Energy: 1.4525339860442277
Energy: 1.3236176819535999
Energy: 1.4525339860474005
Energy: 1.3236176819581327
Energy: 1.452533986037882
Energy: 1.3236176819508803
Energy: 1.2886393931547404
Energy: 1.3562822247117576
Energy: 1.2886514293234703
Energy: 1.356282224618427
Energy: 1.2886393931438622
Energy: 1.3562822246646185
Energy: 1.3661589558447291
Energy: 1.2919906493037745
Energy: 1.366158955861953
Energy: 1.2919906493046809
Energy: 1.3661589558528877
Energy: 1.2919906493019615
Energy: 1.3195564078324107
Energy: 1.4199012949280725
Energy: 1.3195148845463756
Energy: 1.4199012949371375
Energy: 1.3195564078396629
Energy: 1.419901294933058
Energy: 1.3878323450272303
Energy: 1.3336705333739116
Energy: 1.320466846263436
Energy: 1.3336705333775378
Energy: 1.3878323450344827
Energy: 1.3336705333834302
Energy: 1.4213724855047767
Energy: 1.4302697128750737
Energy: 1.3191262201312044
Energy: 1.4302697128673683
Energy: 1.4213724854975245
Energy: 1.430269712882779
Energy: 1.3966883418636555
Energy: 1.289475642385775
Energy: 1.3966883418622957
Energy: 1.2894756423848681
Energy: 1.3966883418808795
Energy: 1.2894756423767506
Energy: 1.3186767549255527
Energy: 1.254148357585953
Energy: 1.3186767549250993
Energy: 1.254148357572355
Energy: 1.3186767549210199
Energy: 1.254148357579154
Energy: 1.5341335287417297
Energy: 1.3571366700810183
Energy: 1.5341335287399167
Energy: 1.3571366700706347
Energy: 1.5341335287412767
Energy: 1.3571366700841914
Energy: 1.3993596370682724
Energy: 1.318749344505458
Energy: 1.3993596370723516
Energy: 1.3188255429086573
Energy: 1.3993596370714452
Energy: 1.3187493444918605
Energy: 1.3553397193841081
Energy: 1.3346968875766816
Energy: 1.3553397193922667
Energy: 1.3370805970621902
Energy: 1.3553397193854682
Energy: 1.3346968875762284
Energy: 1.4442406302188755
Energy: 1.374691789137616
Energy: 1.444240630221595
Energy: 1.3746719451495706
Energy: 1.4442406302293005
Energy: 1.3746917891403356
Energy: 1.2268574324774741
Energy: 1.3413015084388695
Energy: 1.2268574324824602
Energy: 1.341301508482383
Energy: 1.2268574324797406
Energy: 1.3413015084941677
Energy: 1.2508516645887395
Energy: 1.3233688566871695
Energy: 1.2508516645706091
Energy: 1.3233688567075663
Energy: 1.2508516645715155
Energy: 1.3233688567025805
Energy: 1.288733536480196
Energy: 1.4305443621782088
Energy: 1.2887465510556393
Energy: 1.4305443621863676
Energy: 1.2887335364860886
Energy: 1.4305443620957563
Energy: 1.378976658749404
Energy: 1.4017338719715897
Energy: 1.3789766587498569
Energy: 1.4017338719779355
Energy: 1.3789766587507637
Energy: 1.4017338719670571
Energy: 1.3190556742833788
Energy: 1.3422718536818827
Energy: 1.3188230548082829
Energy: 1.3422718536873217
Energy: 1.319055674303281
Energy: 1.3422718537022795
Energy: 1.4705133364537095
Energy: 1.4256355444039208
Energy: 1.3193017185871285
Energy: 1.4256355444070936
Energy: 1.4705133364568825
Energy: 1.425635544405734
Energy: 1.4372339943224346
Energy: 1.3447991231815382
Energy: 1.3192632201685712
Energy: 1.3447991231788186
Energy: 1.4372339943373924
Energy: 1.3447991231770056
Energy: 1.3190184812000139
Energy: 1.289216659602346
Energy: 1.3190184812054528
Energy: 1.2892166595928272
Energy: 1.3190184812054528
Energy: 1.2892166595928272
Energy: 1.3515325088458061
Energy: 1.2900221938495802
Energy: 1.351532508814531
Energy: 1.2900221938482204
Energy: 1.351532508894264
Energy: 1.2900221938645378
Energy: 1.2891797525161253
Energy: 1.4228839924656693
Energy: 1.2891797525211113
Energy: 1.4228839924602301
Energy: 1.2891797525174848
Energy: 1.42288399246295
Energy: 1.4109184076216612
Energy: 1.323111972148109
Energy: 1.4109184076334462
Energy: 1.3231132217027421
Energy: 1.4109184076261938
Energy: 1.3231119721394968
Energy: 1.331644954929387
Energy: 1.3235341727626027
Energy: 1.331644954929387
Energy: 1.2559819249487112
Energy: 1.3316449549348262
Energy: 1.3235341727621492
Energy: 1.4444906665646307
Energy: 1.374643552173619
Energy: 1.4444906665659902
Energy: 1.3746423798329082
Energy: 1.444490666572336
Energy: 1.3746435521831375
Energy: 1.290929876895183
Energy: 1.3966821786085795
Energy: 1.2909298768879307
Energy: 1.3966821786004209
Energy: 1.2909298768901971
Energy: 1.3966821786058599
Energy: 1.2722063583001921
Energy: 1.3189220196850382
Energy: 1.2722063583029115
Energy: 1.3189220196723468
Energy: 1.272206358287954
Energy: 1.3189220196972349
Energy: 1.4270036073601902
Energy: 1.5407059801497085
Energy: 1.4270036073629095
Energy: 1.5407059801442693
Energy: 1.427003607368349
Energy: 1.540705980149255
Energy: 1.3189129707303253
Energy: 1.3992770828120953
Energy: 1.3187857072621305
Energy: 1.3992770828107355
Energy: 1.3189129707353109
Energy: 1.3992770828252399
Energy: 1.3241741383169452
Energy: 1.3502694697096969
Energy: 1.3423479393450677
Energy: 1.3502694697128697
Energy: 1.3241741383309964
Energy: 1.3502694697078836
Energy: 1.4213203737426157
Energy: 1.4446351851354986
Energy: 1.3192367956062816
Energy: 1.4446351851300594
Energy: 1.4213203737457885
Energy: 1.4446351851332322
Energy: 1.4384074917591385
Energy: 1.2282969481391168
Energy: 1.4384074917487135
Energy: 1.228296948148182
Energy: 1.4384074917487135
Energy: 1.22829694813957
Energy: 1.31948037272082
Energy: 1.3073762512618512
Energy: 1.3194803727144742
Energy: 1.3073762512586782
Energy: 1.3194803727076752
Energy: 1.3073762512636642

minimum gb energy = 1.2268574324774741 eV
minimum distance =  2.31911872415326 Angstroms
sigma value = 51


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

Energy: 1.4460537461379428
Energy: 1.4178729510275585
Energy: 1.36206861114413
Energy: 1.4178729510265082
Energy: 1.4460537461389933
Energy: 1.4178729510265082
Energy: 1.527665030195486
Energy: 1.3197525235449659
Energy: 1.5276650301933854
Energy: 1.3197525235439158
Energy: 1.5276650301849837
Energy: 1.3197525235449659
Energy: 1.357503920594634
Energy: 1.3548281530171524
Energy: 1.3575039205935835
Energy: 1.3548281530129513
Energy: 1.3575039205925334
Energy: 1.3548281530150517
Energy: 1.4412233146570674
Energy: 1.3041912679826948
Energy: 1.4412233146549671
Energy: 1.3041912679879457
Energy: 1.4412233146549671
Energy: 1.3041912679879457
Energy: 1.454639597187914
Energy: 1.3868251393302127
Energy: 1.454639597187914
Energy: 1.3868251393375641
Energy: 1.454639597187914
Energy: 1.3868251393354636
Energy: 1.4111546785270594
Energy: 1.3863989217225174
Energy: 1.411154678524959
Energy: 1.3863989217267183
Energy: 1.411154678520758
Energy: 1.3863989217267183
Energy: 1.3257681369939451
Energy: 1.386599316677311
Energy: 1.3257681369949954
Energy: 1.386599316679411
Energy: 1.3257681369918446
Energy: 1.3865993166804615
Energy: 1.271376391279935
Energy: 1.3868530757558193
Energy: 1.2713763912830855
Energy: 1.3868530757579198
Energy: 1.2713763912841356
Energy: 1.3868530757579198
Energy: 1.4997242750408741
Energy: 1.299283031885592
Energy: 1.4997242750408741
Energy: 1.2992830318887423
Energy: 1.4997242750398239
Energy: 1.2992830318887423
Energy: 1.335958305464464
Energy: 1.6952162802917339
Energy: 1.3350895779597285
Energy: 1.6952162802896333
Energy: 1.335958305460263
Energy: 1.6952162802917339
Energy: 1.4835862966304199
Energy: 1.3155746475542576
Energy: 1.4028966393787632
Energy: 1.315574647555308
Energy: 1.4835862966283193
Energy: 1.315574647555308
Energy: 1.4421226701611847
Energy: 1.4196891019275246
Energy: 1.3586201784504677
Energy: 1.419689101929625
Energy: 1.4421226701590841
Energy: 1.419689101929625
Energy: 1.640972216964065
Energy: 1.3210011394169752
Energy: 1.6409722169651149
Energy: 1.3210011394180254
Energy: 1.640972216964065
Energy: 1.321001139419076
Energy: 1.3574262135263326
Energy: 1.3004670562928486
Energy: 1.357426213528433
Energy: 1.3004670562959992
Energy: 1.3574262135305335
Energy: 1.3004670562959992
Energy: 1.4453782309563783
Energy: 1.375121936571253
Energy: 1.4453782309479768
Energy: 1.3751219365691525
Energy: 1.445378230949027
Energy: 1.3751219365702028
Energy: 1.4547519364054315
Energy: 1.3864756238741107
Energy: 1.454751936403331
Energy: 1.3864756238804121
Energy: 1.4547519364043813
Energy: 1.3864756238804121
Energy: 1.4113028833329986
Energy: 1.4027777511479333
Energy: 1.4113028833329986
Energy: 1.4027777511500337
Energy: 1.4113028833371997
Energy: 1.402777751151084
Energy: 1.3746055693107944
Energy: 1.3897692672106805
Energy: 1.374605569308694
Energy: 1.3897692672117308
Energy: 1.3746055693118444
Energy: 1.3897692672117308

minimum gb energy = 1.271376391279935 eV
minimum distance =  2.16348583964135 Angstroms
sigma value = 19


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

Energy: 1.3826865855600297
Energy: 1.336843388047712
Energy: 1.335862316536213
Energy: 1.3368433880402648
Energy: 1.382686585556292
Energy: 1.336843388041511
Energy: 1.471594478977055
Energy: 1.3758081439797643
Energy: 1.4715944789795468
Energy: 1.3758081439803873
Energy: 1.4715944789814157
Energy: 1.3758081439797643
Energy: 1.274428221005337
Energy: 1.2401561954542215
Energy: 1.2744282210059599
Energy: 1.240156195451107
Energy: 1.2744282210134354
Energy: 1.2401561954529756
Energy: 1.3276370708030505
Energy: 1.2761848893218428
Energy: 1.3276370708036733
Energy: 1.2761848893143675
Energy: 1.327637070807411
Energy: 1.2761848893143675
Energy: 1.2668465636615893
Energy: 1.3168264985825424
Energy: 1.2668465636584745
Energy: 1.3168264985875262
Energy: 1.266846563655983
Energy: 1.3168264985869031
Energy: 1.2212834256683853
Energy: 1.3169750509152904
Energy: 1.221271118016734
Energy: 1.3169750509127984
Energy: 1.2212834256671397
Energy: 1.3169750509134215
Energy: 1.2407241329187308
Energy: 1.2764330587665464
Energy: 1.2407241329237142
Energy: 1.2764330587646775
Energy: 1.2407241329237142
Energy: 1.2764330587640547
Energy: 1.274325535373804
Energy: 1.5300906788654096
Energy: 1.2743254270459934
Energy: 1.530090678857934
Energy: 1.2743255353700664
Energy: 1.5300906788566881
Energy: 1.2746740309753055
Energy: 1.3295673244844548
Energy: 1.2747330557548822
Energy: 1.3295673244813402
Energy: 1.2746740309740594
Energy: 1.329567324481963
Energy: 1.2942595256500935
Energy: 1.3200523507489361
Energy: 1.2942699480809003
Energy: 1.3200523507508048
Energy: 1.2942595256550773
Energy: 1.3200523507495592
Energy: 1.471594478975186
Energy: 1.375808143984125
Energy: 1.471594478977055
Energy: 1.3758081439847478
Energy: 1.4715944789814157
Energy: 1.3758081439847478
Energy: 1.2744282210078288
Energy: 1.2401561954554674
Energy: 1.2744282210078288
Energy: 1.2401561954529756
Energy: 1.2744282210134354
Energy: 1.2401561954523526
Energy: 1.3276370708024277
Energy: 1.2762671862519457
Energy: 1.3276370708055423
Energy: 1.2762671862507
Energy: 1.327637070811149
Energy: 1.276267186250077
Energy: 1.266846563651622
Energy: 1.316925734374041
Energy: 1.266846563651622
Energy: 1.3169257343640741
Energy: 1.266846563652245
Energy: 1.3169257343640741
Energy: 1.1970604258253814
Energy: 1.3170447655061608
Energy: 1.197060425829119
Energy: 1.3170447655049433
Energy: 1.197060425828496
Energy: 1.3170447655049433
Energy: 1.2407241329149932
Energy: 1.2764330587621857
Energy: 1.240724132917485
Energy: 1.2764330587609398
Energy: 1.2407241329187308
Energy: 1.276433058760317
Energy: 1.2743997191596699
Energy: 1.5300906788629176
Energy: 1.274416855970309
Energy: 1.5300906788610489
Energy: 1.2743997191658996
Energy: 1.530090678861672
Energy: 1.303990593692504
Energy: 1.3295673244844548
Energy: 1.311930177282266
Energy: 1.3295673244813402
Energy: 1.3039905936943728
Energy: 1.329567324481963
Energy: 1.3826865855594066
Energy: 1.3368433880452204
Energy: 1.335862316541168
Energy: 1.3368433880408876
Energy: 1.382686585556292
Energy: 1.3368433880402648
Energy: 1.471594478977678
Energy: 1.3758081439810104
Energy: 1.4715944789795468
Energy: 1.3758081439803873
Energy: 1.4715944789826616
Energy: 1.3758081439803873
Energy: 1.2744282210096975
Energy: 1.2401561954585822
Energy: 1.2744282210090747
Energy: 1.2401561954573364
Energy: 1.27442822101655
Energy: 1.2401561954579592
Energy: 1.3276370708030505
Energy: 1.276184889319974
Energy: 1.3276370708061653
Energy: 1.2761848893112526
Energy: 1.32763707080928
Energy: 1.2761848893112526
Energy: 1.2668465636547368
Energy: 1.3168264985788047
Energy: 1.266846563654114
Energy: 1.3168264985825424
Energy: 1.2668465636553599
Energy: 1.3168264985819196
Energy: 1.2212834256702543
Energy: 1.3169750509146676
Energy: 1.221271118013619
Energy: 1.3169750509127984
Energy: 1.2212834256715004
Energy: 1.3169750509121756
Energy: 1.240724132917485
Energy: 1.276433058759694
Energy: 1.2407241329212226
Energy: 1.276433058759694
Energy: 1.2407241329212226
Energy: 1.276433058760317
Energy: 1.2743255353713123
Energy: 1.5300906788629176
Energy: 1.2743254270453706
Energy: 1.530090678859803
Energy: 1.2743255353688205
Energy: 1.53009067885918
Energy: 1.2746740309765514
Energy: 1.329567324483832
Energy: 1.2747330557548822
Energy: 1.329567324483209
Energy: 1.2746740309715676
Energy: 1.329567324483209
Energy: 1.2942595256500935
Energy: 1.3200523507501818
Energy: 1.294269948080306
Energy: 1.3200523507514277
Energy: 1.2942595256544542
Energy: 1.3200523507489361
Energy: 1.471594478975186
Energy: 1.3758081439797643
Energy: 1.471594478977055
Energy: 1.3758081439791412
Energy: 1.4715944789814157
Energy: 1.3758081439791412
Energy: 1.2744282210078288
Energy: 1.2401561954554674
Energy: 1.2744282210072055
Energy: 1.2401561954529756
Energy: 1.274428221014058
Energy: 1.2401561954535985

minimum gb energy = 1.1970604258253814 eV
minimum distance =  2.33036251069092 Angstroms
sigma value = 27


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

Energy: 1.173082690648831
Energy: 1.1270044145558746
Energy: 1.1730826906473049
Energy: 1.1270044145558746
Energy: 1.173082690648831
Energy: 1.1270044145558746
Energy: 1.3100942163022613
Energy: 1.1013293748200064
Energy: 1.3100942163022613
Energy: 1.1013293749130522
Energy: 1.3100942163114166
Energy: 1.1013293748215323
Energy: 1.1113190634887014
Energy: 1.2610921805736395
Energy: 1.111319063473442
Energy: 1.2610921805721136
Energy: 1.1113190634856493
Energy: 1.2610921805721136
Energy: 1.2243840922386686
Energy: 1.094852217393243
Energy: 1.2243840922371425
Energy: 1.0948522173978206
Energy: 1.2243840922386686
Energy: 1.0948522173993465
Energy: 1.2253100966298718
Energy: 1.0946891337674152
Energy: 1.2253100966298718
Energy: 1.0946891337689408
Energy: 1.2253100966298718
Energy: 1.0946891337643978
Energy: 1.2297872528013303
Energy: 1.2988796774002132
Energy: 1.2297872527982785
Energy: 1.2988796774002132
Energy: 1.2297872527998044
Energy: 1.2988796773986875
Energy: 1.0953672644410215
Energy: 1.1726823882623982
Energy: 1.0953672644394952
Energy: 1.1726823882608723
Energy: 1.0953672644410215
Energy: 1.1726823882623982
Energy: 1.1659454753261185
Energy: 1.1270252618163248
Energy: 1.1659454753276446
Energy: 1.1270252618132732
Energy: 1.1659454753276446
Energy: 1.1270252618132732
Energy: 1.3121193307910768
Energy: 1.1112321708921118
Energy: 1.3121193307910768
Energy: 1.1112321708753614
Energy: 1.3121193307910768
Energy: 1.111232170890586
Energy: 1.1748579126528973
Energy: 1.2967065811796263
Energy: 1.1748579126528973
Energy: 1.2967065811811525
Energy: 1.1748579126528973
Energy: 1.2967065811811525
Energy: 1.2016035920201003
Energy: 1.0957228360046367
Energy: 1.2016035920201003
Energy: 1.0957228360046367
Energy: 1.2016035920201003
Energy: 1.0957228360046367
Energy: 1.2956655762673277
Energy: 1.223343071196282
Energy: 1.295665576265802
Energy: 1.223343071197808
Energy: 1.295665576265802
Energy: 1.223343071196282

minimum gb energy = 1.0946891337643978 eV
minimum distance =  2.16048238148515 Angstroms
sigma value = 9


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

Energy: 1.2418910934954255
Energy: 1.1193136146713936
Energy: 1.1076588125361413
Energy: 1.1193136146726796
Energy: 1.2418910934992842
Energy: 1.119313614672251
Energy: 1.236508443383
Energy: 1.0323023205712214
Energy: 1.2365084433838573
Energy: 1.0017283515417774
Energy: 1.2365084433855724
Energy: 1.0017283515417774
Energy: 1.0307489145865802
Energy: 1.1202784752374235
Energy: 1.0307489145955837
Energy: 1.120278475246856
Energy: 1.0307489146114475
Energy: 1.1202784752412824
Energy: 1.2346315946908701
Energy: 1.0544259222659416
Energy: 1.231100833588558
Energy: 1.0544259222650842
Energy: 1.234631594696015
Energy: 1.0544259222646553
Energy: 1.0296271483523773
Energy: 1.0631296934941192
Energy: 1.0296271483262238
Energy: 1.0631296934611056
Energy: 1.0296271483378
Energy: 1.063129693460677
Energy: 1.0722049265876352
Energy: 1.1403643431260273
Energy: 1.0722049265936378
Energy: 1.1195553105621598
Energy: 1.0722049266009266
Energy: 1.1195553105694487
Energy: 1.0318998377144304
Energy: 1.1899949290562952
Energy: 1.0318998377049977
Energy: 1.1899949290455765
Energy: 1.0318998377088566
Energy: 1.1899949290451477
Energy: 1.026432253103835
Energy: 1.089611675156757
Energy: 1.0264322531012626
Energy: 1.0896116751361773
Energy: 1.0264322530939738
Energy: 1.089611675136606
Energy: 1.2177444061102984
Energy: 1.0619338150814686
Energy: 1.217744406109441
Energy: 1.0619338151015805
Energy: 1.2177444061085836
Energy: 1.0619338151011517
Energy: 1.0864788829723437
Energy: 1.202533673962243
Energy: 1.0864788829787748
Energy: 1.202533673950667
Energy: 1.0864788829702
Energy: 1.2025336739498096
Energy: 1.110524888111058
Energy: 1.063271925505688
Energy: 1.110524888111058
Energy: 1.0632719254816783
Energy: 1.1105248881238814
Energy: 1.0632719254808207
Energy: 1.0433325925230679
Energy: 1.1529380971588263
Energy: 1.0429839046817997
Energy: 1.1529380971567216
Energy: 1.0433325924917696
Energy: 1.1529380971584369
Energy: 1.070102943341423
Energy: 1.0922666601767834
Energy: 1.133661031924326
Energy: 1.0922666601819284
Energy: 1.0701029433560003
Energy: 1.092266660184072
Energy: 1.2362515690512252
Energy: 1.113632559056813
Energy: 1.1028694694884011
Energy: 1.1136325590572416
Energy: 1.2362515690456513
Energy: 1.1136325590559555
Energy: 1.0687407926625923
Energy: 1.061236649722809
Energy: 1.0687407926617347
Energy: 1.0612366497318126
Energy: 1.0687407926655934
Energy: 1.0612366497305263
Energy: 1.0505200535608397
Energy: 1.094769698456473
Energy: 1.0505200535462624
Energy: 1.0947696984590458
Energy: 1.050520053552265
Energy: 1.094769698458188
Energy: 1.225516542177164
Energy: 0.9928984922755694
Energy: 1.2257930162988404
Energy: 0.9928984922704245
Energy: 1.2255165421685892
Energy: 0.9928984922712818
Energy: 1.0223352498371268
Energy: 1.0697683369819264
Energy: 1.022335249830267
Energy: 1.0697683369819264
Energy: 1.0223352498294096
Energy: 1.0697683369917876
Energy: 1.0212073209356385
Energy: 1.2196383657757355
Energy: 1.0212065766376583
Energy: 1.219638365772734
Energy: 1.021207320926635
Energy: 1.219638365774878
Energy: 1.1718199289365825
Energy: 0.9741933242978863
Energy: 1.1718199289391549
Energy: 1.0220948969726789
Energy: 1.1718199289348674
Energy: 1.0220948969559578
Energy: 1.0212149351041622
Energy: 1.0933558041272815
Energy: 1.0212149351161668
Energy: 1.093355803830279
Energy: 1.0212149351140232
Energy: 1.0933558041319977
Energy: 1.153085642379127
Energy: 1.0695824175708146
Energy: 1.1530856423877018
Energy: 1.06958241754852
Energy: 1.1530856423855582
Energy: 1.0695824175489486
Energy: 1.2828815689862738
Energy: 0.9926513354607615
Energy: 1.2828815689931337
Energy: 0.9926513354912022
Energy: 1.2828815689862738
Energy: 0.992651335491631
Energy: 0.9887058809991084
Energy: 1.094308881482836
Energy: 0.9887058810033958
Energy: 1.094308881500843
Energy: 0.988705881008541
Energy: 1.0943088814969844
Energy: 1.008539837779241
Energy: 1.1239627027962091
Energy: 1.0085398377732384
Energy: 1.123962702803069
Energy: 1.0085398377762398
Energy: 1.1239627028039267
Energy: 1.2365910220584975
Energy: 1.128012381439178
Energy: 1.1025713076387975
Energy: 1.1280123814113097
Energy: 1.236591022068359
Energy: 1.1280123814134535
Energy: 1.102863788263731
Energy: 1.033365133748281
Energy: 1.1028637882808807
Energy: 1.033365133755141
Energy: 1.1028637882611585
Energy: 1.0333651337547123
Energy: 1.0450064038316527
Energy: 1.070748583488004
Energy: 1.0450064038325102
Energy: 1.0707485834875756
Energy: 1.0450064038217917
Energy: 1.0707485834892903
Energy: 1.1897098081809523
Energy: 1.0631901157633235
Energy: 1.1887230211809392
Energy: 1.0631901157611798
Energy: 1.18970980817152
Energy: 1.0631901157611798
Energy: 1.031328275841585
Energy: 1.1924672161104295
Energy: 1.0313282758493025
Energy: 1.1924672160105712
Energy: 1.0313282758587348
Energy: 1.1924672158635898
Energy: 1.2384627302680167
Energy: 1.06925103732244
Energy: 1.2384627302431495
Energy: 1.069251037333587
Energy: 1.2384627302628717
Energy: 1.0692510373327297
Energy: 1.0265033346965535
Energy: 1.1888589409691595
Energy: 1.0265054252486303
Energy: 1.1888589409790205
Energy: 1.0265033346695818
Energy: 1.1888589409785917
Energy: 1.092635282150077
Energy: 1.0860223829252833
Energy: 1.0926352821526495
Energy: 1.086022382917995
Energy: 1.0926352821509346
Energy: 1.0860223829162796
Energy: 1.1375371936140928
Energy: 1.019687819941712
Energy: 1.1375371936050893
Energy: 1.0196878199764012
Energy: 1.1375371936050893
Energy: 1.019687819936567
Energy: 1.0985044086139149
Energy: 1.0689949263864547
Energy: 1.0985044086126288
Energy: 1.0689949263881697
Energy: 1.0985044086079125
Energy: 1.0689949263898846
Energy: 1.1103008612489187
Energy: 1.0544737723542328
Energy: 1.1103008612454888
Energy: 1.0544737723756699
Energy: 1.1103008612412013
Energy: 1.0544737723748125
Energy: 0.970756162638349
Energy: 1.240577495792642
Energy: 0.9707561626336327
Energy: 1.2405774958012168
Energy: 0.970756162638349
Energy: 1.2405774958003593
Energy: 1.0835193472672064
Energy: 0.9584187489389577
Energy: 1.083519347271065
Energy: 0.9584187489381002
Energy: 1.0835193472890723
Energy: 0.9584187489548212
Energy: 1.2418910934885656
Energy: 1.119313614668821
Energy: 1.10765881252971
Energy: 1.1193136146679636
Energy: 1.2418910934971406
Energy: 1.119313614668821
Energy: 1.2365084433851437
Energy: 1.0629999227272815
Energy: 1.2365084433834288
Energy: 1.0323023205609316
Energy: 1.2365084433860012
Energy: 1.0323023205609316
Energy: 1.0307489145925826
Energy: 1.1202784752661494
Energy: 1.0307489145990139
Energy: 1.1202784752532873
Energy: 1.0307489146161635
Energy: 1.1202784752511434
Energy: 1.2346315946930135
Energy: 1.054425922268943
Energy: 1.2311008335954179
Energy: 1.0544259222629404
Energy: 1.2346315946917275
Energy: 1.0544259222642267
Energy: 1.029627148353235
Energy: 1.0631296934885452
Energy: 1.0296271483257953
Energy: 1.063129693455103
Energy: 1.029627148331369
Energy: 1.063129693455103

minimum gb energy = 0.9584187489381002 eV
minimum distance =  2.18558622222036 Angstroms
sigma value = 57


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

Energy: 0.4346760484275593
Energy: 0.447390952326909
Energy: 0.4346760484275593
Energy: 0.447390952326909
Energy: 0.4346760484275593
Energy: 0.447390952326909
Energy: 0.5910887130857386
Energy: 0.43566112877895147
Energy: 0.5910887130857386
Energy: 0.43566112877895147
Energy: 0.5910887130837866
Energy: 0.43566112877992746
Energy: 0.5049385818320759
Energy: 0.5633379404983554
Energy: 0.5049385818320759
Energy: 0.5633379404993314
Energy: 0.5049385818310999
Energy: 0.5633379404983554
Energy: 0.4480433434974324
Energy: 0.4347571825331464
Energy: 0.4480433434954805
Energy: 0.4347571825331464
Energy: 0.4480433434954805
Energy: 0.4347571825331464
Energy: 0.590752678499046
Energy: 0.5988631693100385
Energy: 0.5907526784970941
Energy: 0.5988631693110146
Energy: 0.590752678499046
Energy: 0.5988631693110146
Energy: 0.4348824825979512
Energy: 0.503578046729714
Energy: 0.4348824825979512
Energy: 0.503578046729714
Energy: 0.43488248259697526
Energy: 0.50357804673069
Energy: 0.43488911423912396
Energy: 0.5034078703002095
Energy: 0.434889114238148
Energy: 0.5034078703021615
Energy: 0.434889114238148
Energy: 0.5034078703011856
Energy: 0.5907329612783776
Energy: 0.5984924958783694
Energy: 0.5907329612783776
Energy: 0.5984924958783694
Energy: 0.5907329612793536
Energy: 0.5984924958773934
Energy: 0.44804332708005823
Energy: 0.4347393503793047
Energy: 0.44804332708005823
Energy: 0.4347393503793047
Energy: 0.44804332708005823
Energy: 0.4347393503783287
Energy: 0.5050003405489578
Energy: 0.5635836323261599
Energy: 0.5050003405479819
Energy: 0.5635836323261599
Energy: 0.5050003405499338
Energy: 0.5635836323261599
Energy: 0.5910416335913372
Energy: 0.43567470372753897
Energy: 0.5910416335903612
Energy: 0.435674703726563
Energy: 0.5910416335913372
Energy: 0.435674703726563
Energy: 0.4346760484275593
Energy: 0.4473909523278849
Energy: 0.4346760484285353
Energy: 0.4473909523278849
Energy: 0.4346760484275593
Energy: 0.447390952326909
Energy: 0.5910887130847626
Energy: 0.43566112877992746
Energy: 0.5910887130847626
Energy: 0.4356611287779755
Energy: 0.5910887130847626
Energy: 0.43566112877895147
Energy: 0.5049385818320759
Energy: 0.5633379404993314
Energy: 0.5049385818320759
Energy: 0.5633379404993314
Energy: 0.5049385818320759
Energy: 0.5633379405012834
Energy: 0.4480433434964564
Energy: 0.4347571825331464
Energy: 0.4480433434954805
Energy: 0.4347571825341224
Energy: 0.4480433434954805
Energy: 0.43475718253217044
Energy: 0.59075267849807
Energy: 0.5988631693110146
Energy: 0.590752678499046
Energy: 0.5988631693110146
Energy: 0.59075267849807
Energy: 0.5988631693100385
Energy: 0.4348824825989272
Energy: 0.50357804673069
Energy: 0.43488248259990325
Energy: 0.503578046729714
Energy: 0.4348824825989272
Energy: 0.50357804673069
Energy: 0.4348891142400999
Energy: 0.5034078703002095
Energy: 0.43488911423912396
Energy: 0.5034078703011856
Energy: 0.43488911423912396
Energy: 0.5034078703002095
Energy: 0.5907329612793536
Energy: 0.5984924958783694
Energy: 0.5907329612783776
Energy: 0.5984924958783694
Energy: 0.5907329612793536
Energy: 0.5984924958773934

minimum gb energy = 0.4346760484275593 eV
minimum distance =  2.33899050687528 Angstroms
sigma value = 11


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

Energy: 0.8676450167413554
Energy: 0.8382789753285877
Energy: 0.8676450167420703
Energy: 0.8382789753264428
Energy: 0.8676450167420703
Energy: 0.8382789753278728
Energy: 1.050350195187127
Energy: 0.8711765435946381
Energy: 1.0503501951921317
Energy: 0.8711765435924935
Energy: 1.0503501951928464
Energy: 0.8711765435910636
Energy: 1.0120780673314578
Energy: 1.1880617376323657
Energy: 1.0120780673300283
Energy: 1.188061737630221
Energy: 1.0120780673328877
Energy: 1.188061737630936
Energy: 1.0486480808364533
Energy: 0.8135511088060668
Energy: 1.0486480808443173
Energy: 0.8135511088060668
Energy: 1.048648080838598
Energy: 0.8135511088074968
Energy: 0.7990227440174855
Energy: 0.7819054947045033
Energy: 0.799022744012546
Energy: 0.7819054947052183
Energy: 0.799022744013261
Energy: 0.7819054947045033
Energy: 0.8660187312874148
Energy: 0.7985422376937953
Energy: 0.8660187312909894
Energy: 0.7985422376945102
Energy: 0.8660187312924191
Energy: 0.7985422376937953
Energy: 0.7727595685833787
Energy: 0.8521771084404444
Energy: 0.7727595685840934
Energy: 0.8521771089592174
Energy: 0.7727595685840934
Energy: 0.8521771079373347
Energy: 0.9575647698166251
Energy: 0.7437020055844007
Energy: 0.9575647698159102
Energy: 0.7437020055851157
Energy: 0.9575647698159102
Energy: 0.7437020055836857
Energy: 0.8283843334647143
Energy: 0.7476700158259404
Energy: 0.8283843334461263
Energy: 0.7476700158252255
Energy: 0.8283843334475562
Energy: 0.7476700158245106
Energy: 0.7638126952784754
Energy: 1.1057254993973933
Energy: 0.76381269528205
Energy: 1.1057254993959635
Energy: 0.763812695281335
Energy: 1.1057254993988233
Energy: 1.3505339152915565
Energy: 1.0048633811900838
Energy: 1.3505339152894116
Energy: 1.0048633811857939
Energy: 1.3505339152915565
Energy: 1.0048633811900838
Energy: 0.8005585461487066
Energy: 0.784519008690798
Energy: 0.8005585461558558
Energy: 0.784519008691513
Energy: 0.8005585461529959
Energy: 0.7845190086922279
Energy: 0.9058834187038853
Energy: 0.8190454803848188
Energy: 0.9058834187060302
Energy: 0.8190454803848188
Energy: 0.905883418706745
Energy: 0.8190454803869635
Energy: 0.9701287313012275
Energy: 1.150796716982235
Energy: 0.9701287313012275
Energy: 1.1507967169793756
Energy: 0.9701287313019424
Energy: 1.15079671698438
Energy: 1.3050739391236068
Energy: 0.872748673041359
Energy: 1.3050739391236068
Energy: 0.8727486730449336
Energy: 1.3050739391228918
Energy: 0.8727486730435038
Energy: 0.842318573363274
Energy: 0.8417453733125279
Energy: 0.8423185733654188
Energy: 0.8417453733068085
Energy: 0.8423185733625592
Energy: 0.8417453733089532
Energy: 0.9210503366304125
Energy: 0.7915632416273977
Energy: 0.9210503366318424
Energy: 0.7915632416266827
Energy: 0.9210503366325572
Energy: 0.7915632416216782
Energy: 1.2419234681703628
Energy: 1.1120609015679435
Energy: 1.2419234681689328
Energy: 1.1120609016051193
Energy: 1.2419234681710776
Energy: 1.1120609015557896
Energy: 1.1473106339702572
Energy: 0.8095943624108358
Energy: 1.1473106339874153
Energy: 0.809594362408691
Energy: 1.1473106339995693
Energy: 0.8095943624101208
Energy: 0.8003337937099128
Energy: 0.8185269469508091
Energy: 0.8003337937113426
Energy: 0.8185269469515241
Energy: 0.8003337937113426
Energy: 0.818526946952239
Energy: 0.7649596475188226
Energy: 0.8017462291822278
Energy: 0.7649596475188226
Energy: 0.801746229181513
Energy: 0.7649596475216823
Energy: 0.8017462291822278
Energy: 0.8182525264323184
Energy: 0.8513725918569405
Energy: 0.8182525264316035
Energy: 0.8513725918576555
Energy: 0.8182525264251692
Energy: 0.8513725918583704
Energy: 0.8262366015871061
Energy: 0.8328938615778682
Energy: 0.8262366015656586
Energy: 0.8328938615721486
Energy: 0.826236601597115
Energy: 0.8328938615764382
Energy: 0.828542707750022
Energy: 0.791120272290847
Energy: 0.8285427077257148
Energy: 0.791120272282983
Energy: 0.8285427077314341
Energy: 0.7911202722894173
Energy: 0.7649084474831244
Energy: 1.1089248729616472
Energy: 0.7649084474816945
Energy: 1.108924872965222
Energy: 0.7649084474816945
Energy: 1.1089248729709416
Energy: 1.4362864689757995
Energy: 1.0047806200984326
Energy: 1.4362864689765145
Energy: 1.0047806200984326
Energy: 1.4362864689750845
Energy: 1.0047806200984326

minimum gb energy = 0.7437020055836857 eV
minimum distance =  2.24901033330918 Angstroms
sigma value = 41


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

Energy: 1.0827160035369183
Energy: 0.9449487446161864
Energy: 0.9828738359399836
Energy: 0.9449487446139324
Energy: 1.0827160035408627
Energy: 0.944948744613369
Energy: 1.0601902625319026
Energy: 1.1404029532040814
Energy: 1.0601902625279582
Energy: 1.1404029532097162
Energy: 1.0601902625285218
Energy: 1.1404029532091526
Energy: 1.0221624816398627
Energy: 1.6050310664797922
Energy: 1.0221624816415533
Energy: 1.6050310664786653
Energy: 1.0221624816421166
Energy: 1.6050310664786653
Energy: 1.0357662826820895
Energy: 0.9461585805225814
Energy: 1.0357662826798357
Energy: 0.9461585805231448
Energy: 1.0357662826849072
Energy: 0.9461585805231448
Energy: 0.9134108686461025
Energy: 1.0067359059436578
Energy: 0.9134138174765021
Energy: 1.0067359059487293
Energy: 0.9134108686449756
Energy: 1.0067359059481655
Energy: 1.1145935902892437
Energy: 0.8922110347926765
Energy: 1.1145935902875532
Energy: 0.8922110347943669
Energy: 1.1145935902931878
Energy: 0.8922110347954938
Energy: 0.9361383820188791
Energy: 1.2321276682894169
Energy: 0.9361383820205694
Energy: 1.232127668281528
Energy: 0.9361383820177521
Energy: 1.2321276682820916
Energy: 0.9846643143830976
Energy: 0.9462811229221271
Energy: 0.9847189715379313
Energy: 0.9462811229288889
Energy: 0.9846643143819707
Energy: 0.9462811229283254
Energy: 0.8556350994018038
Energy: 0.9996941523409539
Energy: 0.85563509939955
Energy: 0.9996941523420809
Energy: 0.8556350993961691
Energy: 0.9996941523426445
Energy: 0.9265033801639205
Energy: 1.0612842081448048
Energy: 0.9265033801627935
Energy: 1.061284208140297
Energy: 0.9265033801622302
Energy: 1.0612842081431144
Energy: 0.920292327912037
Energy: 1.3219343454334176
Energy: 0.9202923279137274
Energy: 1.3219343454361838
Energy: 0.9202923279098342
Energy: 1.3219343454356716
Energy: 0.9092231135439999
Energy: 0.897751163344993
Energy: 0.9092231135485077
Energy: 0.8977511633506279
Energy: 0.9092231135456902
Energy: 0.8977511633495009
Energy: 0.9046460644049759
Energy: 0.9401556294546364
Energy: 0.9046460644044126
Energy: 0.940155629451819
Energy: 0.9046460644061028
Energy: 0.940155629451819
Energy: 0.8808231476639155
Energy: 1.0182701275493538
Energy: 0.8808183310942284
Energy: 1.0182701275493538
Energy: 0.8808231476577172
Energy: 1.0182701275471002
Energy: 0.920951868795176
Energy: 1.1445961427996
Energy: 0.9209518687985055
Energy: 1.1445961428012905
Energy: 0.9209518687917951
Energy: 1.1445961428001634
Energy: 0.8785587477383642
Energy: 0.877241867000966
Energy: 0.8785587477423085
Energy: 0.8772418670032199
Energy: 0.878558747741745
Energy: 0.8772418669958946
Energy: 0.9890793276311671
Energy: 0.9403640169479367
Energy: 0.9871758575520528
Energy: 0.9403640169490637
Energy: 0.989079327633421
Energy: 0.9403640169485002
Energy: 1.0790771626906275
Energy: 1.309035260721553
Energy: 1.0789113379252404
Energy: 1.3090352607266242
Energy: 1.079077162693445
Energy: 1.3090352607266242
Energy: 0.9424083798205168
Energy: 1.0393434125648968
Energy: 0.9424083798176993
Energy: 1.0393434125502463
Energy: 0.9424083798143185
Energy: 1.039343412549683
Energy: 1.0199299824464694
Energy: 0.9321480810004968
Energy: 0.9198939107294739
Energy: 0.9321480810027508
Energy: 1.019929982442525
Energy: 0.9321480810027508
Energy: 0.9350979860165246
Energy: 0.9957941086947393
Energy: 0.9350979860165246
Energy: 0.9957941086986837
Energy: 0.9350979860137072
Energy: 0.9957941086953029
Energy: 1.0238358794563898
Energy: 1.3091079081764412
Energy: 1.023835879450806
Energy: 1.3091079081747508
Energy: 1.0238358794468616
Energy: 1.3091079081741872
Energy: 1.0081416847152231
Energy: 0.9400287164872454
Energy: 1.008141684716914
Energy: 0.9400287164849914
Energy: 1.008141684716914
Energy: 0.940028716485555
Energy: 0.8786866678087937
Energy: 1.0082319685478387
Energy: 0.878508058945745
Energy: 1.00823196853995
Energy: 0.878686667803159
Energy: 1.0082319685410768
Energy: 0.8878791043784795
Energy: 1.1903216290333818
Energy: 0.8878791043745353
Energy: 1.1903216290401437
Energy: 0.8878791043767892
Energy: 1.1903216290423977
Energy: 0.9370524206722785
Energy: 0.935587587655142
Energy: 0.9370524206705879
Energy: 0.9355875876517612
Energy: 0.9370524206745323
Energy: 0.9355875876506342
Energy: 0.9890787274874798
Energy: 0.9399071720900783
Energy: 0.9890280938851456
Energy: 0.9399071720940229
Energy: 0.9890787274857893
Energy: 0.9399071720945863
Energy: 0.8520375184425232
Energy: 1.0021678797255582
Energy: 0.8520375184397059
Energy: 1.0021678797221771
Energy: 0.85203751844365
Energy: 1.00216787972105
Energy: 0.9195598113154207
Energy: 1.0536396773464476
Energy: 0.9195598113142938
Energy: 1.0536396773487016
Energy: 0.9195598113092736
Energy: 1.053639677349265
Energy: 1.1085949487586981
Energy: 0.8839488771064404
Energy: 1.1085949487592615
Energy: 0.8839488771109483
Energy: 1.1085949487558806
Energy: 0.8839488771098213
Energy: 0.9160033753519756
Energy: 0.8965840513110276
Energy: 0.9160033753463409
Energy: 0.8965840513076467
Energy: 0.9160033753497216
Energy: 0.8965840513070832
Energy: 0.9341331952736422
Energy: 0.9689867821086535
Energy: 0.9341331952691342
Energy: 0.9689867821013283
Energy: 0.9341331952758961
Energy: 0.9689867821013283
Energy: 0.8869206401923746
Energy: 0.9927509430856423
Energy: 0.8869217350200997
Energy: 0.9927509430862059
Energy: 0.8869206401901206
Energy: 0.9927509430862059

minimum gb energy = 0.8520375184397059 eV
minimum distance =  2.18479465931001 Angstroms
sigma value = 33


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

Energy: 0.994912046585302
Energy: 0.8967328066505624
Energy: 0.9949120465860929
Energy: 0.8967328066501311
Energy: 0.9949120465880342
Energy: 0.8967328066509219
Energy: 1.0064982727132628
Energy: 0.8573086716552211
Energy: 1.0064982727168579
Energy: 0.857308671656803
Energy: 1.0064982727124716
Energy: 0.8573086716552211
Energy: 0.9327061488090217
Energy: 1.0430444306188058
Energy: 0.9327061488106035
Energy: 1.0430444306183742
Energy: 0.9327061488106035
Energy: 1.0430444306180147
Energy: 0.9176902576193658
Energy: 0.880714579061009
Energy: 0.9176902576205883
Energy: 0.8807145790582769
Energy: 0.917690257617784
Energy: 0.8807145790586365
Energy: 0.9082360748296022
Energy: 0.9749730809466066
Energy: 0.9082360748343479
Energy: 0.9749730809374751
Energy: 0.9082360748319751
Energy: 0.9749730809363248
Energy: 1.0312342639008802
Energy: 0.9106305376799868
Energy: 1.031234263901671
Energy: 0.9106305376815688
Energy: 1.0312342639028933
Energy: 0.910630537679196
Energy: 0.8963988849279235
Energy: 0.9918474142274144
Energy: 0.896398884923969
Energy: 0.9918474142408599
Energy: 0.8963988849287143
Energy: 0.9918474142400691
Energy: 0.952332225966419
Energy: 0.9551609717382068
Energy: 0.9523322259703735
Energy: 0.9551609717389978
Energy: 0.9523322259616734
Energy: 0.9551609717397886
Energy: 1.027896680409347
Energy: 0.9345197550351095
Energy: 1.027896680415243
Energy: 0.9345197550338873
Energy: 1.0278966804128702
Energy: 0.9345197550244683
Energy: 1.1131322838547892
Energy: 0.8890499456911778
Energy: 1.1131322838555802
Energy: 0.8890499456899555
Energy: 1.113132283856371
Energy: 0.8890499456911778
Energy: 0.9517972416370161
Energy: 0.9500374606607779
Energy: 0.9517972416374475
Energy: 0.9500374606615688
Energy: 0.9517972416350747
Energy: 0.9500374606607779
Energy: 0.9752322840866404
Energy: 0.8810467759294545
Energy: 0.9752322841111586
Energy: 0.8810467759294545
Energy: 0.9752322841182769
Energy: 0.8810467759306767
Energy: 0.9350440820675693
Energy: 1.0297433891619279
Energy: 0.935044082069942
Energy: 1.0297433891631502
Energy: 0.9350440820695106
Energy: 1.0297433891615684
Energy: 0.9549711093615517
Energy: 0.9592801013573389
Energy: 0.9549711093587475
Energy: 0.9592801013573389
Energy: 0.9549711093615517
Energy: 0.9592801013577703
Energy: 0.9606530282907315
Energy: 0.8941831254950002
Energy: 0.9606530282899406
Energy: 0.894183125498164
Energy: 0.9606530282915223
Energy: 0.8941831254950002
Energy: 0.9170735675761199
Energy: 1.0371601822781868
Energy: 0.9170735675749694
Energy: 1.0371601822935737
Energy: 0.9170735675754008
Energy: 1.0371601822797687
Energy: 0.9758711307471855
Energy: 0.8706820526183969
Energy: 0.9758711307487672
Energy: 0.8706820526152333
Energy: 0.9758711307463944
Energy: 0.8706820526219201
Energy: 0.8751834640687638
Energy: 0.9199442726329551
Energy: 0.8751834640679729
Energy: 0.9199442726325957
Energy: 0.8751834640695547
Energy: 0.9199442726333867
Energy: 1.0469017138682137
Energy: 0.9315772930330455
Energy: 1.0469017138623178
Energy: 0.931577293033477
Energy: 1.0469017138631085
Energy: 0.931577293033477
Energy: 0.9748511742015291
Energy: 0.9286175303985313
Energy: 0.9748511741952018
Energy: 0.9286175304016949
Energy: 0.9748511741987969
Energy: 0.9286175303977404
Energy: 0.8717875953578385
Energy: 0.9600197343963865
Energy: 0.871787595356688
Energy: 0.9600197343975369
Energy: 0.8717875953665385
Energy: 0.9600197343896277
Energy: 0.8519893728030742
Energy: 1.0089166297583902
Energy: 0.8519893728030742
Energy: 1.0089166297572398
Energy: 0.8519893728022833
Energy: 1.0089166297580305
Energy: 0.9610341130933053
Energy: 0.8446960014938512
Energy: 0.9610341130953186
Energy: 0.8446960014962239
Energy: 0.9610341130937368
Energy: 0.8446960014942826
Energy: 0.8706293661648359
Energy: 0.9651216784026291
Energy: 0.87062936616915
Energy: 0.9651216784057929
Energy: 0.8706293661648359
Energy: 0.9651216784006879
Energy: 0.9322939410861819
Energy: 0.870640162915015
Energy: 0.9322939410874043
Energy: 0.8706401629221334
Energy: 0.932293941085391
Energy: 0.8706401629205515
Energy: 0.9057997559624842
Energy: 0.9666118566574694
Energy: 0.9057997559609023
Energy: 0.9666118566543057
Energy: 0.9057997559601114
Energy: 0.9666118566522924
Energy: 1.0052432901567565
Energy: 0.9005007813905049
Energy: 1.0052432901547432
Energy: 0.900500781388923
Energy: 1.005243290157116
Energy: 0.9005007813912957
Energy: 0.9597352351635628
Energy: 0.8715892566123272
Energy: 0.9597352351651447
Energy: 0.8715892565945678
Energy: 0.9597352351615496
Energy: 0.8715892566107455
Energy: 0.9393989893145256
Energy: 1.0297191911520325
Energy: 0.9393989893398347
Energy: 1.0297191911504506
Energy: 0.9393989893275397
Energy: 1.0297191911504506
Energy: 0.8848248555468377
Energy: 1.1108455393979644
Energy: 0.8848248555468377
Energy: 1.1108455393932188
Energy: 0.8848248555460467
Energy: 1.1108455394046512
Energy: 0.9160636915483323
Energy: 0.8716414883419371
Energy: 0.9160636915507049
Energy: 0.8716414883419371
Energy: 0.9160636915495546
Energy: 0.8716414883411461
Energy: 0.8706740683050206
Energy: 0.9750377318712775
Energy: 0.8706740683460761
Energy: 0.9750377318669634
Energy: 0.8706740682868296
Energy: 0.975037731866532
Energy: 0.9628680304810706
Energy: 0.904501578062007
Energy: 0.9628680304810706
Energy: 0.9045015780600657
Energy: 0.9628680304889796
Energy: 0.9045015780569021
Energy: 0.9541105927409375
Energy: 0.9666676168932649
Energy: 0.9541105927385647
Energy: 0.9666676168940558
Energy: 0.9541105927354011
Energy: 0.9666676168929053
Energy: 0.9538842169091609
Energy: 0.9666845417225843
Energy: 0.9538842169072197
Energy: 0.9666845417230159
Energy: 0.95388421690837
Energy: 0.9666845417230159
Energy: 0.9754137390827057
Energy: 0.904510169381875
Energy: 0.9754137390827057
Energy: 0.9045101693823066
Energy: 0.9754137390807645
Energy: 0.9045101693874115
Energy: 0.8706628366018812
Energy: 0.9748851104396015
Energy: 0.8706628366118034
Energy: 0.9748851104368692
Energy: 0.8706628365821804
Energy: 0.9748851104376601
Energy: 0.9162366153617045
Energy: 0.8716294633857952
Energy: 0.9162366153585411
Energy: 0.8716294633845727
Energy: 0.9162366153581095
Energy: 0.8716294633814092
Energy: 0.8848151881051002
Energy: 1.1130993477365168
Energy: 0.8848151881055316
Energy: 1.1130993476341295
Energy: 0.8848151881047408
Energy: 1.113099347675257
Energy: 0.9393196482245189
Energy: 1.0296618464110228
Energy: 0.9393196482245189
Energy: 1.0296618464118137
Energy: 0.9393196482091322
Energy: 1.029661846412245
Energy: 0.95971250713942
Energy: 0.8718625049532751
Energy: 0.9597125071374786
Energy: 0.8718625049639165
Energy: 0.9597125071386291
Energy: 0.8718625049662891
Energy: 1.00532008564856
Energy: 0.9002899574340562
Energy: 1.0053200856469782
Energy: 0.9002899574336966
Energy: 1.0053200856489914
Energy: 0.9002899574348469
Energy: 0.9058391933522287
Energy: 0.9667527127020475
Energy: 0.9058391933593468
Energy: 0.9667527127024789
Energy: 0.9058391933557518
Energy: 0.9667527127048516
Energy: 0.9307099718906615
Energy: 0.8706846898721035
Energy: 0.9307099718807391
Energy: 0.8706846898673579
Energy: 0.9307099718954069
Energy: 0.8706846898669984
Energy: 0.8706153405319362
Energy: 0.9647598172778437
Energy: 0.8706153405465321
Energy: 0.9647598172786347
Energy: 0.8706153405445908
Energy: 0.9647598172778437
Energy: 0.9610147241540464
Energy: 0.8445214390618874
Energy: 0.9610147241500918
Energy: 0.8445214390603055
Energy: 0.9610147241528241
Energy: 0.8445214390603055
Energy: 0.8519973254102449
Energy: 1.0090462472050934
Energy: 0.8519973254074406
Energy: 1.0090462472058843
Energy: 0.8519973254058587
Energy: 1.0090462472050934

minimum gb energy = 0.8445214390603055 eV
minimum distance =  2.27425055497687 Angstroms
sigma value = 67


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

Energy: 1.0579078387334886
Energy: 0.982342816837777
Energy: 1.0579078387334886
Energy: 0.982342816837777
Energy: 1.0579078387334886
Energy: 0.982342816837777
Energy: 0.9552814316023259
Energy: 0.8829278309331122
Energy: 0.9552814316049689
Energy: 0.8829278309331122
Energy: 0.9552814316049689
Energy: 0.8829278309331122
Energy: 1.1750853592514794
Energy: 1.1233795662595671
Energy: 1.1750853592514794
Energy: 1.1233795662569244
Energy: 0.8845187780291909
Energy: 1.1233795662595671
Energy: 0.9553999591886451
Energy: 0.8829571461098397
Energy: 0.9553999591886451
Energy: 0.8829571461098397
Energy: 0.9553999591886451
Energy: 0.8829571461071968
Energy: 1.0579078387334886
Energy: 0.982342816843063
Energy: 1.0579078387361314
Energy: 0.982342816845646
Energy: 1.0579078387334886
Energy: 0.982342816845646
Energy: 0.955281431599683
Energy: 0.8829278309357553
Energy: 0.9552814316023259
Energy: 0.8829278309357553
Energy: 0.955281431599683
Energy: 0.8829278309357553
Energy: 0.8845187780344768
Energy: 1.1233795662542811
Energy: 0.8845187780318339
Energy: 1.1233795662542811
Energy: 0.8845187780344768
Energy: 1.1233795662542811

minimum gb energy = 0.8829278309331122 eV
minimum distance =  2.28341281473741 Angstroms
sigma value = 3


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

Energy: 1.2742581224707132
Energy: 1.11746511390574
Energy: 1.2251540572828619
Energy: 1.1174651139021434
Energy: 1.2742581224599234
Energy: 1.1174651139021434
Energy: 1.1461993503197223
Energy: 1.0439981049817715
Energy: 1.1461993503197223
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Energy: 1.1170825766830565
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Energy: 1.1003574651828536
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Energy: 1.1658817100869225
Energy: 1.1254411983426345
Energy: 1.166387127913818
Energy: 1.125441198357021
Energy: 1.1658817100689396
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Energy: 1.2279508805172266
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Energy: 1.2279508805352095
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Energy: 1.0780702481991344
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Energy: 1.078070248202731
Energy: 1.0300167444647819
Energy: 1.1768098373425677
Energy: 1.0300167444611852
Energy: 1.1768098373533575
Energy: 1.0300167444611852
Energy: 1.1768098373497609
Energy: 1.1550605463413501
Energy: 1.1255807550116006
Energy: 1.1550605463413501
Energy: 1.1255807550116006
Energy: 1.1550605463413501
Energy: 1.1255807550116006
Energy: 1.0730648657576158
Energy: 1.0827799788263077
Energy: 1.073072619530052
Energy: 1.0827799254728223
Energy: 1.0730648657504227
Energy: 1.0827800174906677
Energy: 1.2105718807847103
Energy: 1.0420791367533455
Energy: 1.2105718807847103
Energy: 1.0420791367353626
Energy: 1.2105718807847103
Energy: 1.0420791367317659
Energy: 1.0984278517292732
Energy: 1.0763473702982158
Energy: 1.0984278517292732
Energy: 1.0763473702910227
Energy: 1.098427851740063
Energy: 1.0763473702910227
Energy: 1.1058464794650258
Energy: 1.0441389078928085
Energy: 1.1058464794650258
Energy: 1.044138907907195
Energy: 1.1058464794614293
Energy: 1.044138907907195
Energy: 1.119070894018034
Energy: 1.0841165424980883
Energy: 1.119070894018034
Energy: 1.084116542519668
Energy: 1.119070894007244
Energy: 1.084116542519668
Energy: 1.22875499193465
Energy: 1.057697028797176
Energy: 1.2287549919166671
Energy: 1.0576970288007725
Energy: 1.2287549919094736
Energy: 1.0576970288007725
Energy: 1.177692491446764
Energy: 1.0760710753322003
Energy: 1.17769244749062
Energy: 1.076071075317814
Energy: 1.177692491446764
Energy: 1.0760710753142173
Energy: 1.1371657853140829
Energy: 1.1004590006241466
Energy: 1.1371657853068895
Energy: 1.1004590006313397
Energy: 1.1371657853068895
Energy: 1.1004590006313397
Energy: 1.0730597839431428
Energy: 1.157095451796433
Energy: 1.0730597839503364
Energy: 1.1570954518000296
Energy: 1.0730597839431428
Energy: 1.1570954518000296
Energy: 1.1420331723880828
Energy: 1.1240553928788435
Energy: 1.1420331723916792
Energy: 1.1240553928716503
Energy: 1.1420331723880828
Energy: 1.1240553928716503
Energy: 1.1319034745622332
Energy: 1.1240254501443816
Energy: 1.1320636639535095
Energy: 1.1240254501551714
Energy: 1.1319034745694263
Energy: 1.1240254501551714

minimum gb energy = 1.0071318315202373 eV
minimum distance =  2.25518697291467 Angstroms
sigma value = 81


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

Energy: 1.3402263895979123
Energy: 1.2149721540605012
Energy: 1.2062191647131926
Energy: 1.2149721540609948
Energy: 1.3402263895959379
Energy: 1.2149721540560587
Energy: 1.2547725486575496
Energy: 1.147982099263669
Energy: 1.2547725486550814
Energy: 1.147618019801418
Energy: 1.2547725486457026
Energy: 1.147982099269099
Energy: 1.1618438240923548
Energy: 0.9846405238370216
Energy: 1.1616416444927389
Energy: 0.9846405238330725
Energy: 1.1618438240943294
Energy: 0.9846405238335663
Energy: 1.0816345378763583
Energy: 1.1128420722007453
Energy: 1.0816345378748775
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Energy: 1.0816345378768517
Energy: 1.1128420721963024
Energy: 1.2066497292921659
Energy: 1.0079689665760398
Energy: 1.2066497292911784
Energy: 1.0079689665725846
Energy: 1.2066497292911784
Energy: 1.0079689665681417
Energy: 1.151244637638434
Energy: 1.1991907804483157
Energy: 1.151244637642383
Energy: 1.1992867709266373
Energy: 1.1512446376438639
Energy: 1.199190780446835
Energy: 1.0393912135182424
Energy: 1.1980199241828784
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Energy: 1.1980279033487211
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Energy: 1.1275587796614766
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Energy: 1.144960092795056
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Energy: 0.9855849608649833
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Energy: 0.9855849608689323
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Energy: 0.9853875612987988
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Energy: 0.9853875613071905
Energy: 1.0641125994577505
Energy: 0.9853875612968243
Energy: 1.0641125994641676
Energy: 1.1441782729837198
Energy: 0.9891220288576167
Energy: 1.1441782729837198
Energy: 0.9891220288556422
Energy: 1.1441782729876688
Energy: 0.9891220288699574
Energy: 1.229577478862062
Energy: 1.1984837893113562
Energy: 1.2306215828846707
Energy: 1.1984661828105487
Energy: 1.2295774788773646
Energy: 1.1984837893098752
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Energy: 1.4082790815273896
Energy: 1.19053571334927
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Energy: 0.9844587961674621
Energy: 1.1629225598362676
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Energy: 1.1651944812226784
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Energy: 1.1629225598298505
Energy: 1.112644168361302
Energy: 1.2666117567940338
Energy: 1.1126441683617956
Energy: 1.2666117567984767
Energy: 1.1126441683563657
Energy: 1.2666117567920592
Energy: 1.01065521971562
Energy: 1.1447951369255458
Energy: 1.0106552197185816
Energy: 1.144795136926533
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Energy: 1.1447951369304818
Energy: 1.2690189593226437
Energy: 1.2413977192622432
Energy: 1.0626883404473275
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Energy: 1.2690189593295098
Energy: 1.2413977192666859
Energy: 1.2685696927940413
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Energy: 1.062488836659273
Energy: 0.9667267756129562
Energy: 1.2685696927974965
Energy: 0.9667267756188797
Energy: 1.1917304967626206
Energy: 1.145364534214741
Energy: 1.191730496759165
Energy: 1.1453706453443568
Energy: 1.1917304967586717
Energy: 1.1453645342162218
Energy: 1.1405606562789201
Energy: 1.1464911470300958
Energy: 1.14056065628435
Energy: 1.1464911470226915
Energy: 1.1405606562759585
Energy: 1.1464911470197294
Energy: 0.9845797802718529
Energy: 1.3215838856552915
Energy: 0.984579780268891
Energy: 1.321583885662696
Energy: 0.9845797802669165
Energy: 1.321583885662696
Energy: 1.1902903278111452
Energy: 1.0862063106143556
Energy: 1.1902903278121324
Energy: 1.0862063106168236
Energy: 1.1902903278096642
Energy: 1.086206310613862
Energy: 1.2293128519055363
Energy: 1.198886807510132
Energy: 1.229727389454723
Energy: 1.1988914526619543
Energy: 1.2293128519001064
Energy: 1.1988868075111194
Energy: 1.1443524345744949
Energy: 1.2458836586923414
Energy: 1.1444428929776915
Energy: 1.2458836586923414
Energy: 1.1443524345710396
Energy: 1.2458836586923414
Energy: 0.9851133359231364
Energy: 1.0639829693296239
Energy: 0.9851133359246173
Energy: 1.0642084148538609
Energy: 0.9851133359246173
Energy: 1.0639829693390028
Energy: 1.1540480345579618
Energy: 0.9856365753251646
Energy: 1.1540480345594426
Energy: 0.9856365753197348
Energy: 1.1540480345579618
Energy: 0.9856365753162794
Energy: 1.0116231095784496
Energy: 1.1452240690484765
Energy: 1.0116231095749941
Energy: 1.1452240690499573
Energy: 1.0116231095794368
Energy: 1.145224069047489
Energy: 1.2685901430749715
Energy: 1.1587027483014378
Energy: 1.1284320325578387
Energy: 1.159402315481017
Energy: 1.2685901430793693
Energy: 1.1587027482584922
Energy: 1.2925629109781955
Energy: 1.0346843596033566
Energy: 1.1457763013734503
Energy: 1.0345932142372762
Energy: 1.2925629109742465
Energy: 1.0346843595974329
Energy: 1.3169502845432182
Energy: 1.3853639855376942
Energy: 1.1905827466110532
Energy: 1.3853639855367068
Energy: 1.3169502845402563
Energy: 1.3853639855441113
Energy: 1.1421931360845152
Energy: 1.1981969035472657
Energy: 1.142193136088958
Energy: 1.198196903561087
Energy: 1.1421931360869833
Energy: 1.198196903547759
Energy: 1.1448829590127003
Energy: 0.9894598546013241
Energy: 1.144882959009245
Energy: 0.9894598546057667
Energy: 1.1448829590072704
Energy: 0.9894598546146072
Energy: 1.2370162104509927
Energy: 1.1982902355801355
Energy: 1.2370162104485243
Energy: 1.1982125586043042
Energy: 1.237016210450499
Energy: 1.1982902355771738

minimum gb energy = 0.9667267756129562 eV
minimum distance =  2.28749359335115 Angstroms
sigma value = 43


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

Energy: 1.4081614347974953
Energy: 1.1219412103967181
Energy: 1.3349665742050296
Energy: 1.1219412103942927
Energy: 1.4081614347968894
Energy: 1.121941210394899
Energy: 1.2197551638391368
Energy: 1.0921498219743746
Energy: 1.2197551638403494
Energy: 1.0921498219701302
Energy: 1.2197551638427748
Energy: 1.0921498219683115
Energy: 1.1861113955902542
Energy: 1.2678393013150044
Energy: 1.1862430666848696
Energy: 1.2678393013119726
Energy: 1.2246642464704491
Energy: 1.2678393013113662
Energy: 1.0223960272890733
Energy: 1.1148939025413414
Energy: 1.022396027281191
Energy: 1.114893902552862
Energy: 1.0223960272824038
Energy: 1.1148939025534683
Energy: 1.1769545037327038
Energy: 1.1220782670401237
Energy: 1.17695450373331
Energy: 1.1220782670419427
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Energy: 1.122078267042549
Energy: 1.1286350145948691
Energy: 1.2289733536235687
Energy: 1.1286350145894397
Energy: 1.2289733536223562
Energy: 1.128635014588227
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Energy: 1.28799210876119
Energy: 1.1887742734066413
Energy: 1.2879921087581583
Energy: 1.1887742734054287
Energy: 1.2879921087569457
Energy: 1.1413792361434716
Energy: 1.2138266263622064
Energy: 1.1413811995135668
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Energy: 1.033866670100238
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Energy: 1.147314350893767
Energy: 1.0338666701008443
Energy: 1.0555282279201494
Energy: 1.111902887724037
Energy: 1.0555282279243938
Energy: 1.111902887724643
Energy: 1.055528227925
Energy: 1.111902887724643
Energy: 1.0620040046971173
Energy: 1.071393194224058
Energy: 1.0620040046946921
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Energy: 1.0620040046977237
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Energy: 1.1413284867230888
Energy: 1.1251424786904238
Energy: 1.1413284867261206
Energy: 1.1251424786958533
Energy: 1.1413284867327904
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Energy: 1.2272041459758047
Energy: 1.2289680557150688
Energy: 1.2253697577307174
Energy: 1.2289680557187068
Energy: 1.22720414596671
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Energy: 1.1088432043710537
Energy: 1.0622475248532806
Energy: 1.1088432043686285
Energy: 1.0623171601205363
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Energy: 1.0621628227317856
Energy: 1.1631161822529386
Energy: 1.0621628227329987
Energy: 1.1631161822559701
Energy: 1.0621628227408808
Energy: 1.1631161822541511
Energy: 1.1435492825474551
Energy: 1.1652455327104616
Energy: 1.1435492825438172
Energy: 1.1652455327195566
Energy: 1.1435492825444233
Energy: 1.1652455327195566
Energy: 1.142424540958724
Energy: 1.0929840662699024
Energy: 1.1424245409611493
Energy: 1.092984066271115
Energy: 1.1424245409635745
Energy: 1.092984066271115
Energy: 1.2678492894427325
Energy: 1.1665917945916826
Energy: 1.205777325139499
Energy: 1.1665917945886508
Energy: 1.2678492894445514
Energy: 1.1665917945886508
Energy: 1.2679215402229973
Energy: 1.0953885616114054
Energy: 1.206418272147098
Energy: 1.095388561610799
Energy: 1.2679215402260287
Energy: 1.0953885616138306
Energy: 1.1783777971812603
Energy: 1.09265056222012
Energy: 1.1783777976491585
Energy: 1.0926505622158755
Energy: 1.1783777983437158
Energy: 1.0926505622158755
Energy: 1.0900835523945551
Energy: 1.031088126870562
Energy: 1.0900835523945551
Energy: 1.0310881268717749
Energy: 1.0900835523994055
Energy: 1.0310881268675305
Energy: 1.2060782669608463
Energy: 1.1743955806633888
Energy: 1.2060782669596335
Energy: 1.1743955806555062
Energy: 1.2060782669669095
Energy: 1.1743955806555062
Energy: 1.0619351378192783
Energy: 1.1418716222112955
Energy: 1.0619351378229165
Energy: 1.1418716222064722
Energy: 1.0619351378247355
Energy: 1.1418716222064722
Energy: 1.2195566559454902
Energy: 1.2275934034488145
Energy: 1.2195566559485218
Energy: 1.2275934034451765
Energy: 1.2195566559479156
Energy: 1.2275934034415383
Energy: 1.1413325931430993
Energy: 1.1378750339385877
Energy: 1.1413381874203818
Energy: 1.1378750339385877
Energy: 1.1413325931479499
Energy: 1.1378750339373749
Energy: 1.2060092219293062
Energy: 1.2063779976374143
Energy: 1.2060092219274872
Energy: 1.2063779976362012
Energy: 1.206009221925668
Energy: 1.2063779976368079
Energy: 1.1451372158456945
Energy: 1.0294773543029208
Energy: 1.145137215842663
Energy: 1.0294773543004954
Energy: 1.1451372158408437
Energy: 1.029477354299889
Energy: 1.1479077024005475
Energy: 1.0338487640532883
Energy: 1.147907702399335
Energy: 1.0338487640514693
Energy: 1.1479077024017603
Energy: 1.033848764050863
Energy: 1.1414044647296129
Energy: 1.1537708591013491
Energy: 1.1414044647284
Energy: 1.1537708591037745
Energy: 1.1414044647277939
Energy: 1.1537708591037745
Energy: 1.2185915874840165
Energy: 1.1431824821823882
Energy: 1.2185915874834101
Energy: 1.1431824820648142
Energy: 1.2185915874821973
Energy: 1.1431824820357102
Energy: 1.1957124429299846
Energy: 1.2265249322621674
Energy: 1.195577065762056
Energy: 1.2265249322603484
Energy: 1.1957124429318036
Energy: 1.2265249322603484

minimum gb energy = 1.022396027281191 eV
minimum distance =  2.20383085302873 Angstroms
sigma value = 57


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

Energy: 1.1547231427885336
Energy: 0.9931361670088313
Energy: 1.1547231427853935
Energy: 0.9931361670158971
Energy: 1.1547231427853935
Energy: 0.993136167007297
Energy: 1.070917553927044
Energy: 0.9334929960318146
Energy: 1.070917553927044
Energy: 0.9334929960318146
Energy: 1.070917553929399
Energy: 0.9334929960325995
Energy: 1.0708751298911847
Energy: 1.231770041813828
Energy: 1.070875129894325
Energy: 1.231770041813828
Energy: 1.0708751298935397
Energy: 1.231770041813828
Energy: 1.050173791190895
Energy: 1.1286784414376598
Energy: 1.0501737911877547
Energy: 1.1286784414376598
Energy: 1.0501737911830442
Energy: 1.1286784414384452
Energy: 1.089841707246435
Energy: 1.1278516819708992
Energy: 1.0898417072440798
Energy: 1.1278516819716844
Energy: 1.0898417072495756
Energy: 1.1278516819716844
Energy: 1.0712918097380606
Energy: 1.033940979297551
Energy: 1.0712918097357054
Energy: 1.033940979296766
Energy: 1.0712918097309947
Energy: 1.033940979296766
Energy: 1.1220327910184014
Energy: 1.1603186065168742
Energy: 1.1220327910191865
Energy: 1.1603186065176592
Energy: 1.1220327910184014
Energy: 1.1603186065184445
Energy: 1.050870723243093
Energy: 0.9929556292332393
Energy: 1.0508707232532988
Energy: 0.9929556292355946
Energy: 1.0508707232548689
Energy: 0.9929556292426605
Energy: 1.0676271971268787
Energy: 0.9333239652457075
Energy: 1.0676271971253084
Energy: 0.9333239652472778
Energy: 1.0676271971268787
Energy: 0.9333239652519881
Energy: 0.9214204033122156
Energy: 1.0675329343345188
Energy: 0.9214204033153558
Energy: 1.0675329343337336
Energy: 0.9214204033145706
Energy: 1.0675329343337336
Energy: 1.1225111854466012
Energy: 1.1319570445096727
Energy: 1.1225111854473864
Energy: 1.1319570445088876
Energy: 1.1225111854466012
Energy: 1.1319570445096727
Energy: 1.0608942506613734
Energy: 1.1362670392662573
Energy: 1.060894250659018
Energy: 1.1362670392623675
Energy: 1.060894250657448
Energy: 1.1362670392600123
Energy: 1.0750630489022799
Energy: 0.93339606023653
Energy: 1.075063048899175
Energy: 0.9333960602428106
Energy: 1.0750630489007096
Energy: 0.93339606023496
Energy: 1.1256735165358471
Energy: 0.9419973494758637
Energy: 1.125673516535062
Energy: 0.9419973494774339
Energy: 1.1256735165405576
Energy: 0.9419973494766488
Energy: 1.0591272917887544
Energy: 0.9395652499978886
Energy: 1.0591272917926797
Energy: 0.939565250004169
Energy: 1.0591272917903243
Energy: 0.9395652500073094
Energy: 1.0671528700547932
Energy: 1.0396976314830237
Energy: 1.0671528700579336
Energy: 1.0396976314798836
Energy: 1.0671528700571484
Energy: 1.0396976314884836
Energy: 0.9213786615767
Energy: 1.0702571522266222
Energy: 0.9213786615837656
Energy: 1.0702571522274074
Energy: 0.9213786615821955
Energy: 1.0702571522281923
Energy: 1.1085912538746945
Energy: 1.0594509597732378
Energy: 1.1085912538731244
Energy: 1.028829743294956
Energy: 1.1085912538762648
Energy: 1.028829743295741
Energy: 0.921431819500272
Energy: 1.0702751796081966
Energy: 0.9214318195057675
Energy: 1.0702751796081966
Energy: 0.9214318194955614
Energy: 1.0702751796081966
Energy: 1.0672124826802754
Energy: 1.0396535172832633
Energy: 1.0672124826810248
Energy: 1.0396535172856187
Energy: 1.0672124826794902
Energy: 1.0396535172856187
Energy: 1.0588481665683387
Energy: 0.939631038008342
Energy: 1.0588481665683387
Energy: 0.9396310380192975
Energy: 1.0588481665628435
Energy: 0.9396310380192975
Energy: 1.1260133027441899
Energy: 1.1232314786994042
Energy: 1.126013302746545
Energy: 1.1232314787009743
Energy: 1.12601330274576
Energy: 1.1232314786978341
Energy: 1.075603845708454
Energy: 0.9335060146576941
Energy: 1.0756038457076686
Energy: 0.933506014665545
Energy: 1.0756038457076686
Energy: 0.9335060146584792
Energy: 1.061703777708481
Energy: 1.1352778500439047
Energy: 1.0617037777100513
Energy: 1.1352778500454748
Energy: 1.0617037777100513
Energy: 1.1352778500446894

minimum gb energy = 0.9213786615767 eV
minimum distance =  2.23023289856487 Angstroms
sigma value = 17


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

Energy: 1.1294535793845177
Energy: 0.9967743638924838
Energy: 1.1294535793845177
Energy: 0.9967743638913736
Energy: 1.1294535793845177
Energy: 0.9967743638913736
Energy: 0.9543268256362516
Energy: 0.9431016899857108
Energy: 0.9543268256351415
Energy: 0.9431016899868211
Energy: 0.9543268256362516
Energy: 0.9431016899846006
Energy: 1.1175443782743453
Energy: 1.1390954602807002
Energy: 1.1175443782699044
Energy: 1.1390954602807002
Energy: 1.1175443782743453
Energy: 1.1390954602807002
Energy: 0.8855761849688137
Energy: 1.1372664265987065
Energy: 0.8855761849677036
Energy: 1.1372664265998165
Energy: 0.8855761849688137
Energy: 1.1372664266009267
Energy: 1.1295158528806406
Energy: 1.090449515470829
Energy: 1.1295158528784202
Energy: 1.090449515470829
Energy: 1.1295158528784202
Energy: 1.0904495154719391
Energy: 1.0395811987221963
Energy: 1.1164942303515701
Energy: 1.0395811987221963
Energy: 1.11649423035046
Energy: 1.0395811987221963
Energy: 1.11649423035046
Energy: 1.0553219581441398
Energy: 0.9520941944752626
Energy: 1.05532195814525
Energy: 0.9520941944752626
Energy: 1.055321958141919
Energy: 0.9520941944741522
Energy: 0.885732976684779
Energy: 1.0807524388401235
Energy: 0.8857329766858895
Energy: 1.0807524388401235
Energy: 0.885732976684779
Energy: 1.0807524388401235
Energy: 1.088744513678913
Energy: 0.9430796229229889
Energy: 1.0887445136811336
Energy: 0.943079622924099
Energy: 1.0887445136800233
Energy: 0.943079622924099
Energy: 1.0262198456677016
Energy: 0.9568022525138657
Energy: 1.0262198456677016
Energy: 0.9568022525127553
Energy: 1.0262198456688116
Energy: 0.9568022525138657
Energy: 1.0103104780445389
Energy: 1.1406092142356623
Energy: 1.0103104780434284
Energy: 1.1406092142345519
Energy: 1.0103104780434284
Energy: 1.1406092142356623
Energy: 1.019674681537139
Energy: 0.9429544010575441
Energy: 1.0196746815349182
Energy: 0.9429544010586545
Energy: 1.0196746815349182
Energy: 0.9429544010586545
Energy: 0.8852817224297428
Energy: 1.114221890231854
Energy: 0.8852817224286326
Energy: 1.114221890231854
Energy: 0.8852817224286326
Energy: 1.114221890231854
Energy: 1.0260106762768084
Energy: 1.110950264822799
Energy: 1.0260106762768084
Energy: 1.110950264822799
Energy: 1.0260106762768084
Energy: 1.110950264822799
Energy: 1.0388220652532068
Energy: 1.3194983503091866
Energy: 1.038822065254317
Energy: 1.3194983503080762
Energy: 1.0388220652532068
Energy: 1.3194983503091866
Energy: 1.0393265272822363
Energy: 1.1140366375707644
Energy: 1.0393265272822363
Energy: 1.114036637572985
Energy: 1.0393265272822363
Energy: 1.1140366375718749
Energy: 1.0238461937813998
Energy: 1.1147248098912277
Energy: 1.02384619378251
Energy: 1.114724809892338
Energy: 1.02384619378251
Energy: 1.114724809892338

minimum gb energy = 0.8852817224286326 eV
minimum distance =  2.27482127386081 Angstroms
sigma value = 17


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

Energy: 1.0064396932288524
Energy: 0.9525047403839088
Energy: 1.0328307493302114
Energy: 0.9525047403864811
Energy: 1.0064396932232786
Energy: 0.9525047403847661
Energy: 0.9726345886499485
Energy: 0.9772704727021374
Energy: 0.9283862966180049
Energy: 0.9790773780307326
Energy: 0.9726345886439463
Energy: 0.9772704726901326
Energy: 1.1023092194334836
Energy: 1.000237942477491
Energy: 1.063214542823845
Energy: 1.0002379424882097
Energy: 1.1023092194493471
Energy: 1.0002379424899246
Energy: 0.8762821010715788
Energy: 1.0451513526530836
Energy: 0.8762674020383288
Energy: 1.04515135265094
Energy: 0.8762821010441392
Energy: 1.04515135265094
Energy: 0.9310693365382089
Energy: 0.9016363562663927
Energy: 0.9310693365600747
Energy: 0.9016363562642491
Energy: 0.9310693365497849
Energy: 0.9016363562633916
Energy: 1.0144130274600212
Energy: 0.9646968822487162
Energy: 1.013822065588941
Energy: 0.9646968822560046
Energy: 1.0144130274493024
Energy: 0.9646968822564334
Energy: 0.9300247047659871
Energy: 0.9647788284824221
Energy: 0.9300247047655582
Energy: 0.9647788284969995
Energy: 0.930024704762557
Energy: 0.9647788284978569
Energy: 1.111219722773812
Energy: 1.1957759687560818
Energy: 1.1112197227678096
Energy: 1.1957759687453635
Energy: 1.111219722762236
Energy: 1.1957759687453635
Energy: 0.9809758161280173
Energy: 0.9859834304642119
Energy: 0.9809758161245874
Energy: 0.9859834304526357
Energy: 0.9809758161224437
Energy: 0.985983430450921
Energy: 0.9331974045183353
Energy: 0.8549904559356392
Energy: 0.9331974045204792
Energy: 0.8549904559536463
Energy: 0.9331974045260139
Energy: 0.8549904559527889
Energy: 0.8759344549795415
Energy: 1.1696025335985247
Energy: 0.8759344549859727
Energy: 1.1696025335895213
Energy: 0.8759344549962627
Energy: 1.1696025335882738
Energy: 1.0699083582046132
Energy: 0.9326653065641501
Energy: 1.0699083582097582
Energy: 0.9326653065757262
Energy: 1.0699083582157602
Energy: 0.9326653065778701
Energy: 0.9720995506339952
Energy: 0.942133301018904
Energy: 0.9720995506113108
Energy: 0.9421333010219053
Energy: 0.9720995506203144
Energy: 0.9421333010214765
Energy: 0.9323992453193127
Energy: 1.0682298196317797
Energy: 0.93239924532742
Energy: 1.0682298196399258
Energy: 0.9323992453299924
Energy: 1.0682298196399258
Energy: 0.9843324781441378
Energy: 0.9316544748922949
Energy: 0.9840883721231592
Energy: 0.931654474885435
Energy: 0.9843324781008346
Energy: 0.9316544748850061
Energy: 0.8775266824993782
Energy: 0.9750019333137325
Energy: 0.8775241238430628
Energy: 0.9750019333158763
Energy: 0.8775266824890883
Energy: 0.9750019333175913
Energy: 0.9478244307016627
Energy: 1.0569956128486924
Energy: 0.9478244307050927
Energy: 1.056995612844834
Energy: 0.9478244307055215
Energy: 1.0569956128439761
Energy: 1.0584078187648052
Energy: 1.2256799770226174
Energy: 1.0584078187626615
Energy: 1.2256799770281912
Energy: 1.0584078187648052
Energy: 1.2256799770277627
Energy: 0.9661639149458147
Energy: 1.1111412568329486
Energy: 0.966163914941956
Energy: 1.1111412568222299
Energy: 0.9661639149372399
Energy: 1.1111412568230874
Energy: 0.9464872469510478
Energy: 0.9664099121923511
Energy: 0.9464872469510478
Energy: 0.9664099122034986
Energy: 0.9464872469450453
Energy: 0.9664099122039272
Energy: 0.9895919884318904
Energy: 1.1111661885269568
Energy: 0.9895919884203143
Energy: 1.1111661885132371
Energy: 0.989591988432319
Energy: 1.1111661885132371
Energy: 1.0067905647779825
Energy: 1.2256157163416377
Energy: 1.0067905647728375
Energy: 1.2256157163540324
Energy: 1.0067905647826987
Energy: 1.2256157163544612
Energy: 0.9477505959437481
Energy: 1.0086227423241831
Energy: 0.9477505959351733
Energy: 1.0086227423241831
Energy: 0.9477505959446058
Energy: 1.0086227423246117
Energy: 0.8762970585842389
Energy: 1.1968265031735592
Energy: 0.876297058579094
Energy: 1.1968265031851353
Energy: 0.8762970585820952
Energy: 1.196826503184278
Energy: 1.0217142607687102
Energy: 0.9318226133877605
Energy: 1.0217142607734264
Energy: 0.9318226133993367
Energy: 1.0217142607763887
Energy: 0.9318226133984792
Energy: 0.9683649713754386
Energy: 1.0795148496312101
Energy: 0.9323615558437942
Energy: 1.0795148496342113
Energy: 0.9683649713600039
Energy: 1.0795148496342113
Energy: 0.9839951146233187
Energy: 0.934576801736235
Energy: 0.9485132984150687
Energy: 0.9345768017358065
Energy: 0.9839951146391822
Energy: 0.9345768017332339
Energy: 1.0963097639536181
Energy: 0.931591333083884
Energy: 1.050280370801965
Energy: 0.9315913330873138
Energy: 1.0963097639493307
Energy: 0.9315913330894576
Energy: 0.8766501394977692
Energy: 1.0085009421847055
Energy: 0.8767267697721959
Energy: 1.0085009405206338
Energy: 0.876650139487908
Energy: 1.008500941184446
Energy: 0.9331855828206553
Energy: 0.9994491687350857
Energy: 0.9331855828206553
Energy: 1.0150626817264112
Energy: 0.9331855828176541
Energy: 1.0108799435418814
Energy: 0.9975492795727124
Energy: 0.9862027222675398
Energy: 0.9975492795714263
Energy: 0.9862027222658248
Energy: 0.99754927957357
Energy: 0.9862027222658248
Energy: 1.0292681121769005
Energy: 1.2745407142137826
Energy: 1.0292681121726128
Energy: 1.2745407142184988
Energy: 1.0292681121747569
Energy: 1.2745407142184988
Energy: 0.9348780831291713
Energy: 0.9425863533636171
Energy: 0.9348780831334588
Energy: 0.9425863533691907
Energy: 0.9348780831308864
Energy: 0.9425863533709057
Energy: 1.0214346796126144
Energy: 0.903805772951005
Energy: 1.0214346796216178
Energy: 0.9038057729531486
Energy: 1.0214346795928921
Energy: 0.90380577295272
Energy: 0.9279540246482929
Energy: 0.9015912120866839
Energy: 0.9279540246487217
Energy: 0.9015912120974025
Energy: 0.9279540246388996
Energy: 0.9015912120879701
Energy: 0.8761309378655977
Energy: 1.0084181074787049
Energy: 0.8761309378595953
Energy: 1.0084181074701302
Energy: 0.8761309378570228
Energy: 1.008418107471845
Energy: 0.9853662031116506
Energy: 0.9155839137962716
Energy: 0.9853662031142231
Energy: 0.9155839137911268
Energy: 0.9853662031185104
Energy: 0.9155839137911268
Energy: 0.9560030898119356
Energy: 0.9159298406107408
Energy: 0.9560030898265129
Energy: 0.9159298406141706
Energy: 0.9560030898196531
Energy: 0.9159298406145995
Energy: 1.0328307493306397
Energy: 0.9525047403821937
Energy: 1.0328307493280673
Energy: 0.9525047403877673
Energy: 1.032830749331926
Energy: 0.9525047403860524
Energy: 0.928386296607715
Energy: 0.9517293666538843
Energy: 0.9283862966235785
Energy: 0.9517293666440232
Energy: 0.9283862966257223
Energy: 0.9517293666440232
Energy: 1.136616523814739
Energy: 1.000345011350133
Energy: 1.1366196294467377
Energy: 1.0003450113693877
Energy: 1.1366165238297452
Energy: 1.0003450113698162
Energy: 0.8762855016636311
Energy: 0.9315003885753228
Energy: 0.8762263479345708
Energy: 0.9315003885633181
Energy: 0.8762855016589148
Energy: 0.9315003885800391
Energy: 0.9310693365510713
Energy: 0.9016581369304326
Energy: 0.931069336564791
Energy: 0.9016581369270026
Energy: 0.9310693365532149
Energy: 0.9016581369274314

minimum gb energy = 0.8549904559356392 eV
minimum distance =  2.23773543456425 Angstroms
sigma value = 57


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

Energy: 0.8736045563330214
Energy: 0.8570806058899386
Energy: 0.873604556330927
Energy: 0.8570806058892407
Energy: 0.8736045563337193
Energy: 0.8570806058885425
Energy: 0.9798912381916595
Energy: 0.8399052217005984
Energy: 0.9798912381889308
Energy: 0.8399052216999002
Energy: 0.9798912381909614
Energy: 0.8399052216999002
Energy: 0.9746962000766444
Energy: 0.9058147307192554
Energy: 0.9746962000773426
Energy: 0.9058147307192554
Energy: 0.9746962000787387
Energy: 0.9058147307185572
Energy: 0.8749502327887918
Energy: 0.94901188536318
Energy: 0.874950232783905
Energy: 0.9490118853610857
Energy: 0.8749502327859994
Energy: 0.9490118853610857
Energy: 0.9839323989288633
Energy: 0.8294613717130724
Energy: 0.9839323989281652
Energy: 0.8294613717130724
Energy: 0.9839323989295615
Energy: 0.8294613717137705
Energy: 0.9414888082300965
Energy: 0.840568108376454
Energy: 0.9414888082273043
Energy: 0.8405681083778501
Energy: 0.9414888082293986
Energy: 0.8405681083785483
Energy: 1.0848797353958342
Energy: 0.9148403438920304
Energy: 1.0848797353979283
Energy: 0.9148403438899361
Energy: 1.0848797353944377
Energy: 0.9148403438906342
Energy: 1.0924933950172664
Energy: 1.0961613338492464
Energy: 1.0924933950172664
Energy: 1.0961613338492464
Energy: 1.0924933950165685
Energy: 1.0961613338492464
Energy: 0.8649758545919886
Energy: 0.8429093150437783
Energy: 0.8649758545947808
Energy: 0.8429093150444765
Energy: 0.8649758545926864
Energy: 0.8429093150430802
Energy: 0.8622659550935188
Energy: 0.8824937661360823
Energy: 0.8622659550921226
Energy: 0.8824937661360823
Energy: 0.8622659550928206
Energy: 0.8824937661367804
Energy: 1.0849512569657247
Energy: 1.096995528834296
Energy: 1.0849512569664228
Energy: 1.0969955288335982
Energy: 1.0849512569685171
Energy: 1.0969955288335982
Energy: 0.9006360551839621
Energy: 0.9548159890503758
Energy: 0.9006360551839621
Energy: 0.9548159890489797
Energy: 0.9006360551867545
Energy: 0.9548159890510739
Energy: 0.8599060488642688
Energy: 0.9128697009467776
Energy: 0.8599060488614764
Energy: 0.9128697009432872
Energy: 0.8599060488614764
Energy: 0.9128697009446833
Energy: 0.8096189642649994
Energy: 1.0102357480683137
Energy: 0.8096189642656973
Energy: 1.0102357480641253
Energy: 0.8096189642649994
Energy: 1.0102357480655215
Energy: 0.9664949414979391
Energy: 0.8541928412559654
Energy: 0.9664949414958448
Energy: 0.8541928412552672
Energy: 0.966494941496543
Energy: 0.8541928412559654
Energy: 0.8856484981082781
Energy: 0.9757607156243223
Energy: 0.8856484981117685
Energy: 0.9757607156257184
Energy: 0.8856484981110705
Energy: 0.9757607156250202
Energy: 0.8853638472625958
Energy: 0.9948740419713887
Energy: 0.8853638472618977
Energy: 0.9948740419713887
Energy: 0.885363847263992
Energy: 0.9948740419720866
Energy: 1.0395117591215501
Energy: 0.9198048536784126
Energy: 1.0395117591222482
Energy: 0.9198048536770164
Energy: 1.0395117591215501
Energy: 0.9198048536826013
Energy: 0.8097292388097099
Energy: 1.0411371506489273
Energy: 0.8097292388118041
Energy: 1.0411371506489273
Energy: 0.8097292388104079
Energy: 1.0411371506482292
Energy: 0.8570887736505113
Energy: 0.9427469688377785
Energy: 0.8570887736505113
Energy: 0.9427469688363824
Energy: 0.8570887736505113
Energy: 0.9427469688384766
Energy: 0.926777049889517
Energy: 1.117442320358305
Energy: 0.9267770498860264
Energy: 1.117442320357607
Energy: 0.926777049889517
Energy: 1.117442320357607
Energy: 0.7961498915538567
Energy: 1.0452643606253347
Energy: 0.7961498915566492
Energy: 1.0452643606246366
Energy: 0.7961498915538567
Energy: 1.0452643606239382
Energy: 0.8835442529425185
Energy: 0.9040762453731275
Energy: 0.883544252946009
Energy: 0.9040762453731275
Energy: 0.8835442529425185
Energy: 0.9040762453738257
Energy: 0.8936177575429837
Energy: 1.0451384192639768
Energy: 0.893617757538097
Energy: 1.045138419265373
Energy: 0.8936177575408893
Energy: 1.0451384192639768
Energy: 0.89416163387326
Energy: 1.1373043322431882
Energy: 0.894161633872562
Energy: 1.1373043322445844
Energy: 0.8941616338746564
Energy: 1.1373043322417922
Energy: 0.8578045197678438
Energy: 0.9024919955843476
Energy: 0.857804519768542
Energy: 0.9024919955850454
Energy: 0.857804519768542
Energy: 0.9024919955857437
Energy: 0.7957187040351569
Energy: 1.0410088886086715
Energy: 0.7957187040372512
Energy: 1.0410088886079736
Energy: 0.7957187040351569
Energy: 1.0410088886079736

minimum gb energy = 0.7957187040351569 eV
minimum distance =  2.23111934884674 Angstroms
sigma value = 43


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

Energy: 0.8645838018712723
Energy: 0.8220076811271092
Energy: 0.8323330773378197
Energy: 0.8220076811235487
Energy: 0.8645838018794105
Energy: 0.8220076811240574
Energy: 0.8231767014893575
Energy: 0.8942012977931839
Energy: 0.7850450025505081
Energy: 0.8942012977982704
Energy: 0.8231767014893575
Energy: 0.8942012977977618
Energy: 0.908944097296487
Energy: 0.9068604047426341
Energy: 0.8632187096973631
Energy: 0.9068604047512809
Energy: 0.9089440972954697
Energy: 0.9068604047517898
Energy: 0.8192166649307233
Energy: 0.9158987878080352
Energy: 0.819352264289761
Energy: 0.9158987878075265
Energy: 0.8192166649261455
Energy: 0.9158987878060006
Energy: 0.7853351766064466
Energy: 0.7835579694386793
Energy: 0.7853351766054293
Energy: 0.7835579694381707
Energy: 0.7853351766044122
Energy: 0.7835579694386793
Energy: 0.9322064893463281
Energy: 0.772094468307606
Energy: 0.93210569251127
Energy: 0.7720944683157442
Energy: 0.9322064893448023
Energy: 0.7720944683157442
Energy: 0.8036842456880929
Energy: 0.8808042857991588
Energy: 0.8038528300810682
Energy: 0.880804285800176
Energy: 0.8036842456947053
Energy: 0.8808042858006846
Energy: 1.0112547086647854
Energy: 0.7665924553929631
Energy: 1.0112547086632593
Energy: 0.766592455388894
Energy: 1.0112547086602075
Energy: 0.7665924553914372
Energy: 0.7958940144104812
Energy: 0.7478394818102997
Energy: 0.7958944252462101
Energy: 0.7478394818006358
Energy: 0.7958940144074294
Energy: 0.7478394818006358
Energy: 0.7790700103296931
Energy: 0.833361110110534
Energy: 0.7790700103347794
Energy: 0.8333611101115516
Energy: 0.7790700103347794
Energy: 0.8333611101110429
Energy: 1.0403856126359363
Energy: 0.8459052465456303
Energy: 1.0403856126410225
Energy: 0.8459052465410525
Energy: 1.0403856126475886
Energy: 0.8459052465405438
Energy: 0.7424130680317002
Energy: 0.7471331520207005
Energy: 0.7424130680281398
Energy: 0.7471331520140883
Energy: 0.7424130680240707
Energy: 0.7471331520135797
Energy: 0.7792669087818238
Energy: 0.75606994540385
Energy: 0.7792669087848756
Energy: 0.7560699454048672
Energy: 0.779266908784367
Energy: 0.7560699454043587
Energy: 0.8151231095838904
Energy: 0.837133433684202
Energy: 0.8151231095843989
Energy: 0.8371334336801329
Energy: 0.8151231095782955
Energy: 0.8371334336816589
Energy: 0.7619449800488016
Energy: 0.7467998843094895
Energy: 0.7619449800508362
Energy: 0.7467998843023687
Energy: 0.7619449800513448
Energy: 0.7467998843013514
Energy: 0.793846124481868
Energy: 0.8499463819688075
Energy: 0.7938461244777989
Energy: 0.8499463819703332
Energy: 0.7938461244747471
Energy: 0.8499463819713505
Energy: 0.8058983323554099
Energy: 0.8308539888667502
Energy: 0.8058983323584618
Energy: 0.8308539888626812
Energy: 0.8058983323559187
Energy: 0.8308539888581034
Energy: 0.8141430589809975
Energy: 0.7750540271010762
Energy: 0.8141430589825235
Energy: 0.7750540271122661
Energy: 0.814143058982015
Energy: 0.7750540271122661
Energy: 0.7591411882804383
Energy: 0.8632337922953333
Energy: 0.7591411882789123
Energy: 0.8632337922866864
Energy: 0.7591411882819642
Energy: 0.8632337922861778
Energy: 0.8215763030645702
Energy: 0.856037550529601
Energy: 0.8215763030544436
Energy: 0.8560375505326527
Energy: 0.8215763030635528
Energy: 0.8560375505331614
Energy: 0.8786327373678506
Energy: 0.8047350721444608
Energy: 0.8786327373678506
Energy: 0.8047350721449695
Energy: 0.8786327373683591
Energy: 0.80473507214853
Energy: 0.8316004198421902
Energy: 0.8949495602737839
Energy: 0.792231854530214
Energy: 0.8949495602692062
Energy: 0.8316004198401556
Energy: 0.8949495602692062
Energy: 0.8579317459467691
Energy: 0.877156409193103
Energy: 0.8205511198362323
Energy: 0.8771564091961548
Energy: 0.8579317459518555
Energy: 0.8771564091946289
Energy: 0.866315113246979
Energy: 0.8338202867461814
Energy: 0.7871254331429496
Energy: 0.8338202867451643
Energy: 0.8663151132408753
Energy: 0.8338202867451643
Energy: 0.7601576745079454
Energy: 0.7800482229536811
Energy: 0.7596734694039257
Energy: 0.780048222952664
Energy: 0.7601576745150662
Energy: 0.7800482229521551
Energy: 0.7851497948311199
Energy: 0.7904478318952319
Energy: 0.7851915782013738
Energy: 0.7904478319038787
Energy: 0.7851497948326458
Energy: 0.7904478319028614
Energy: 0.8917022927164187
Energy: 0.8070666923765105
Energy: 0.891702292711841
Energy: 0.8070666923749845
Energy: 0.8917022927154015
Energy: 0.8070666923765105
Energy: 0.7468433992823402
Energy: 0.7550875872525481
Energy: 0.7467656299897603
Energy: 0.7550875872449185
Energy: 0.7468433992833576
Energy: 0.7550875872454272
Energy: 0.7509367460460384
Energy: 0.8761255510798654
Energy: 0.7509367460429867
Energy: 0.8761255510742706
Energy: 0.7509367460495989
Energy: 0.876125551073762
Energy: 0.8263992043045153
Energy: 0.7641953223261109
Energy: 0.8263992043111277
Energy: 0.7641953223276368
Energy: 0.8263992043096018
Energy: 0.7641953223271282
Energy: 0.7140587533958505
Energy: 0.7538603349118688
Energy: 0.7140587533989022
Energy: 0.7538603348940666
Energy: 0.7140587533973765
Energy: 0.753860334914412
Energy: 0.751381740643036
Energy: 0.7714489080696597
Energy: 0.7513817406445618
Energy: 0.7714489080696597
Energy: 0.7513817406476136
Energy: 0.7714489080696597
Energy: 0.7608072685121444
Energy: 0.7428084485135407
Energy: 0.7608072685096012
Energy: 0.742808448513032
Energy: 0.7608072685075667
Energy: 0.7428084485150666
Energy: 0.8744700685436955
Energy: 0.9371301464224284
Energy: 0.8744700685472557
Energy: 0.937130146415816
Energy: 0.8744700685452212
Energy: 0.937130146414799
Energy: 0.7534358968288537
Energy: 0.7299691504938437
Energy: 0.7534358968288537
Energy: 0.7299691505004561
Energy: 0.7534358968278364
Energy: 0.7299691505009647
Energy: 0.6934188880941611
Energy: 0.7432362499846374
Energy: 0.6934188880926351
Energy: 0.7432362499912497
Energy: 0.6934188880890746
Energy: 0.7432362499917583

minimum gb energy = 0.6934188880890746 eV
minimum distance =  2.27661838768575 Angstroms
sigma value = 81


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

Energy: 0.05412284803861295
Energy: 0.10646542357848929
Energy: 0.05412284803861295
Energy: 0.10646542357662042
Energy: 0.05412284803861295
Energy: 0.10646542358035814
Energy: 0.8084544778774183
Energy: 0.21511219997787942
Energy: 0.8084544778774183
Energy: 0.21511219997787942
Energy: 0.8084544778755494
Energy: 0.21511219997601058
Energy: 0.8084557408447618
Energy: 0.21510918679965457
Energy: 0.8084557408391977
Energy: 0.21510918679965457
Energy: 0.8084557408410666
Energy: 0.21510918680152344
Energy: 0.05412284803861295
Energy: 0.10646542357475158
Energy: 0.05412284803861295
Energy: 0.10646542357662042
Energy: 0.05412284803861295
Energy: 0.10646542357662042
Energy: 0.8084544778755494
Energy: 0.21511219999283024
Energy: 0.8084544778736805
Energy: 0.21511219998348596
Energy: 0.8084544778736805
Energy: 0.21511219998348596
Energy: 0.8084557408559748
Energy: 0.21510918682208077
Energy: 0.8084557408429355
Energy: 0.21510918682394964
Energy: 0.8084557408410666
Energy: 0.21510918682394964
Energy: 0.05412284803861295
Energy: 0.10646542357662042
Energy: 0.05412284803861295
Energy: 0.10646542357475158
Energy: 0.05412284803861295
Energy: 0.10646542357475158
Energy: 0.8084544778755494
Energy: 0.21511219999283024
Energy: 0.8084544778736805
Energy: 0.21511219998161715
Energy: 0.8084544778755494
Energy: 0.21511219998722372
Energy: 0.8084557408522374
Energy: 0.2151091867903103
Energy: 0.8084557408410666
Energy: 0.2151091867903103
Energy: 0.8084557408410666
Energy: 0.21510918679217916
Energy: 0.05412284803861295
Energy: 0.10646542357475158
Energy: 0.05412284803861295
Energy: 0.10646542357662042
Energy: 0.05412284803861295
Energy: 0.10646542357662042

minimum gb energy = 0.05412284803861295 eV
minimum distance =  2.45406661095311 Angstroms
sigma value = 3


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

Energy: 0.9417867897378781
Energy: 0.7949155623648121
Energy: 0.8830693620625207
Energy: 0.794915562377675
Energy: 0.9417867897362002
Energy: 0.7949155623771158
Energy: 0.8098660861914357
Energy: 0.8045329749961395
Energy: 0.8098660861914357
Energy: 0.8045329749944617
Energy: 0.8098660861819282
Energy: 0.8045329749950211
Energy: 0.7799689595599043
Energy: 0.8106890028439451
Energy: 0.8071382077484615
Energy: 0.8106890028456226
Energy: 0.807138207747343
Energy: 0.810689002846182
Energy: 0.826091976084113
Energy: 0.8092729623303481
Energy: 0.82609197608635
Energy: 0.8092729623337037
Energy: 0.8260919760874685
Energy: 0.8092729623325852
Energy: 0.6955409077413927
Energy: 0.7539779564304214
Energy: 0.6955409077391556
Energy: 0.7539779564320992
Energy: 0.695540907733563
Energy: 0.7539779564332177
Energy: 0.7615253430413914
Energy: 0.8238772046500122
Energy: 0.7615253430413914
Energy: 0.823877204653368
Energy: 0.7615253430441876
Energy: 0.8238772046539272
Energy: 0.8120040091254241
Energy: 0.7449819925172539
Energy: 0.8120040091237464
Energy: 0.7449819925083059
Energy: 0.8120040091198316
Energy: 0.7449819925055096
Energy: 0.6818217351178434
Energy: 0.7560831868693313
Energy: 0.6818217351206395
Energy: 0.7560831868670942
Energy: 0.6818217351206395
Energy: 0.7560831868670942
Energy: 0.7709776787790691
Energy: 0.8241652690471107
Energy: 0.7709776787829838
Energy: 0.8241652690476701
Energy: 0.7709776787874579
Energy: 0.8241652690476701
Energy: 0.7663532184637474
Energy: 0.6833275348121641
Energy: 0.7663532184609512
Energy: 0.6833275348088087
Energy: 0.7663532184637474
Energy: 0.6833275348071308
Energy: 0.742411666182269
Energy: 0.7560101769155988
Energy: 0.7424116661833875
Energy: 0.7560101769144805
Energy: 0.7424116661939626
Energy: 0.7560101769155988
Energy: 0.7921030211686324
Energy: 0.840798335060988
Energy: 0.792103021169751
Energy: 0.8407983350660213
Energy: 0.7921030211669546
Energy: 0.8407983350671399
Energy: 0.7843392923339557
Energy: 0.6755135012680669
Energy: 0.7843392923361927
Energy: 0.6755135012591188
Energy: 0.7843392923423445
Energy: 0.675513501259678
Energy: 0.7832145771631599
Energy: 0.8288271958484702
Energy: 0.783214577159245
Energy: 0.8288271958490295
Energy: 0.783214577157008
Energy: 0.8288271958495887
Energy: 0.8141844975764719
Energy: 0.8697641178404226
Energy: 0.8141830806215063
Energy: 0.8697641178393043
Energy: 0.8141844975714386
Energy: 0.8697641178393043
Energy: 0.7836748608115596
Energy: 0.6798967429441852
Energy: 0.7836748608115596
Energy: 0.6798967429430666
Energy: 0.7836748608149151
Energy: 0.6798967429425073
Energy: 0.8368151349502833
Energy: 0.787672964112038
Energy: 0.8368151349497239
Energy: 0.7876729641232232
Energy: 0.8368151349525204
Energy: 0.7876729641226641
Energy: 0.8085941378673039
Energy: 0.8474738386846925
Energy: 0.8084808356808
Energy: 0.8474738386791
Energy: 0.808594137858356
Energy: 0.8474738386796593
Energy: 0.8352960325197497
Energy: 0.7133412169223932
Energy: 0.8352723476836207
Energy: 0.7133412169207155
Energy: 0.8352960325259017
Energy: 0.7133412169235118
Energy: 0.8717372181022228
Energy: 0.8420383431279069
Energy: 0.7397284859778274
Energy: 0.8420383431239922
Energy: 0.8717372181039006
Energy: 0.842038343123433
Energy: 0.8502371934958832
Energy: 0.8188961931552283
Energy: 0.797431257220775
Energy: 0.8188961931563465
Energy: 0.8502371934958832
Energy: 0.8188961931563465
Energy: 0.8454060706768887
Energy: 0.7948499088429779
Energy: 0.7987358102548926
Energy: 0.7948499088329112
Energy: 0.8454060706813628
Energy: 0.7948499088323518
Energy: 0.8244540503517577
Energy: 0.8447858726719985
Energy: 0.8244540503545539
Energy: 0.8447858726803873
Energy: 0.8244540503551132
Energy: 0.844785872679828
Energy: 0.8183160944557137
Energy: 0.7134907674832573
Energy: 0.8183160944568324
Energy: 0.7134907674754277
Energy: 0.8183160944601878
Energy: 0.7134907674754277
Energy: 0.8334651196883157
Energy: 0.7666579998681688
Energy: 0.8334651196855194
Energy: 0.7666579998670503
Energy: 0.8334651196816046
Energy: 0.7666579998659317
Energy: 0.7779809210149858
Energy: 0.8419048772727267
Energy: 0.7779809210161044
Energy: 0.8419048772766414
Energy: 0.7779809210161044
Energy: 0.84190487727776
Energy: 0.8823542913521818
Energy: 0.7012017800350242
Energy: 0.8823542913538597
Energy: 0.7012017800333463
Energy: 0.8823542913521818
Energy: 0.7012017800339057
Energy: 0.8158411982962791
Energy: 0.7733253529758152
Energy: 0.815841198291805
Energy: 0.7733253529769336
Energy: 0.8158411982934829
Energy: 0.7733253529763744
Energy: 0.7363829953115587
Energy: 0.787256991123133
Energy: 0.7363829953154736
Energy: 0.7872569911287256
Energy: 0.7363829953171513
Energy: 0.787256991127607
Energy: 0.858412457769366
Energy: 0.7548135274720098
Energy: 0.8584124577704844
Energy: 0.7548135274708913
Energy: 0.8584124577688068
Energy: 0.7548135274742469
Energy: 0.8309155797461845
Energy: 0.7679371494970111
Energy: 0.830915579751218
Energy: 0.7679371494937064
Energy: 0.8309155797467438
Energy: 0.7679371494937064
Energy: 0.6791326188345772
Energy: 0.7728924576291185
Energy: 0.6791326188401698
Energy: 0.7728924576257631
Energy: 0.6791326188401698
Energy: 0.7728924576257631
Energy: 0.8106157215269062
Energy: 0.8571965270599375
Energy: 0.8106176244353668
Energy: 0.8571965270577006
Energy: 0.81061572153077
Energy: 0.857196527056582

minimum gb energy = 0.6755135012591188 eV
minimum distance =  2.25627308648055 Angstroms
sigma value = 67


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

Energy: 1.0336278355531696
Energy: 0.9265551240970258
Energy: 1.033627835556357
Energy: 0.9265551240898539
Energy: 1.0336278355555601
Energy: 0.9265551240962288
Energy: 0.8262034740795916
Energy: 0.9294027961056558
Energy: 0.8262034740772009
Energy: 0.9294027961040621
Energy: 0.826203474076404
Energy: 0.9294027961048589
Energy: 0.9302872542858723
Energy: 0.9637835394729994
Energy: 0.9302872542922475
Energy: 0.9637835394737965
Energy: 0.9542509704461971
Energy: 0.9637835394729994
Energy: 0.9788805248522957
Energy: 0.8866403158242936
Energy: 0.9788805248491083
Energy: 0.8866403158258874
Energy: 0.9788805248538895
Energy: 0.8866403158322623
Energy: 0.7903674313050236
Energy: 0.8811173395948424
Energy: 0.7903674313074143
Energy: 0.8811173395940456
Energy: 0.7903674313042267
Energy: 0.8811173395948424
Energy: 0.9458916897162579
Energy: 0.9462915681463071
Energy: 0.9458916897170546
Energy: 0.9462915681463071
Energy: 0.945891689715461
Energy: 0.9462915681447134
Energy: 0.8932976674367763
Energy: 0.8667733186615232
Energy: 0.8932976674383702
Energy: 0.8667733186599296
Energy: 0.8932976674367763
Energy: 0.8667733186615232
Energy: 0.87791888131821
Energy: 0.8811204290059746
Energy: 0.8779188813142256
Energy: 0.8811204290051778
Energy: 0.87791888131821
Energy: 0.8811204290043808
Energy: 0.9788995067532729
Energy: 0.999635063576273
Energy: 0.9788995067540697
Energy: 0.999635063576273
Energy: 0.9788995067540697
Energy: 0.999635063576273
Energy: 0.933643139746216
Energy: 0.8113031888516086
Energy: 0.9336431397486067
Energy: 0.8113031888516086
Energy: 0.9336431397478099
Energy: 0.8113031888500147
Energy: 0.9085789635976574
Energy: 0.9516796034591725
Energy: 0.9085789635928763
Energy: 0.9516796034591725
Energy: 0.9085789635960637
Energy: 0.9516796034583754
Energy: 0.8954748479279488
Energy: 0.9450766250754085
Energy: 0.8954748479271518
Energy: 0.9450766250746117
Energy: 0.8954748479271518
Energy: 0.9450766250746117
Energy: 0.9314106393343569
Energy: 0.8019441941968879
Energy: 0.9314106393359506
Energy: 0.8019441941968879
Energy: 0.9314106393367473
Energy: 0.801944194196091
Energy: 0.8943091716231362
Energy: 0.9631422024417966
Energy: 0.8943091716247299
Energy: 0.9631422024425936
Energy: 0.8943091716247299
Energy: 0.9631422024402029
Energy: 0.9158122253084515
Energy: 0.904422275133078
Energy: 0.9158122253068579
Energy: 0.904422275132281
Energy: 0.9158122253092486
Energy: 0.904422275132281
Energy: 0.9749537682974184
Energy: 0.9266609553182864
Energy: 0.9749537683006059
Energy: 0.9266609553182864
Energy: 0.974953768299809
Energy: 0.9266609553190832
Energy: 0.925361718223682
Energy: 0.968797279020544
Energy: 0.9253617182212914
Energy: 0.9687972790213409
Energy: 0.9253617182204945
Energy: 0.9687972790197471
Energy: 0.9415491945929622
Energy: 0.8884377946483331
Energy: 0.9415491945921654
Energy: 0.88843779464913
Energy: 0.941549194594556
Energy: 0.8884377946483331
Energy: 0.9372063113312821
Energy: 0.9615594335885163
Energy: 0.9372063113272976
Energy: 0.9615594335885163
Energy: 0.9372063113304853
Energy: 0.9615594335877194
Energy: 0.8027002309783634
Energy: 0.9640412823250749
Energy: 0.8027002309767696
Energy: 0.9640412823258718
Energy: 0.8027002309783634
Energy: 0.9640412823258718
Energy: 0.9108885404139169
Energy: 0.879180996833425
Energy: 0.910888540412323
Energy: 0.879180996833425
Energy: 0.910888540412323
Energy: 0.8791809968326281
Energy: 0.8285532558947708
Energy: 1.0059276020776704
Energy: 0.828553255893177
Energy: 1.0059276020776704
Energy: 0.8285532558947708
Energy: 1.0059276020760766
Energy: 0.7884034046980655
Energy: 0.9652693684932079
Energy: 0.7884034046964717
Energy: 0.9652693684940049
Energy: 0.7884034046980655
Energy: 0.9652693684932079

minimum gb energy = 0.7884034046964717 eV
minimum distance =  2.29672967167124 Angstroms
sigma value = 33


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

Energy: 1.201356351396719
Energy: 1.0377980567036504
Energy: 1.1509934969925435
Energy: 1.0377980567016283
Energy: 1.2013563514007632
Energy: 1.0377980567016283
Energy: 0.9610531909988007
Energy: 1.074384221018631
Energy: 0.9610531910053727
Energy: 1.0743842210085204
Energy: 0.9610531910109334
Energy: 1.0743842210181254
Energy: 1.0076322875173693
Energy: 1.100748621252615
Energy: 1.0076322875138308
Energy: 1.1007486212500874
Energy: 1.007632287513325
Energy: 1.1007486212500874
Energy: 0.9562829169653856
Energy: 1.0137412029552235
Energy: 0.9562829169623526
Energy: 1.0137412029562345
Energy: 0.9562829169598248
Energy: 1.0137412029567399
Energy: 0.9492315048199339
Energy: 1.0309376291442107
Energy: 0.949231504818923
Energy: 1.0309376291522994
Energy: 0.9492315048234727
Energy: 1.0309376291522994
Energy: 1.0810184821337876
Energy: 1.076002627085387
Energy: 1.0810184821297433
Energy: 1.0760026270869034
Energy: 1.0810184821231714
Energy: 1.076002627094992
Energy: 0.910073755132012
Energy: 0.9491112111643135
Energy: 0.9100737551310012
Energy: 0.9491112111739184
Energy: 0.9100737551224072
Energy: 0.9491112111734129
Energy: 1.0247960764006445
Energy: 0.9153935167503982
Energy: 1.0247960764016553
Energy: 0.9153935167453429
Energy: 1.0247960764062052
Energy: 0.9153935167468594
Energy: 1.0910293982600079
Energy: 0.9943267865733116
Energy: 1.0910267145035457
Energy: 0.9943267865763447
Energy: 1.0910293982605135
Energy: 0.9943267865763447
Energy: 1.1302467643594911
Energy: 0.9529921444346958
Energy: 1.1302467643554468
Energy: 0.981454168658608
Energy: 1.1302467643493808
Energy: 0.9814541686596191
Energy: 1.1858932895745578
Energy: 1.1049254052335586
Energy: 1.1858929328959487
Energy: 1.1049254052320419
Energy: 1.1858932895715246
Energy: 1.1049254052315363
Energy: 0.9097665271026842
Energy: 0.9608746322547279
Energy: 0.9097665271016733
Energy: 0.9608746322516948
Energy: 0.9097665270940904
Energy: 0.9608746322516948
Energy: 1.1317438843176268
Energy: 1.0566071260121324
Energy: 1.1317438843090328
Energy: 1.0566071260126382
Energy: 1.1317438843070107
Energy: 1.0566071260126382
Energy: 0.9744520609129046
Energy: 1.10444910503553
Energy: 0.9744520609159378
Energy: 1.1044491050279472
Energy: 0.9744520609154323
Energy: 1.1044491050279472
Energy: 1.01593384855333
Energy: 1.054921641205569
Energy: 1.0159338485578797
Energy: 1.054921641201571
Energy: 1.0159338485538354
Energy: 1.0549216412005595
Energy: 0.9474026598369455
Energy: 1.0696784884408237
Energy: 0.9474026598374511
Energy: 1.0696784884307133
Energy: 0.9474026598374511
Energy: 1.0696784884312187
Energy: 0.9272259919505171
Energy: 1.0594841510031403
Energy: 0.9272259919469785
Energy: 1.0594841510056678
Energy: 0.9272259919505171
Energy: 1.0594841510056678
Energy: 1.0387987787494655
Energy: 1.169866063533372
Energy: 1.0387987787535093
Energy: 1.169866063533372
Energy: 1.038798778753004
Energy: 1.169866063533372
Energy: 0.9230612689232555
Energy: 1.0963026675454803
Energy: 0.9230612689252775
Energy: 1.0963026675434584
Energy: 0.9230612689297812
Energy: 1.096302667543964
Energy: 1.049961880101866
Energy: 1.0609654274903597
Energy: 1.04996188010591
Energy: 1.0609654274918763
Energy: 1.0499618801048993
Energy: 1.0609654274933928
Energy: 0.9449438331682202
Energy: 1.1622852548040423
Energy: 0.9460365813266923
Energy: 1.1622852547989873
Energy: 0.9449438331818694
Energy: 1.1622852547989873
Energy: 0.9817174943440174
Energy: 0.9043277774675971
Energy: 0.9817174943450285
Energy: 0.9043277774756854
Energy: 0.9817174943470506
Energy: 0.9043277774756854
Energy: 1.1037485444014725
Energy: 1.1047850859323798
Energy: 1.0120505336475003
Energy: 1.1047850859424904
Energy: 1.103748544410066
Energy: 1.1047850859429957
Energy: 1.1772784513158383
Energy: 0.9761651881193418
Energy: 1.1288863134843177
Energy: 0.9761651881158031
Energy: 1.1772784513259487
Energy: 0.9761651881158031
Energy: 0.9453549659339388
Energy: 0.9604067208210453
Energy: 0.9087429964579875
Energy: 0.9604067208190232
Energy: 0.9453549659364663
Energy: 0.9604067208195287
Energy: 1.0672416094972217
Energy: 1.1254665555027918
Energy: 1.0672416094982324
Energy: 1.125466555501275
Energy: 1.0672416094951995
Energy: 1.1254665555007695
Energy: 0.9083019108192286
Energy: 0.9063472964204038
Energy: 0.90830191081569
Energy: 0.906347296421415
Energy: 0.908301910814679
Energy: 0.906347296421415
Energy: 0.9467657031090531
Energy: 1.1441564900821848
Energy: 0.9467657031125919
Energy: 1.1441564900801628
Energy: 0.9467657031120864
Energy: 1.1441564900801628
Energy: 0.9877854966362298
Energy: 1.0473556662986012
Energy: 0.9877854966382518
Energy: 1.0473556662935462
Energy: 0.9877854966412851
Energy: 1.0473556662935462
Energy: 0.9221154265675915
Energy: 1.0036644279485074
Energy: 0.922115426568097
Energy: 1.0036644279419356
Energy: 0.9221154265696135
Energy: 1.0036644279409246
Energy: 1.1788280209447037
Energy: 1.1242139961547373
Energy: 1.1788280209472315
Energy: 1.1242139961532207
Energy: 1.1788280209492534
Energy: 1.1242139961537263
Energy: 0.9469633675488954
Energy: 1.060838521952494
Energy: 0.9469885858197357
Energy: 1.0608385219469332
Energy: 0.9469633675448513
Energy: 1.0608385219469332
Energy: 0.9561739678067583
Energy: 1.1353246589835753
Energy: 0.9561704304061546
Energy: 1.13532465897852
Energy: 0.9561739678092861
Energy: 1.1353246589764978
Energy: 1.0378399835469707
Energy: 1.0772865809770378
Energy: 1.037839983544443
Energy: 1.0772865809795196
Energy: 1.0378399835368601
Energy: 1.077286580979014
Energy: 0.9550547630337641
Energy: 1.101455744819307
Energy: 0.9550547630292603
Energy: 1.1014557448177902
Energy: 0.9550547630267326
Energy: 1.1014557448177902
Energy: 1.127155648846044
Energy: 1.0416397710124323
Energy: 1.1271556488531214
Energy: 1.0416397710023217
Energy: 1.127155648848066
Energy: 1.0416397710028273
Energy: 0.9504188015644576
Energy: 1.0803130025015886
Energy: 0.9504188015669851
Energy: 1.080313002502094
Energy: 0.9504188015614244
Energy: 1.080313002502094

minimum gb energy = 0.9043277774675971 eV
minimum distance =  2.20363686700547 Angstroms
sigma value = 41


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

Energy: 1.4015248152457518
Energy: 1.2736784483234875
Energy: 1.2811606812013865
Energy: 1.2736784483248678
Energy: 1.4015248152429916
Energy: 1.2736784483248678
Energy: 1.094337290635685
Energy: 1.3214706534820955
Energy: 1.094337290634305
Energy: 1.321470653479335
Energy: 1.0943372906329245
Energy: 1.3214706534779548
Energy: 1.3619200404448704
Energy: 1.3074902548392646
Energy: 1.3619200404503287
Energy: 1.3074902548392646
Energy: 1.3619200404558496
Energy: 1.3074902548392646
Energy: 1.2704402239150518
Energy: 1.1951297149834177
Energy: 1.270440223910911
Energy: 1.1951297149820372
Energy: 1.270440223910911
Energy: 1.1951297149834177
Energy: 1.2336858528328098
Energy: 1.1705649545863706
Energy: 1.2336858528410914
Energy: 1.17056495458361
Energy: 1.2336858528397112
Energy: 1.1705649545849905
Energy: 1.321991905351512
Energy: 1.249724884077339
Energy: 1.3219919053473708
Energy: 1.2497248840800994
Energy: 1.3219919053487514
Energy: 1.249724884077339
Energy: 1.2657471541371832
Energy: 1.2097223067249894
Energy: 1.2657471541344225
Energy: 1.2097223067263698
Energy: 1.2657471541330423
Energy: 1.209722306720849
Energy: 1.4087015613102525
Energy: 1.312537854177174
Energy: 1.4087015613088723
Energy: 1.3125378541744137
Energy: 1.4087015613088723
Energy: 1.3125378541744137
Energy: 1.0910953914173895
Energy: 1.148332917482447
Energy: 1.0014605347335688
Energy: 1.148332917482447
Energy: 1.0910953914187698
Energy: 1.1483329174838273
Energy: 1.3879091579678902
Energy: 1.2792476900473186
Energy: 1.2690101710396522
Energy: 1.2792476900445582
Energy: 1.3879091579692706
Energy: 1.2792476900404173
Energy: 1.09370887870128
Energy: 1.3079340847638177
Energy: 1.09370887870266
Energy: 1.3079340847638177
Energy: 1.09370887870128
Energy: 1.3079340847638177
Energy: 1.2265045357462725
Energy: 1.2275827698853627
Energy: 1.2265045357462725
Energy: 1.227582769886743
Energy: 1.226504535750413
Energy: 1.2275827698881232
Energy: 1.1086727764802378
Energy: 1.1954174346840212
Energy: 1.1086727764829984
Energy: 1.1954174346688387
Energy: 1.1086727764829984
Energy: 1.1954174346674582
Energy: 1.2345321391418218
Energy: 1.209686745227779
Energy: 1.2345321391459625
Energy: 1.2096867452305398
Energy: 1.2345321391418218
Energy: 1.2096867452305398

minimum gb energy = 1.0014605347335688 eV
minimum distance =  2.24647055166467 Angstroms
sigma value = 11


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

Energy: 1.4538625172648056
Energy: 1.2767712192313798
Energy: 1.4538625172654118
Energy: 1.2767712192325926
Energy: 1.4538625172641992
Energy: 1.2767712192313798
Energy: 1.2268398376494498
Energy: 1.3278421036579977
Energy: 1.2268398376488439
Energy: 1.3278421036579977
Energy: 1.2268398376488439
Energy: 1.3278421036579977
Energy: 1.3809776142188106
Energy: 1.3325619134460647
Energy: 1.3809776142200234
Energy: 1.3325619134460647
Energy: 1.3538855389721196
Energy: 1.3325619134460647
Energy: 1.362705311180628
Energy: 1.2169900479284692
Energy: 1.3627053111818404
Energy: 1.2169900479284692
Energy: 1.3627053111812342
Energy: 1.2169900479284692
Energy: 1.3442992636385342
Energy: 1.2908575993125846
Energy: 1.3442992636391404
Energy: 1.2908575993125846
Energy: 1.3442992636391404
Energy: 1.2908575993125846
Energy: 1.302142579365474
Energy: 1.3590706959465906
Energy: 1.302142579365474
Energy: 1.359070695947197
Energy: 1.302142579363655
Energy: 1.3590706959465906
Energy: 1.3574347138934462
Energy: 1.279232426893228
Energy: 1.3574347138928402
Energy: 1.2792324268938344
Energy: 1.3574347138928402
Energy: 1.2792324268938344
Energy: 1.3056345220129995
Energy: 1.3303436474430406
Energy: 1.3056345220129995
Energy: 1.3303436474430406
Energy: 1.3056345220129995
Energy: 1.3303436474430406
Energy: 1.3395342457726098
Energy: 1.3180300683064121
Energy: 1.3395342457720034
Energy: 1.3180300683064121
Energy: 1.3395342457720034
Energy: 1.3180300683064121
Energy: 1.3030508274391217
Energy: 1.312742367037205
Energy: 1.3030508274385153
Energy: 1.312742367037205
Energy: 1.3030508274391217
Energy: 1.3127423670359921
Energy: 1.2876958478740372
Energy: 1.3413596637195215
Energy: 1.2876958478734308
Energy: 1.341359663720734
Energy: 1.2876958478752498
Energy: 1.3413596637195215
Energy: 1.3236770903833208
Energy: 1.342091091149008
Energy: 1.323677090383927
Energy: 1.342091091150827
Energy: 1.3236770903833208
Energy: 1.342091091149008
Energy: 1.3629746050491995
Energy: 1.2585841019446087
Energy: 1.3629746050491995
Energy: 1.258584101945215
Energy: 1.3629746050491995
Energy: 1.2585841019446087
Energy: 1.3240879043681728
Energy: 1.3302749028990921
Energy: 1.3240879043693854
Energy: 1.3302749028990921
Energy: 1.3240879043699918
Energy: 1.3302749028984857
Energy: 1.272696375176006
Energy: 1.3125816395321261
Energy: 1.2726963751753997
Energy: 1.3125816395321261
Energy: 1.272696375176006
Energy: 1.3125816395327328
Energy: 1.35815361329475
Energy: 1.27805953244082
Energy: 1.3581536132953567
Energy: 1.2780595324426391
Energy: 1.35815361329475
Energy: 1.2780595324402138
Energy: 1.2432898212124888
Energy: 1.3281930334763874
Energy: 1.2432898212124888
Energy: 1.3281930334769936
Energy: 1.243289821211276
Energy: 1.3281930334769936
Energy: 1.3452095010104173
Energy: 1.36744628346219
Energy: 1.345209501009811
Energy: 1.367446283461584
Energy: 1.345209501009811
Energy: 1.36744628346219
Energy: 1.301642603553993
Energy: 1.2138674283372621
Energy: 1.3016426035527802
Energy: 1.2138674283372621
Energy: 1.3016426035533863
Energy: 1.2138674283372621
Energy: 1.2994035472185061
Energy: 1.3294834691576853
Energy: 1.2994035472197187
Energy: 1.329483469158898
Energy: 1.2994035472191126
Energy: 1.3294834691576853
Energy: 1.2512929724013957
Energy: 1.2728944427712439
Energy: 1.251292972400183
Energy: 1.27289444277185
Energy: 1.251292972400183
Energy: 1.2728944427724564
Energy: 1.3785668742945556
Energy: 1.4036823021496883
Energy: 1.3785668742927366
Energy: 1.4036823021496883
Energy: 1.3785668742921302
Energy: 1.4036823021484757
Energy: 1.2790405354713423
Energy: 1.3327519637951726
Energy: 1.2790405354695233
Energy: 1.3327519637963852
Energy: 1.2790405354713423
Energy: 1.3327519637957788
Energy: 1.3354350225476959
Energy: 1.3497379888104917
Energy: 1.3354350225483023
Energy: 1.3497379888104917
Energy: 1.3354350225470895
Energy: 1.3497379888104917
Energy: 1.3114084788687055
Energy: 1.3074369817557625
Energy: 1.3114084788693114
Energy: 1.3074369817557625
Energy: 1.311408478868099
Energy: 1.3074369817551563
Energy: 1.2526456644411934
Energy: 1.3287324092564814
Energy: 1.2526456644417998
Energy: 1.3287324092570876
Energy: 1.2526456644417998
Energy: 1.3287324092570876
Energy: 1.2890226247060441
Energy: 1.3827198151464222
Energy: 1.2890226247060441
Energy: 1.3827198151458158
Energy: 1.2890226247060441
Energy: 1.3827198151470286
Energy: 1.3615824514851278
Energy: 1.2727924214941622
Energy: 1.3615824514851278
Energy: 1.2727924214947686
Energy: 1.3615824514851278
Energy: 1.2727924214941622
Energy: 1.3249654479643542
Energy: 1.3300844369255935
Energy: 1.3249654479643542
Energy: 1.3300844369262
Energy: 1.3249654479643542
Energy: 1.3300844369255935
Energy: 1.2849259280171268
Energy: 1.2152724015412955
Energy: 1.2849259280171268
Energy: 1.2152724015412955
Energy: 1.2849259280171268
Energy: 1.2152724015412955
Energy: 1.301571485399237
Energy: 1.4045028163516298
Energy: 1.3015714853986307
Energy: 1.404502816352236
Energy: 1.3015714853998435
Energy: 1.4045028163516298

minimum gb energy = 1.2138674283372621 eV
minimum distance =  2.18203530494905 Angstroms
sigma value = 57


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

Energy: 1.3489733487317248
Energy: 1.25913493696086
Energy: 1.214118719047092
Energy: 1.259134936969492
Energy: 1.3489733487306457
Energy: 1.259134936969492
Energy: 1.4089666277395192
Energy: 1.1635044318297394
Energy: 1.4089666277405983
Energy: 1.1635044318308183
Energy: 1.4089666277395192
Energy: 1.1635044318308183
Energy: 1.348982739973099
Energy: 1.3443281918641903
Energy: 1.3489827399762866
Energy: 1.3443281918652694
Energy: 1.3489827399773657
Energy: 1.3443281918652694
Energy: 1.2278306099756846
Energy: 1.186410623043544
Energy: 1.2278306099756846
Energy: 1.186410623048939
Energy: 1.2278306099789216
Energy: 1.186410623045702
Energy: 1.4409112743610586
Energy: 1.3440236825748988
Energy: 1.4409112743567427
Energy: 1.344023682570583
Energy: 1.4409112743578216
Energy: 1.344023682570583
Energy: 1.215988963259786
Energy: 1.1639085103333062
Energy: 1.215988963259786
Energy: 1.1639085103300695
Energy: 1.215988963259786
Energy: 1.1639085103300695
Energy: 1.2141187190481706
Energy: 1.2591349369565932
Energy: 1.2141187190481706
Energy: 1.259134936961939
Energy: 1.214118719047092
Energy: 1.259134936961939
Energy: 1.408966627741677
Energy: 1.1635044318308183
Energy: 1.4089666277438353
Energy: 1.1635044318297394
Energy: 1.408966627741677
Energy: 1.1635044318308183
Energy: 1.3489827399795236
Energy: 1.3443281918620322
Energy: 1.3489827399773657
Energy: 1.3443281918587955
Energy: 1.3489827399773657
Energy: 1.3443281918587955
Energy: 1.2278306099778424
Energy: 1.1095836516524877
Energy: 1.2278306099800005
Energy: 1.1095836516535669
Energy: 1.2278306099800005
Energy: 1.1095836516524877
Energy: 1.4409112743599795
Energy: 1.344168439949219
Energy: 1.4409112743589008
Energy: 1.3441684399502982
Energy: 1.4409112743621377
Energy: 1.3441684399502982
Energy: 1.3354327052468096
Energy: 1.1639085103354643
Energy: 1.215988963256549
Energy: 1.1639085103300695
Energy: 1.3354327052500465
Energy: 1.1639085103311484
Energy: 1.3489733487284876
Energy: 1.2591349369587512
Energy: 1.2141187190460128
Energy: 1.2591349369651759
Energy: 1.3489733487252507
Energy: 1.2591349369651759
Energy: 1.4089666277438353
Energy: 1.1635044318254235
Energy: 1.4089666277459931
Energy: 1.1635044318265026
Energy: 1.408966627744914
Energy: 1.1635044318265026
Energy: 1.3489827399762866
Energy: 1.3443281918620322
Energy: 1.3489827399773657
Energy: 1.3443281918620322
Energy: 1.3489827399795236
Energy: 1.3443281918609535
Energy: 1.2278306099767635
Energy: 1.1095836516524877
Energy: 1.2278306099756846
Energy: 1.1095836516514088
Energy: 1.2278306099767635
Energy: 1.10958365165033
Energy: 1.4409112743599795
Energy: 1.344023682570583
Energy: 1.4409112743578216
Energy: 1.3440236825662668
Energy: 1.4409112743589008
Energy: 1.3440236825662668

minimum gb energy = 1.10958365165033 eV
minimum distance =  2.1632977158889 Angstroms
sigma value = 9


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

Energy: 1.4954585814989794
Energy: 1.4298248035370957
Energy: 1.3978423669641171
Energy: 1.4298248035406198
Energy: 1.4954585815077892
Energy: 1.4298248035415007
Energy: 1.3644527424352175
Energy: 1.3295572806211247
Energy: 1.3644527424413846
Energy: 1.3295572806158387
Energy: 1.3644527424405033
Energy: 1.3295572806149576
Energy: 1.3174356350100507
Energy: 1.383661669266523
Energy: 1.3174356350065268
Energy: 1.383661669264761
Energy: 1.317435634995955
Energy: 1.383661669264761
Energy: 1.3289176149216062
Energy: 1.37155813303555
Energy: 1.3289176149216062
Energy: 1.3715581330373117
Energy: 1.3289176149233681
Energy: 1.3715581330373117
Energy: 1.3269211139606452
Energy: 1.4474541094181264
Energy: 1.3269211139615258
Energy: 1.4474541094172453
Energy: 1.3269211139641688
Energy: 1.4474541094172453
Energy: 1.36582415457558
Energy: 1.4080431238031164
Energy: 1.36582415457558
Energy: 1.4080431238066404
Energy: 1.3658241545764607
Energy: 1.4080431238057594
Energy: 1.361910986441219
Energy: 1.3790612059429237
Energy: 1.3619109864447432
Energy: 1.3790612059543765
Energy: 1.361910986448267
Energy: 1.3790612059534957
Energy: 1.3940185943490244
Energy: 1.368529915462137
Energy: 1.3940185943446195
Energy: 1.368529915463018
Energy: 1.3940185943375718
Energy: 1.368529915463018
Energy: 1.396887799361346
Energy: 1.3620604522913557
Energy: 1.396887799363989
Energy: 1.3620604522904747
Energy: 1.396887799365751
Energy: 1.3620604522895936
Energy: 1.3571938851786551
Energy: 1.4304739564335587
Energy: 1.3571927431234854
Energy: 1.4304739564273918
Energy: 1.3571938851795362
Energy: 1.4304739564273918
Energy: 1.280350141050387
Energy: 1.4630336382832874
Energy: 1.2803501410398153
Energy: 1.4630336382744775
Energy: 1.28035014105303
Energy: 1.4630336382771205
Energy: 1.444436194783326
Energy: 1.3964117924927286
Energy: 1.44443619478685
Energy: 1.3964117924839188
Energy: 1.4444361947885718
Energy: 1.3964117924847996
Energy: 1.3317738930845968
Energy: 1.3637842995422567
Energy: 1.33177389307843
Energy: 1.3637842995440188
Energy: 1.331773893074025
Energy: 1.3637842995440188
Energy: 1.3905670640420609
Energy: 1.3150795040719752
Energy: 1.390567064045585
Energy: 1.3150795040754588
Energy: 1.3905670640508707
Energy: 1.315079504074578
Energy: 1.4117047478740001
Energy: 1.3616200543335961
Energy: 1.375799525623844
Energy: 1.3616200543362391
Energy: 1.411704747877524
Energy: 1.3616200543353578
Energy: 1.4889287377249596
Energy: 1.3193737871737856
Energy: 1.3959740463091959
Energy: 1.3193737871684994
Energy: 1.4889287377311264
Energy: 1.3193737871684994
Energy: 1.4874544745117262
Energy: 1.3835319168849585
Energy: 1.39724944733059
Energy: 1.3835319168796727
Energy: 1.4874544745117262
Energy: 1.3835319168805535
Energy: 1.4487869924331975
Energy: 1.3594181946696229
Energy: 1.4487869924323167
Energy: 1.3594181946749089
Energy: 1.4487869924270307
Energy: 1.3594181946757897
Energy: 1.3028603915122787
Energy: 1.4624670498416066
Energy: 1.3028603915061516
Energy: 1.4624670498398447
Energy: 1.3028603915096355
Energy: 1.4624670498424877
Energy: 1.3564684858385596
Energy: 1.3515688941874406
Energy: 1.3564684858333138
Energy: 1.3515688941812736
Energy: 1.3564684858429645
Energy: 1.3515688941812736
Energy: 1.479658552678941
Energy: 1.3934479912262192
Energy: 1.4784873636970262
Energy: 1.3934479912226951
Energy: 1.4796585526798218
Energy: 1.3934479912218143

minimum gb energy = 1.2803501410398153 eV
minimum distance =  2.16712815570227 Angstroms
sigma value = 27


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

Energy: 1.4125772500360692
Energy: 1.2623662348539102
Energy: 1.4125772500375544
Energy: 1.2623662348531677
Energy: 1.4125772500345841
Energy: 1.2623662348539102
Energy: 1.3378147751254197
Energy: 1.3015708554295649
Energy: 1.3378147751268712
Energy: 1.3015708554303076
Energy: 1.3378147751254197
Energy: 1.3015708554310501
Energy: 1.3405331948514623
Energy: 1.3091026487447799
Energy: 1.3405331948499772
Energy: 1.3091026487447799
Energy: 1.3405331948514623
Energy: 1.3091026487447799
Energy: 1.2960966033380668
Energy: 1.2945740030202517
Energy: 1.296096603337324
Energy: 1.294574003019509
Energy: 1.296096603337324
Energy: 1.294574003019509
Energy: 1.3033706913892535
Energy: 1.2434771989531634
Energy: 1.303370691388511
Energy: 1.2434771989516784
Energy: 1.303370691389996
Energy: 1.2434771989524207
Energy: 1.2088011930286524
Energy: 1.2973337422323177
Energy: 1.2088011930293951
Energy: 1.2973337422286046
Energy: 1.2088011930301377
Energy: 1.297333742233803
Energy: 1.3420974496759728
Energy: 1.3132098337848366
Energy: 1.3420974496759728
Energy: 1.3132098337848366
Energy: 1.3420974496752303
Energy: 1.313209833785579
Energy: 1.3434690790662973
Energy: 1.3022680948346703
Energy: 1.3434690790677828
Energy: 1.302268094833928
Energy: 1.3434690790662973
Energy: 1.302268094833928
Energy: 1.2760431947381112
Energy: 1.298155526996075
Energy: 1.2760431947388537
Energy: 1.2981555269953322
Energy: 1.2760431947395963
Energy: 1.2981555269945897
Energy: 1.2965646200851444
Energy: 1.3034325872343562
Energy: 1.2965646200836591
Energy: 1.3034325872350987
Energy: 1.2965646200851444
Energy: 1.3034325872350987
Energy: 1.2963489773607408
Energy: 1.3257576647480216
Energy: 1.2963489773607408
Energy: 1.3257576647487639
Energy: 1.2963489773607408
Energy: 1.3257576647480216
Energy: 1.3126038851522495
Energy: 1.2975514353305118
Energy: 1.312603885150764
Energy: 1.2975514353305118
Energy: 1.3126038851537345
Energy: 1.2975514353305118
Energy: 1.3020565455754136
Energy: 1.2940055096436895
Energy: 1.3020565455754136
Energy: 1.2940055096444325
Energy: 1.3020565455761564
Energy: 1.2940055096444325
Energy: 1.3414290004985805
Energy: 1.2797023112859525
Energy: 1.341429000501551
Energy: 1.2797023112852102
Energy: 1.3414290004985805
Energy: 1.2797023112859525
Energy: 1.208758555246215
Energy: 1.297491916199043
Energy: 1.2087585552469573
Energy: 1.297491916199043
Energy: 1.208758555246215
Energy: 1.2974919161983003
Energy: 1.3033027642508492
Energy: 1.2435072577246056
Energy: 1.3033027642501067
Energy: 1.243507257723863
Energy: 1.3033027642508492
Energy: 1.2435072577231203
Energy: 1.2968486834429969
Energy: 1.339657963498033
Energy: 1.2968486834429969
Energy: 1.339657963498033
Energy: 1.2968486834437394
Energy: 1.3396579634972905
Energy: 1.297218664060038
Energy: 1.3158299051673596
Energy: 1.2972186640607808
Energy: 1.3158299051673596
Energy: 1.297218664060038
Energy: 1.3158299051681026
Energy: 1.269279165025788
Energy: 1.3029888988422773
Energy: 1.2692791650250455
Energy: 1.3029888988415346
Energy: 1.2692791650250455
Energy: 1.3029888988422773
Energy: 1.4125772500353266
Energy: 1.2623662348516824
Energy: 1.4125772500353266
Energy: 1.2623662348516824
Energy: 1.4125772500330989
Energy: 1.2623662348516824
Energy: 1.3378147751268712
Energy: 1.3015708554280796
Energy: 1.3378147751254197
Energy: 1.3015708554280796
Energy: 1.3378147751254197
Energy: 1.3015708554280796
Energy: 1.3405331948492347
Energy: 1.3091026487455224
Energy: 1.3405331948484918
Energy: 1.3091026487447799
Energy: 1.3405331948484918
Energy: 1.3091026487447799
Energy: 1.2960966033306742
Energy: 1.2945740030202517
Energy: 1.296096603331417
Energy: 1.2945740030202517
Energy: 1.2960966033329022
Energy: 1.2945740030209942
Energy: 1.3033706913907388
Energy: 1.243477198956134
Energy: 1.3033706913907388
Energy: 1.243477198956134
Energy: 1.3033706913907388
Energy: 1.2434771989568765
Energy: 1.2088011930227116
Energy: 1.2973337422352544
Energy: 1.2088011930241969
Energy: 1.297333742233803
Energy: 1.2088011930249394
Energy: 1.2973337422330602

minimum gb energy = 1.208758555246215 eV
minimum distance =  2.2183772208936 Angstroms
sigma value = 19


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

Energy: 1.3896084859847597
Energy: 1.493936509909931
Energy: 1.3504240787278916
Energy: 1.4939365099086488
Energy: 1.3896084859892468
Energy: 1.4939365099086488
Energy: 1.377506415661636
Energy: 1.2891318493118065
Energy: 1.3775064156590717
Energy: 1.2891318493066783
Energy: 1.3775064156609949
Energy: 1.2891318493066783
Energy: 1.3187054735182402
Energy: 1.2501460613563857
Energy: 1.3187054735208041
Energy: 1.2501460613640487
Energy: 1.3187054735252912
Energy: 1.2501460613634077
Energy: 1.288645010384142
Energy: 1.4087913867744635
Energy: 1.288598085032981
Energy: 1.4087913867712585
Energy: 1.2886450103886289
Energy: 1.4087913867706172
Energy: 1.2918239068697444
Energy: 1.3584876801015804
Energy: 1.2918239068671804
Energy: 1.3584876801022214
Energy: 1.2918239068710267
Energy: 1.3584876801009393
Energy: 1.4117164330776764
Energy: 1.331468381551908
Energy: 1.4117164330783174
Energy: 1.3314683815525485
Energy: 1.4117164330795995
Energy: 1.3314683815525485
Energy: 1.2512033850143747
Energy: 1.4586141517924334
Energy: 1.2512033850156568
Energy: 1.4586141517917923
Energy: 1.2512033850137336
Energy: 1.4586141517917923
Energy: 1.2907449319022601
Energy: 1.3430138087494348
Energy: 1.2907449318996962
Energy: 1.3430138087552037
Energy: 1.2907449319009783
Energy: 1.3430138087545629
Energy: 1.4331495063619752
Energy: 1.2732501604838118
Energy: 1.4331960598825089
Energy: 1.2732501604870166
Energy: 1.433149506365821
Energy: 1.2732501604870166
Energy: 1.3403317232316938
Energy: 1.320524439563642
Energy: 1.3403317232316938
Energy: 1.320524439564283
Energy: 1.3403317232278478
Energy: 1.320524439563642
Energy: 1.294466930063707
Energy: 1.3632337667649586
Energy: 1.294466930063707
Energy: 1.3632337667617536
Energy: 1.2944669300605023
Energy: 1.3632337667617536
Energy: 1.4019935091635989
Energy: 1.2538546219601396
Energy: 1.401993509165522
Energy: 1.2538546219594988
Energy: 1.4019935091693683
Energy: 1.2538546219588578
Energy: 1.3167507133402347
Energy: 1.2955582062621467
Energy: 1.3166827199123643
Energy: 1.2955582062602529
Energy: 1.31675071333703
Energy: 1.295558206261535
Energy: 1.3142004499368187
Energy: 1.4111426789224375
Energy: 1.3141991993408169
Energy: 1.4111426789179504
Energy: 1.3142004499348956
Energy: 1.4111426789179504
Energy: 1.3523426642960428
Energy: 1.2770943600201328
Energy: 1.3523426642883507
Energy: 1.277094360018851
Energy: 1.3523426642845047
Energy: 1.277094360018851
Energy: 1.3024714005924314
Energy: 1.2713866302521126
Energy: 1.3024714005943545
Energy: 1.2713866302514716
Energy: 1.3024714005917906
Energy: 1.2713866302514716
Energy: 1.2762668401045072
Energy: 1.359774703733151
Energy: 1.2762668401000201
Energy: 1.359774703733151
Energy: 1.2762668400974562
Energy: 1.359774703733792
Energy: 1.3263612932503803
Energy: 1.4019998782572056
Energy: 1.3263612932484572
Energy: 1.4019998782655387
Energy: 1.3263612932510214
Energy: 1.4019998782648977
Energy: 1.409163246677188
Energy: 1.3337745668776335
Energy: 1.408039663118036
Energy: 1.3337745668808387
Energy: 1.409163246679752
Energy: 1.3337745668801977
Energy: 1.276793186290605
Energy: 1.3801950126705806
Energy: 1.2767931862880413
Energy: 1.3801950126654527
Energy: 1.276793186288682
Energy: 1.3801950126654527
Energy: 1.2555285030600554
Energy: 1.3512120176098592
Energy: 1.2555285030587733
Energy: 1.3512120176060132
Energy: 1.2555285030542862
Energy: 1.351212017605372
Energy: 1.3644241775785944
Energy: 1.2543670077299278
Energy: 1.3644241775824404
Energy: 1.2543670077382612
Energy: 1.3644241775830814
Energy: 1.254367007736979
Energy: 1.435596742297807
Energy: 1.3107173296972008
Energy: 1.3565544811796144
Energy: 1.3107173296869445
Energy: 1.4355967422926792
Energy: 1.3107173296869445
Energy: 1.4370806080053156
Energy: 1.3876359258389643
Energy: 1.3463266159268743
Energy: 1.3876359258351183
Energy: 1.4370806080040337
Energy: 1.3876359258344773
Energy: 1.349387007160158
Energy: 1.2540812904994159
Energy: 1.3493870071537475
Energy: 1.254081290505826
Energy: 1.3493870071537475
Energy: 1.254081290505826
Energy: 1.2991516920901438
Energy: 1.3191046661649972
Energy: 1.299151692092679
Energy: 1.319104666165638
Energy: 1.299151692092679
Energy: 1.3191046661649972
Energy: 1.2455274754491872
Energy: 1.398044251168799
Energy: 1.2455274754543153
Energy: 1.398044251172645
Energy: 1.2455274754555972
Energy: 1.3980442511732858
Energy: 1.3231779041621294
Energy: 1.3571226440860245
Energy: 1.3231779041563603
Energy: 1.3571226440841015
Energy: 1.3231779041589244
Energy: 1.3571226440847424
Energy: 1.3384114062593084
Energy: 1.3301090096237138
Energy: 1.3384114062599497
Energy: 1.3301090096249957
Energy: 1.3384114062561034
Energy: 1.3301090096249957

minimum gb energy = 1.2455274754491872 eV
minimum distance =  2.18873722843813 Angstroms
sigma value = 101


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

Energy: 1.34490476440131
Energy: 1.399203056100909
Energy: 1.2650403375587869
Energy: 1.3992030561093098
Energy: 1.3449047644041274
Energy: 1.3992030561087463
Energy: 1.3798455737853348
Energy: 1.2301680436769047
Energy: 1.333497120542623
Energy: 1.2122658306104226
Energy: 1.3798455737920963
Energy: 1.2122658306115495
Energy: 1.318741715806709
Energy: 1.20384977598216
Energy: 1.318741715806709
Energy: 1.20384977598216
Energy: 1.3187417158156736
Energy: 1.20384977598216
Energy: 1.1912808053323474
Energy: 1.4494036150726033
Energy: 1.1914056458856346
Energy: 1.4326077280102512
Energy: 1.1912808053323474
Energy: 1.4326077280091243
Energy: 1.2124561723520313
Energy: 1.2962357163460947
Energy: 1.2124561723503409
Energy: 1.296235716343892
Energy: 1.2124561723497773
Energy: 1.296235716343892
Energy: 1.3651456225056073
Energy: 1.2315528430024199
Energy: 1.3651456225044802
Energy: 1.2315528430001659
Energy: 1.3651456225022263
Energy: 1.2315528430001659
Energy: 1.211827511067262
Energy: 1.337056940409875
Energy: 1.2118275110678254
Energy: 1.3370569404042403
Energy: 1.2118275110683892
Energy: 1.3370569404126924
Energy: 1.1701336390673178
Energy: 1.308178134437007
Energy: 1.1701336390701351
Energy: 1.3081781344415147
Energy: 1.1701336390656272
Energy: 1.3081781344432053
Energy: 1.3985819715795305
Energy: 1.2279627224842196
Energy: 1.3987307051311297
Energy: 1.227962722483656
Energy: 1.3985819715862926
Energy: 1.2279627224847829
Energy: 1.298374411064294
Energy: 1.2512316220993325
Energy: 1.2983744110592228
Energy: 1.2671837778289063
Energy: 1.2983744110564053
Energy: 1.2671837778300334
Energy: 1.1936877593406694
Energy: 1.4804710292929677
Energy: 1.193687759341233
Energy: 1.4804710292890233
Energy: 1.1936877593417965
Energy: 1.4804710292890233
Energy: 1.3831820370886918
Energy: 1.230582962725534
Energy: 1.3831820370870014
Energy: 1.2127805333681203
Energy: 1.3831820370870014
Energy: 1.212780533367557
Energy: 1.3084512710380438
Energy: 1.2056797098627403
Energy: 1.308451271036917
Energy: 1.205679709858796
Energy: 1.30845127103246
Energy: 1.2056797098571055
Energy: 1.2653452161630006
Energy: 1.367025800014347
Energy: 1.265345216169199
Energy: 1.3670258000115296
Energy: 1.2653452161703258
Energy: 1.3670258000115296
Energy: 1.266942443065481
Energy: 1.2679175173500834
Energy: 1.2669424430660445
Energy: 1.267917517355155
Energy: 1.266942443067735
Energy: 1.2679175173529011
Energy: 1.3090456367540768
Energy: 1.204305740881586
Energy: 1.3090456367512593
Energy: 1.2043057408889113
Energy: 1.3090456367484418
Energy: 1.2043057408883477
Energy: 1.1960821603912557
Energy: 1.3451336271333538
Energy: 1.1960820560923744
Energy: 1.3451336271203937
Energy: 1.1960821603912557
Energy: 1.3451336271282823
Energy: 1.1967142574179244
Energy: 1.2985444271139297
Energy: 1.196711979562979
Energy: 1.2985444271066044
Energy: 1.196714257408909
Energy: 1.2985444271066044
Energy: 1.3570668953571827
Energy: 1.2280768518321383
Energy: 1.3570668953588734
Energy: 1.2280768518315748
Energy: 1.3570668953549292
Energy: 1.2280768518310115
Energy: 1.212655404481247
Energy: 1.2371815026308812
Energy: 1.2126554044840645
Energy: 1.2371815026207387
Energy: 1.2126554044823739
Energy: 1.2371815026201751
Energy: 1.1735778627381908
Energy: 1.4175785663045815
Energy: 1.173577862738754
Energy: 1.4175785663023275
Energy: 1.17357786273481
Energy: 1.4175785663102163
Energy: 1.3660611869412553
Energy: 1.2322537639967728
Energy: 1.366061186738505
Energy: 1.2322537639950821
Energy: 1.3660611869564692
Energy: 1.2322537639945188
Energy: 1.3270013878965217
Energy: 1.235105496201602
Energy: 1.3270013878965217
Energy: 1.235105496200475
Energy: 1.3270013878948312
Energy: 1.2351054961999115
Energy: 1.1912789565761308
Energy: 1.3169481855552643
Energy: 1.1912789565699324
Energy: 1.3169481855648437
Energy: 1.191278956570496
Energy: 1.3169481855642804
Energy: 1.3929690974983084
Energy: 1.2354582511707684
Energy: 1.3929690974983084
Energy: 1.2354582511640066
Energy: 1.3929690974954907
Energy: 1.2354582511640066
Energy: 1.3686360389336663
Energy: 1.2046732342039288
Energy: 1.309172871225624
Energy: 1.2046732342044921
Energy: 1.3686360389314123
Energy: 1.2046732342056192
Energy: 1.3458171417255507
Energy: 1.3700169266143847
Energy: 1.264823783903353
Energy: 1.3700169266093132
Energy: 1.3458171417193525
Energy: 1.3700169266081863
Energy: 1.3732445862342362
Energy: 1.2884548039829131
Energy: 1.305260779978992
Energy: 1.2884548039868575
Energy: 1.3732445862319822
Energy: 1.288454803988548
Energy: 1.3463843530829511
Energy: 1.1990892494958283
Energy: 1.3463843530818242
Energy: 1.199089249493011
Energy: 1.3463843530795703
Energy: 1.1990892494924474
Energy: 1.19529490813913
Energy: 1.2860423929874714
Energy: 1.1953674374802001
Energy: 1.2860423929914155
Energy: 1.1952949081380029
Energy: 1.2860423929919793
Energy: 1.1962396765970686
Energy: 1.3374876650629093
Energy: 1.19620581090287
Energy: 1.3374876650640362
Energy: 1.1962396765970686
Energy: 1.337487665065163
Energy: 1.3732177600754878
Energy: 1.2318584584540035
Energy: 1.3732177600822497
Energy: 1.2318584584573844
Energy: 1.3732177600805593
Energy: 1.2318584584568208
Energy: 1.3144090203918477
Energy: 1.2350978026363788
Energy: 1.3144090203822685
Energy: 1.2350978026515926
Energy: 1.3144090203805778
Energy: 1.2350978026515926

minimum gb energy = 1.1701336390656272 eV
minimum distance =  2.19132337330095 Angstroms
sigma value = 33


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

Energy: 0.020072852860651413
Energy: 0.9799964447877564
Energy: 0.020072852860183236
Energy: 0.9799964447854674
Energy: 0.020072852860651413
Energy: 0.9799964447877564
Energy: 0.02151540677196489
Energy: 0.4342228029012398
Energy: 0.02151540677149671
Energy: 0.43422280290077164
Energy: 0.021515406772381045
Energy: 0.43422280290217613
Energy: 0.9799428264466098
Energy: 0.43424790530654234
Energy: 0.9799428205361862
Energy: 0.43424790531387714
Energy: 0.9799436492277862
Energy: 0.434247905305606
Energy: 0.021515406772849223
Energy: 0.43422280290306053
Energy: 0.021515406773317397
Energy: 0.43422280290446497
Energy: 0.021515406772849223
Energy: 0.43422280290264437

minimum gb energy = 0.020072852860183236 eV
minimum distance =  2.48384711956163 Angstroms
sigma value = 1