Model name: model_name=EAM_IMD_BrommerGaehler_2006A_AlNiCo__MO_122703700223_003
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.128871455788613
cohesive_energy=3.7144354827541424
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.53307330188668e-19, 2.72959628781312e-19, 3.1593641481172796e-19, 3.4645627751279396e-19, 3.7803838332220197e-19, 4.0803753861721796e-19, 4.36134910247676e-19, 4.60387057956534e-19, 4.8013228279395e-19, 4.96259792791794e-19, 5.098750898275259e-19, 5.21466837774516e-19, 5.31483646090284e-19, 5.4157575670785e-19, 5.518200741056459e-19, 5.61477994855398e-19, 5.70081683379978e-19, 5.77373189241312e-19, 5.83259586194628e-19, 5.87837004837966e-19, 5.91206382299268e-19, 5.93452633940136e-19, 5.94689514301584e-19, 5.95070832340476e-19, 5.946574707689039e-19, 5.9332285763278195e-19, 5.909308079182199e-19, 5.873595562010339e-19, 5.825001544701119e-19, 5.76242052537708e-19, 5.684730980394419e-19, 5.590474929016199e-19, 5.477569541618219e-19, 5.34329111792268e-19, 5.18518832767956e-19, 4.99883916337902e-19, 4.77644102481348e-19, 4.50693889320834e-19, 4.1738784145324197e-19, 3.75338715693912e-19, 3.21478343788734e-19, 2.5215696736545595e-19, 1.63737645464898e-19, 5.2003769621698797e-20, -9.06806340017856e-20, -2.8015660622123996e-19, -4.17240441202914e-19, -5.8301605534626e-19, -9.08748178098264e-19, -1.46817058033224e-18, -2.4868344842294397e-18, -4.25568555346446e-18, -7.39646445262734e-18, -1.3253397377644079e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.012423751189974162
Energy: 0.05663334911604576
Energy: 0.057133443791903465
Energy: 0.05703429381511357
Energy: 0.013262502123050602
Energy: 0.013235956487470673
Energy: 0.056717294029139755
Energy: 0.05715293512529972
Energy: 0.05698399874595859
Energy: 0.013140506416667178
Energy: 0.056942565643876196
Energy: 0.05662225582657227
Energy: 0.056538588097733426
Energy: 0.05708972458451373
Energy: 0.057535122901833366
Energy: 0.057129451070107674
Energy: 0.0564838785421661
Energy: 0.05660888587405639
Energy: 0.05681323794375003
Energy: 0.05743211915700307
Energy: 0.057113939313533
Energy: 0.01305371006892827
Energy: 0.01276986424291597
Energy: 0.0570968908804119
Energy: 0.056613016999138475
Energy: 0.05729341350733354
Energy: 0.01291534327791153
Energy: 0.012760668749145295
Energy: 0.056708396304367734
Energy: 0.05707592176922633
Energy: 0.05712754561868384
Energy: 0.013170410681702271
Energy: 0.01279462890118355
Energy: 0.05606928046390001
Energy: 0.0568106021009361
Energy: 0.05726366141967726
Energy: 0.013078667727355327
Energy: 0.012855696304374331
Energy: 0.05590850232346512
Energy: 0.05678839484645774
Energy: 0.05692767557565302
Energy: 0.057075437562632864
Energy: 0.056069416895666836
Energy: 0.012908972316315218
Energy: 0.013728904597080498
Energy: 0.056714930147168746
Energy: 0.05722187402012
Energy: 0.056190334397075534
Energy: 0.012883984882340669
Energy: 0.05603523323247698
Energy: 0.05631688611215505
Energy: 0.05623123096740252
Energy: 0.057081611180078304
Energy: 0.012907345234299573
Energy: 0.012895305705762038
Energy: 0.056122937129749584
Energy: 0.05582661393710235
Energy: 0.05759694306989268
Energy: 0.012880164750963579
Energy: 0.0130019045711182
Energy: 0.013032393293674734
Energy: 0.05629446959578693
Energy: 0.05699185881715512
Energy: 0.05711622480855956
Energy: 0.0563713855496565
Energy: 0.01307391986708582
Energy: 0.05642176065940456
Energy: 0.056894262503005666
Energy: 0.05745018621519357
Energy: 0.05645153844889026

minimum gb energy = 0.012423751189974162 eV
minimum distance =  2.88434901241957 Angstroms
sigma value = 3


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

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Energy: 0.48048716527645186
Energy: 0.4794701439944141
Energy: 0.48434895975587305
Energy: 0.4949986816109429
Energy: 0.4908311110106511
Energy: 0.485538313484334
Energy: 0.47950352289561393
Energy: 0.486340514578659
Energy: 0.4811469128394835
Energy: 0.44169477384234795
Energy: 0.5156561713296987
Energy: 0.481497366297639
Energy: 0.4905714342146661
Energy: 0.42172747646758874
Energy: 0.40749144716529756
Energy: 0.5290613625007884
Energy: 0.48261941475524117
Energy: 0.4854034860471543
Energy: 0.4686062997393918
Energy: 0.44654641057596617
Energy: 0.5088764505972848
Energy: 0.4147023742047445
Energy: 0.4053131360260215
Energy: 0.4617475108332293
Energy: 0.4057576220708546
Energy: 0.5185616724261441
Energy: 0.4168643994512088
Energy: 0.40820531137629934
Energy: 0.47105649822395446
Energy: 0.4457094642709183
Energy: 0.484665754764786
Energy: 0.4932131505870712
Energy: 0.4088513654779409
Energy: 0.41548574501090113
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Energy: 0.48117709460207714
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Energy: 0.4574777052549813
Energy: 0.4629412795258985
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Energy: 0.4819860756252827
Energy: 0.5161648231177083
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Energy: 0.48361052564058404
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Energy: 0.49959826776798955
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Energy: 0.4989246016660054
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Energy: 0.4028790769599353
Energy: 0.5116004186161602
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Energy: 0.37049678466442204
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Energy: 0.5468205590358267
Energy: 0.5946129310782414
Energy: 0.4953825709086788
Energy: 0.49688732231954125
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Energy: 0.4994034400257904
Energy: 0.5953167983748694
Energy: 0.49555482331795825
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Energy: 0.5048363539514997
Energy: 0.4969210436227622
Energy: 0.3975022835808823
Energy: 0.5154694334318543
Energy: 0.4998435664030163
Energy: 0.5040352577971137
Energy: 0.4358546545711278
Energy: 0.39897340413893584
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Energy: 0.49962121670463644
Energy: 0.5053783146971926
Energy: 0.43642831826419126
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Energy: 0.5061209430022596
Energy: 0.4151057267095643
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Energy: 0.5161600869153231
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Energy: 0.49788332596111784
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Energy: 0.48413767662326934
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Energy: 0.49774027261491377
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Energy: 0.5003411852728459
Energy: 0.4404722844176307
Energy: 0.3891343319786998
Energy: 0.5319272455806516
Energy: 0.5002089005681215
Energy: 0.5004472081251324
Energy: 0.44414268383363936
Energy: 0.4012684537380795
Energy: 0.5276398578936592
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Energy: 0.42315843130011777
Energy: 0.4536596662591011
Energy: 0.40437946646437356
Energy: 0.4529039454316022
Energy: 0.43853333075086925
Energy: 0.444543037741565
Energy: 0.4376970428866892
Energy: 0.44805895573970045
Energy: 0.4365791883390006
Energy: 0.4175585247831405
Energy: 0.4514570802150509
Energy: 0.41597924867832087
Energy: 0.4486366319405056
Energy: 0.44812725230898887
Energy: 0.4147373689269602
Energy: 0.4474327403875888
Energy: 0.4314449279343021
Energy: 0.4061961209403663
Energy: 0.45115100474657727
Energy: 0.41453486793148464
Energy: 0.5322181998996046
Energy: 0.40679754495518344
Energy: 0.4053717748179045
Energy: 0.516004703803522
Energy: 0.4773187474836927
Energy: 0.5383872385235757
Energy: 0.3718976531107988
Energy: 0.4347058401105762
Energy: 0.5437862975623232
Energy: 0.48082053793153784
Energy: 0.5549773196105762
Energy: 0.4894420372343731
Energy: 0.5094576038021095
Energy: 0.5082632802659032
Energy: 0.503066882091672
Energy: 0.48832108529239926
Energy: 0.46505857289787617
Energy: 0.4772810457252812
Energy: 0.4860292835192615
Energy: 0.5021163055262485
Energy: 0.4484548361857216
Energy: 0.4475415543819836
Energy: 0.48274087747417516
Energy: 0.47823504911587744
Energy: 0.5219851309587805
Energy: 0.4057588093087648
Energy: 0.41987706823628557
Energy: 0.4843124608229495
Energy: 0.48088789295757267
Energy: 0.5197203813394822
Energy: 0.5065548814458921
Energy: 0.47922134676020384
Energy: 0.48423753656034635
Energy: 0.4813684483929066
Energy: 0.4842840685255089
Energy: 0.5286487815048587
Energy: 0.48536169595909673
Energy: 0.48271295298024824
Energy: 0.4790768503673745
Energy: 0.4801044604615574

minimum gb energy = 0.37049678466442204 eV
minimum distance =  2.60840349162748 Angstroms
sigma value = 75


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

Energy: 0.9933538563667872
Energy: 0.44855389618085584
Energy: 0.45183709359080043
Energy: 0.4602377905685513
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Energy: 0.4437490845789005
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Energy: 0.46168959240260987
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minimum gb energy = 0.428258555766275 eV
minimum distance =  2.64462986867326 Angstroms
sigma value = 105


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

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Energy: 0.4703249444253424
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Energy: 0.46061929481369746
Energy: 0.44941678254301026
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Energy: 0.4554100019184377
Energy: 0.4631287571899427
Energy: 0.4428958394747464
Energy: 0.45418178624060745
Energy: 0.44147459701827557
Energy: 0.45555040294082677
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Energy: 0.45478893750895527
Energy: 0.4642805451458866
Energy: 0.4925934666759632
Energy: 0.46189741144980423
Energy: 0.4506545403951878
Energy: 0.44247439218257534
Energy: 0.4555836981744122
Energy: 0.48182208460588627
Energy: 0.48008565039429507
Energy: 0.4749702967608471
Energy: 0.4498196050900503
Energy: 0.4759918509352735
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Energy: 0.4426227870910729
Energy: 0.4601586136061281
Energy: 0.4522460884637658
Energy: 0.4746043104549234
Energy: 0.45421971420625834
Energy: 0.45305644649647037
Energy: 0.45092748978006775
Energy: 0.48568126156341124
Energy: 0.45181494503849895
Energy: 0.44230599850912206
Energy: 0.4431995644887548
Energy: 0.46772482537393184
Energy: 0.4804824532602221
Energy: 0.4462752600396764
Energy: 0.4547752709526831
Energy: 0.48167580721105746
Energy: 0.4953078808379355
Energy: 0.460486560386841
Energy: 0.4618269433350945
Energy: 0.449980481215561
Energy: 0.47281899144885603
Energy: 0.49561411718726517
Energy: 0.4581203288065123
Energy: 0.46078875215787374
Energy: 0.46863559568421986
Energy: 0.47453201125204264
Energy: 0.4968167042874878
Energy: 0.45572682987628926
Energy: 0.4689193192535029
Energy: 0.4417312058862071
Energy: 0.4428733951214169
Energy: 0.44296508395005657
Energy: 0.4473039752670002
Energy: 0.47117057607934804
Energy: 0.4490409284502827
Energy: 0.4465523220044987
Energy: 0.45280135499102186
Energy: 0.451209255996289
Energy: 0.4408613798753848
Energy: 0.44821010111332943
Energy: 0.44587069405658514
Energy: 0.4474359822776243
Energy: 0.43765289683652564
Energy: 0.4415197251365789
Energy: 0.447707990302774
Energy: 0.442487503371186
Energy: 0.44926962736418335

minimum gb energy = 0.4370000037105466 eV
minimum distance =  2.60162656409557 Angstroms
sigma value = 165


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

Energy: 0.5660637319471561
Energy: 0.42479211329800853
Energy: 0.42491782238461895
Energy: 0.42917244379754016
Energy: 0.42100800798462734
Energy: 0.5660984659178554
Energy: 0.45548058750294773
Energy: 0.425151401559285
Energy: 0.42890361008708644
Energy: 0.42082709180234273
Energy: 0.4302628565029604
Energy: 0.4292399916509277
Energy: 0.4306949270771273
Energy: 0.42254825459663226
Energy: 0.4260526761473416
Energy: 0.4305892290505399
Energy: 0.42890013834538476
Energy: 0.43086605929684185
Energy: 0.4232699283821017
Energy: 0.426526742378954
Energy: 0.4230326080188584
Energy: 0.43695080135370934
Energy: 0.4262733972881236
Energy: 0.42568498800025606
Energy: 0.4346481442163789
Energy: 0.4234638062071971
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Energy: 0.42909985507758014
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Energy: 0.4225409186354421
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Energy: 0.42997358363872185
Energy: 0.4256056273117801
Energy: 0.4252935571539727
Energy: 0.41713461608104346
Energy: 0.42644819271516576
Energy: 0.4288145027352719
Energy: 0.42727938369157026
Energy: 0.42889209165235326
Energy: 0.42916764378538386
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Energy: 0.4286121063064475
Energy: 0.42533840331471917
Energy: 0.42913603378099646
Energy: 0.43111914988944744
Energy: 0.4344740200153688
Energy: 0.4266461387006932
Energy: 0.4291952003494957
Energy: 0.42538121306396753
Energy: 0.42913062087155046
Energy: 0.42580453850361516
Energy: 0.42538151919840944
Energy: 0.4247487849294634
Energy: 0.42397608586456886
Energy: 0.4248958076984961
Energy: 0.42599480720617183
Energy: 0.42906228512303457
Energy: 0.42531860556301637
Energy: 0.4257784898296049
Energy: 0.43096643673508633
Energy: 0.42545108026640005
Energy: 0.4273902109729814
Energy: 0.4251070540197659
Energy: 0.4238481470628549
Energy: 0.43329403442053627
Energy: 0.4236444999597661
Energy: 0.42761939834687623
Energy: 0.42181456961708136
Energy: 0.4268070277046236
Energy: 0.4302144977091422
Energy: 0.42350017537224055
Energy: 0.42426691178050957
Energy: 0.42186493863073615
Energy: 0.4270667997287155
Energy: 0.43080468851738946
Energy: 0.42283308247340945
Energy: 0.4290216703454129
Energy: 0.42931180581399225
Energy: 0.42332342010968715
Energy: 0.42508534582682084
Energy: 0.42516318194392894
Energy: 0.42808215028414176
Energy: 0.428375241187977
Energy: 0.42197279200742493
Energy: 0.4222738517225071
Energy: 0.4233394758483683
Energy: 0.4309946580769373
Energy: 0.42925987607358485
Energy: 0.4244663893064317
Energy: 0.4298854626110693
Energy: 0.4354613152784366
Energy: 0.423376367133543
Energy: 0.4303394936074818
Energy: 0.42460170549083587
Energy: 0.4304508054847262

minimum gb energy = 0.41713461608104346 eV
minimum distance =  2.66721887863886 Angstroms
sigma value = 41


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

Energy: 0.4694577755969084
Energy: 0.3976888052386861
Energy: 0.39378788791426433
Energy: 0.37899086586158365
Energy: 0.37661895499075854
Energy: 0.36806570418804674
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Energy: 0.39357524712882236
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Energy: 0.40868107075953025
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Energy: 0.39925677930496956
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Energy: 0.3817564607452713
Energy: 0.4103855782356634
Energy: 0.41129462500003683
Energy: 0.4013133862919325
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Energy: 0.4109046951944755
Energy: 0.3854154041007973
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Energy: 0.39300440591105856
Energy: 0.39822834985862515
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Energy: 0.3861276915077288
Energy: 0.38156504972086613
Energy: 0.43705910409829
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Energy: 0.42465330098567816
Energy: 0.40132716079834424
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Energy: 0.40324421070267485
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Energy: 0.398884440864419
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Energy: 0.4026964641800804
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Energy: 0.4011131105919501
Energy: 0.41016275157142984
Energy: 0.38833084935681317
Energy: 0.3878422206057246
Energy: 0.4036767908098376
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Energy: 0.4428253335282552
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Energy: 0.3830398200554278
Energy: 0.39811546270672754
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Energy: 0.38611117120441885
Energy: 0.38420112154483343
Energy: 0.400745846267026
Energy: 0.3920083344803625
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Energy: 0.3800186900207865
Energy: 0.38137003302931205
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Energy: 0.4000515052229888
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Energy: 0.4729825563826439
Energy: 0.39003067256753987
Energy: 0.40825767467032376
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Energy: 0.384036342135427
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Energy: 0.4000719504059217
Energy: 0.4260749519593484
Energy: 0.4143703090317837
Energy: 0.38790258657658144
Energy: 0.38785756412877764
Energy: 0.40481967251494017
Energy: 0.42614657636330355
Energy: 0.4112499391685852
Energy: 0.3880457630016757
Energy: 0.3877750044925011
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Energy: 0.39871606139267046
Energy: 0.3911276453655528
Energy: 0.38613620618752753
Energy: 0.38673857063575623
Energy: 0.39673264387787727
Energy: 0.3982909585768091
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Energy: 0.38735523217993395
Energy: 0.39211347465788676
Energy: 0.3884593301952058
Energy: 0.4056117033477082
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Energy: 0.42174906379357097
Energy: 0.39544030840265443
Energy: 0.3965664171748351
Energy: 0.40786462114586075
Energy: 0.4402184402902499
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Energy: 0.4054659834403436
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Energy: 0.39795227665914956
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Energy: 0.3957870445099034
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Energy: 0.3964038349113355
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Energy: 0.40321363308762354
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Energy: 0.39706602054050516
Energy: 0.4109134781465915
Energy: 0.3754896503505085
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Energy: 0.38986806549738245
Energy: 0.3949076184847501
Energy: 0.3865254041022383
Energy: 0.3936130244045905
Energy: 0.392708540094507
Energy: 0.3758185065113454
Energy: 0.3765466544569627
Energy: 0.3999376974425743
Energy: 0.3883492885499109
Energy: 0.3878239383350216
Energy: 0.4072431618304363
Energy: 0.3768586657754735
Energy: 0.38330330848661653
Energy: 0.41085940180724756
Energy: 0.39472619586678354
Energy: 0.3972307785671389
Energy: 0.3758203702538615
Energy: 0.4097175947596473
Energy: 0.4000903711760559
Energy: 0.39410677514591963
Energy: 0.3833907289828089
Energy: 0.3770932575395271
Energy: 0.39031147398810045
Energy: 0.39118218600964716
Energy: 0.3938270131832188
Energy: 0.39302132179745475
Energy: 0.4100309653434138
Energy: 0.3941280099558128
Energy: 0.43852634874420404
Energy: 0.4385849379313612
Energy: 0.3825004481987032
Energy: 0.4228557279418534
Energy: 0.3727240968742612
Energy: 0.4236487884820742
Energy: 0.39865486394747257
Energy: 0.3888331092666008

minimum gb energy = 0.36806570418804674 eV
minimum distance =  2.68029094484971 Angstroms
sigma value = 185


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

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Energy: 0.2606426326359899
Energy: 0.2727439279387855
Energy: 0.255056617639552
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Energy: 0.2611709275357924
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Energy: 0.2806181827753242
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Energy: 0.2604193364660926
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Energy: 0.24809698166654054
Energy: 0.2679559211087517
Energy: 0.30781198217497674
Energy: 0.26471313941399205
Energy: 0.1557014117733587
Energy: 0.15802744464578727
Energy: 0.26023695384391016
Energy: 0.30443773797994067
Energy: 0.26498145303757725
Energy: 0.23613190134506049
Energy: 0.24212377229654478
Energy: 0.2516090639287999
Energy: 0.2730270809188995
Energy: 0.2636864669625431
Energy: 0.2607685860691577
Energy: 0.2738984033202631
Energy: 0.26018427328589366
Energy: 0.2589962583720394
Energy: 0.25228135006320657
Energy: 0.2526086957772164
Energy: 0.251892531364117
Energy: 0.2592836619180622
Energy: 0.2983751180162572
Energy: 0.2622844601605921
Energy: 0.2566845176093316
Energy: 0.25462182764732094
Energy: 0.2620428767308439
Energy: 0.27819714198121215
Energy: 0.2521018650544148
Energy: 0.15485622576385166
Energy: 0.2551040141211471
Energy: 0.24782688287331964
Energy: 0.2656717310471123
Energy: 0.25602988747164207

minimum gb energy = 0.15468027165784198 eV
minimum distance =  2.68811153197058 Angstroms
sigma value = 33


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

Energy: 0.41118488209799514
Energy: 0.34821023088999825
Energy: 0.36944045526419067
Energy: 0.36405849872523144
Energy: 0.34040811291938916
Energy: 0.338549267824295
Energy: 0.34622500591963207
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Energy: 0.3646570033582893
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Energy: 0.3652569160758072
Energy: 0.34394841418448713
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Energy: 0.3740950370104466
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Energy: 0.36714457160665803
Energy: 0.3965866687388333
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Energy: 0.3561805414081111
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Energy: 0.35757873289134257
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Energy: 0.3505226628265117
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Energy: 0.3597415068295091
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Energy: 0.3570908016423682
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Energy: 0.37202723532513604
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Energy: 0.35046905613967194
Energy: 0.3506505839352067
Energy: 0.35988169890610106
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Energy: 0.34868254616141037
Energy: 0.34849109796207534
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Energy: 0.35049694999586095
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Energy: 0.40164885619020085
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Energy: 0.3491499554458226
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Energy: 0.3689758792168013
Energy: 0.4022667003922159
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Energy: 0.3632674104530624
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Energy: 0.34471919562407705
Energy: 0.34577761614945995
Energy: 0.3576244795520091
Energy: 0.40277988040441237
Energy: 0.35375985865432497
Energy: 0.35370612654859995
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Energy: 0.348797733441766
Energy: 0.37100607987550654
Energy: 0.3533242698608723
Energy: 0.34398922952012334
Energy: 0.3421208401248951
Energy: 0.3398324259404402
Energy: 0.3785197672132044
Energy: 0.34496325253387283
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Energy: 0.38335600647624124
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Energy: 0.37062275921526006
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Energy: 0.3373365992459116
Energy: 0.34477317517499034
Energy: 0.35201249649351923
Energy: 0.36806093026119907
Energy: 0.3593323931365721

minimum gb energy = 0.3373365992459116 eV
minimum distance =  2.6018041008256 Angstroms
sigma value = 219


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

Energy: 0.5382548731357526
Energy: 0.43984390609564783
Energy: 0.44584216251791314
Energy: 0.44681479282125103
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Energy: 0.4381932806809106
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Energy: 0.4687310489664154
Energy: 0.43774988474764853
Energy: 0.4572811277533693
Energy: 0.4475142930285029
Energy: 0.4451160168232191
Energy: 0.44554677679225085
Energy: 0.4376600003047262
Energy: 0.50268779348652
Energy: 0.4630019127168616
Energy: 0.4559736847576842
Energy: 0.43915952716180445
Energy: 0.43780796261198446
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Energy: 0.44613257096480735
Energy: 0.4389413677573005
Energy: 0.4981165688145745
Energy: 0.4379200596549692
Energy: 0.4540210199497521
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Energy: 0.43790208201535197
Energy: 0.4380411653541174
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Energy: 0.43890265843786397
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Energy: 0.4537357187101145
Energy: 0.4601954068966414
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Energy: 0.4402964133129561
Energy: 0.44020975754363545
Energy: 0.45952971075788235
Energy: 0.43775777600317645
Energy: 0.4489550502818953
Energy: 0.4278383786515735
Energy: 0.43928813398134553
Energy: 0.4380310079464419
Energy: 0.439260999762917
Energy: 0.4448098833375326
Energy: 0.42824007775683753
Energy: 0.4417215359259925
Energy: 0.4443183554656075
Energy: 0.43953525468454324
Energy: 0.4387625001575822
Energy: 0.44500375389356606
Energy: 0.44502581912676437
Energy: 0.4466625138282909
Energy: 0.43831282116858267
Energy: 0.43821539778973495
Energy: 0.44505080967331784
Energy: 0.46125630383757793
Energy: 0.4455263392791593
Energy: 0.4393813825292044
Energy: 0.42818541020534207
Energy: 0.4393258344871913
Energy: 0.44613109081399244
Energy: 0.4466669367255111
Energy: 0.43834343787164
Energy: 0.42863689733555094
Energy: 0.4408503630278974
Energy: 0.4563581817368914
Energy: 0.4455574896710764
Energy: 0.4381387254031332

minimum gb energy = 0.4277143222746266 eV
minimum distance =  2.64843307822053 Angstroms
sigma value = 15


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

Energy: 0.8508010238208528
Energy: 0.5286570029740736
Energy: 0.5263478709459732
Energy: 0.52503123438521
Energy: 0.510466920534841
Energy: 0.5071089104650227
Energy: 0.5184302210376699
Energy: 0.5451267479608695
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minimum gb energy = 0.5052455949054478 eV
minimum distance =  2.62414845171189 Angstroms
sigma value = 293


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

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Energy: 0.5040829967762773
Energy: 0.5044915206405586
Energy: 0.49594183747800413
Energy: 0.5258278967976707
Energy: 0.4983108191735842
Energy: 0.49687796609078905
Energy: 0.5051195439335529
Energy: 0.5076533391797242
Energy: 0.4933251038017885
Energy: 0.4986874432748877
Energy: 0.49689617114189416
Energy: 0.504347682070621
Energy: 0.5069446685442993
Energy: 0.5044578092429975
Energy: 0.49978480034680095
Energy: 0.5049625004980471
Energy: 0.5208025955076128
Energy: 0.5256907761763298
Energy: 0.5056387550815196
Energy: 0.512024427629488
Energy: 0.5200761876148674
Energy: 0.5222554444615592
Energy: 0.5249948552933048
Energy: 0.5056323062497905
Energy: 0.5122754792712644
Energy: 0.49687794616307357
Energy: 0.5290713063538038
Energy: 0.5339581521249492
Energy: 0.4970661169053948
Energy: 0.5584540988755503
Energy: 0.497456305675073
Energy: 0.5274201040470793
Energy: 0.5282630427450453
Energy: 0.4971216341210226
Energy: 0.5583856698585041
Energy: 0.5034876494220464
Energy: 0.5143838070331339
Energy: 0.5049706565260605
Energy: 0.5042917245341683
Energy: 0.5119752632795409
Energy: 0.5031634677374917
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Energy: 0.5062907673214344
Energy: 0.5044449195796509
Energy: 0.5120078557017731
Energy: 0.51971637609191
Energy: 0.5066498735420621
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Energy: 0.4971190087800711
Energy: 0.49752436124696814
Energy: 0.4850510962789334
Energy: 0.5068684858232295
Energy: 0.5041238481179777
Energy: 0.4971260089609262
Energy: 0.498127378098636
Energy: 0.4983114461571478
Energy: 0.49594381400251547
Energy: 0.49731833697331984
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Energy: 0.49897270208204936
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Energy: 0.4861039016545786
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Energy: 0.4867079652315685
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Energy: 0.4976149128123933
Energy: 0.5304351149859948
Energy: 0.4870028478550675
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Energy: 0.4968567026469318
Energy: 0.49801494533842017
Energy: 0.49616555031384413
Energy: 0.4958924322624356
Energy: 0.5056011222763581
Energy: 0.5041116085759233
Energy: 0.5074724304022985
Energy: 0.4960895110957394
Energy: 0.49577092901084613
Energy: 0.5058228424923246
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Energy: 0.4959497498220816
Energy: 0.5001924608713693
Energy: 0.4983045018831996
Energy: 0.506860898027262
Energy: 0.4994290255141827
Energy: 0.5059810711681256
Energy: 0.49929851626701977
Energy: 0.4988611242893003
Energy: 0.5070737776985176
Energy: 0.49755830941553675
Energy: 0.506015706980532
Energy: 0.5179973965321911
Energy: 0.5250546928719544
Energy: 0.512243327309941
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Energy: 0.4990129762244717
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Energy: 0.5129548182000772
Energy: 0.5137154589847728
Energy: 0.5067805378793142
Energy: 0.5386956490773729
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Energy: 0.5124738014394256
Energy: 0.5151037928225577
Energy: 0.5075864233284992
Energy: 0.5261796110637318
Energy: 0.5734147021922591
Energy: 0.5055432472883926
Energy: 0.5206677588994413
Energy: 0.5060496288891314
Energy: 0.4975113454755127
Energy: 0.5184386939274407
Energy: 0.5372972840772882
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Energy: 0.5192100677926527
Energy: 0.4975947082283453
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Energy: 0.4970982817077578
Energy: 0.492170452369258
Energy: 0.485770865075041
Energy: 0.5042380015289042
Energy: 0.49700849135646913
Energy: 0.5060639106782353
Energy: 0.48581012323976275
Energy: 0.48611716526200593
Energy: 0.5041614622856117
Energy: 0.5046030773130467
Energy: 0.5046991889159829
Energy: 0.49799654966856594
Energy: 0.5265457559841742
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Energy: 0.5050752002847656
Energy: 0.5051756260571791
Energy: 0.5156808924272278
Energy: 0.5248691082920254
Energy: 0.49598922330750345
Energy: 0.49638544711401644
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Energy: 0.5050144859123998
Energy: 0.5070722393846557
Energy: 0.4992057964434447
Energy: 0.498870630358742
Energy: 0.5032248701672846
Energy: 0.5107844922931164
Energy: 0.5077833082149176
Energy: 0.498225616876848
Energy: 0.48554660089564416
Energy: 0.5102544113089917
Energy: 0.5314224599740072
Energy: 0.5110622662120863
Energy: 0.519465949345412
Energy: 0.5011806018469452
Energy: 0.49716829528317363
Energy: 0.5110505173873657
Energy: 0.4987550811904189
Energy: 0.520979175042416
Energy: 0.5211993749373595
Energy: 0.49643606264724455
Energy: 0.49643797810251017
Energy: 0.5105614488281431
Energy: 0.4978323817151309
Energy: 0.5214685740218831
Energy: 0.4964824934314482
Energy: 0.4959929680424842
Energy: 0.5110490804425434
Energy: 0.4868313348027396
Energy: 0.5044681677920259
Energy: 0.5034099830429261
Energy: 0.4971336616431591
Energy: 0.5133305506534223
Energy: 0.4990984082499899
Energy: 0.5041889917445953
Energy: 0.5044628909148023
Energy: 0.4963582867846224
Energy: 0.5248603327804668
Energy: 0.5370778215202985
Energy: 0.49741402992749667
Energy: 0.506989884365729
Energy: 0.5071225969066946
Energy: 0.4994133165979673
Energy: 0.49927067548272414
Energy: 0.49725728324671814
Energy: 0.5079619539587519
Energy: 0.5067747730468822
Energy: 0.4980769826670409
Energy: 0.5000583529528266
Energy: 0.4970600320432081
Energy: 0.5205625875570398
Energy: 0.5362386045560729
Energy: 0.4959411546685735
Energy: 0.5134867162390135
Energy: 0.5207952726184549
Energy: 0.5222008173272356
Energy: 0.5372505851628313
Energy: 0.4967484813826895
Energy: 0.5138155631614466
Energy: 0.49691595552667284
Energy: 0.5077505527987886
Energy: 0.5395633130453283
Energy: 0.5007042938818482
Energy: 0.5588705790832337
Energy: 0.49715251072917216
Energy: 0.5072471255201965
Energy: 0.5391900645231195
Energy: 0.4976750879247884
Energy: 0.5595265621678915
Energy: 0.49742700504626997
Energy: 0.5135914339373996
Energy: 0.4988223721666728
Energy: 0.5429853297872436
Energy: 0.5121727067899264
Energy: 0.5001042117052727
Energy: 0.5154786464869263
Energy: 0.5053666206348443
Energy: 0.5051159390051785
Energy: 0.5075621165002454

minimum gb energy = 0.4850510962789334 eV
minimum distance =  2.5927524392932 Angstroms
sigma value = 293


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

Energy: 0.473649785407863
Energy: 0.4800967812505479
Energy: 0.5154116050810646
Energy: 0.4824173486837259
Energy: 0.4743224213609486
Energy: 0.4736345938627848
Energy: 0.48030128896810087
Energy: 0.5150881071848203
Energy: 0.48138674842805806
Energy: 0.4742029560789741
Energy: 0.5040539755501693
Energy: 0.4804084142323183
Energy: 0.4794348160026841
Energy: 0.4786602083768392
Energy: 0.48091748322592015
Energy: 0.5026328249159161
Energy: 0.4804901158222844
Energy: 0.4749228492046139
Energy: 0.4791447992178201
Energy: 0.48038662255637476
Energy: 0.4807648067070276
Energy: 0.4795323205291647
Energy: 0.4804955228251957
Energy: 0.4818202648327275
Energy: 0.5024080800099553
Energy: 0.47974392339247246
Energy: 0.48004025305565345
Energy: 0.4802018894598268
Energy: 0.5155387231208978
Energy: 0.5025801381351229
Energy: 0.5168580492494047
Energy: 0.4744346360782154
Energy: 0.4743929380152049
Energy: 0.47974278191565795
Energy: 0.4803190921396376
Energy: 0.5173956409619627
Energy: 0.4742468844595062
Energy: 0.4744879548891179
Energy: 0.4796531444142415
Energy: 0.47850403114895346
Energy: 0.48045282773865766
Energy: 0.47406666002339604
Energy: 0.47399907852537976
Energy: 0.5024770138327648
Energy: 0.4818493524378631
Energy: 0.48012052530116184
Energy: 0.47412733567816856
Energy: 0.4740535615935968
Energy: 0.4796096374746648
Energy: 0.48009135371156964
Energy: 0.48067271757342717
Energy: 0.5156228491700123
Energy: 0.48078898888819294
Energy: 0.48018998556146497
Energy: 0.4750556724776136
Energy: 0.48146069301493605
Energy: 0.5151055343516561
Energy: 0.4809270805877803
Energy: 0.5062389206226497
Energy: 0.4865392831216834
Energy: 0.5157487068073228
Energy: 0.4762586030729424
Energy: 0.4811083776177591
Energy: 0.48027423837952316
Energy: 0.47970652891516335
Energy: 0.4805810521749732
Energy: 0.47534925449236637
Energy: 0.4809309925568833
Energy: 0.480503424485031
Energy: 0.4796836186591774
Energy: 0.4820778292529616
Energy: 0.5012800192595267
Energy: 0.4804460710234749
Energy: 0.47401888388534114
Energy: 0.4740224761806582
Energy: 0.4821411196959644
Energy: 0.5021329266222847
Energy: 0.48056751321505375
Energy: 0.4768781959363203
Energy: 0.47484258352529146
Energy: 0.47991910741698607
Energy: 0.4745060082417514
Energy: 0.4790951792678725
Energy: 0.4742593581283661
Energy: 0.5038029029964757
Energy: 0.4797223332418138
Energy: 0.4789744597919211
Energy: 0.4789950976715952
Energy: 0.47409665060869943
Energy: 0.5022640293053365
Energy: 0.5069498149939916
Energy: 0.4807704588133869
Energy: 0.5022055939075949
Energy: 0.5160516109306322
Energy: 0.4810550620904753
Energy: 0.508570069975385
Energy: 0.4816001823116434
Energy: 0.5019479669121585
Energy: 0.48164140194920735
Energy: 0.47973277221172067
Energy: 0.47492913676238013
Energy: 0.48135904125099144
Energy: 0.48223568459275684
Energy: 0.5162626318496932
Energy: 0.50380015231306
Energy: 0.47481433461238615
Energy: 0.48120930586469096
Energy: 0.4754804684389888
Energy: 0.5162995928253851
Energy: 0.5033021710626511
Energy: 0.473731063461269
Energy: 0.4803369912911167
Energy: 0.5146049594416892
Energy: 0.48197824879188045
Energy: 0.4744280300718202
Energy: 0.4738521062480602
Energy: 0.4805408267351753
Energy: 0.5148215588113074
Energy: 0.48155637186844324
Energy: 0.47414277007630506
Energy: 0.5040833053681341
Energy: 0.48020918212081826
Energy: 0.47889047470299406
Energy: 0.4786773108223754
Energy: 0.48093194857663835
Energy: 0.5024467066943857
Energy: 0.48045820465583866
Energy: 0.4747812898733006
Energy: 0.47909021011286007
Energy: 0.4822482427577978
Energy: 0.48150817091190473
Energy: 0.47976576827890727
Energy: 0.48061437163005766
Energy: 0.5156390898489844
Energy: 0.5022874068287605
Energy: 0.4796635512487487
Energy: 0.48006494880739137
Energy: 0.4804119585292542
Energy: 0.5157557513880463
Energy: 0.5022300369087827
Energy: 0.5167596098588547
Energy: 0.4741495867618774
Energy: 0.4743892101161471
Energy: 0.4799328340755948
Energy: 0.5150274625488217
Energy: 0.5165374774669064
Energy: 0.47409736316558915
Energy: 0.4745646992631735
Energy: 0.4793264503157847
Energy: 0.5028060006712312
Energy: 0.4804870225931896
Energy: 0.4740315604125372
Energy: 0.47396773001788245
Energy: 0.4808588022042457
Energy: 0.48200932531609075
Energy: 0.4802379482143365
Energy: 0.47410034874851253
Energy: 0.47395210319088643
Energy: 0.47950026765230586
Energy: 0.48045132110376476
Energy: 0.48072147801736265
Energy: 0.515155595972528
Energy: 0.4810850833267823
Energy: 0.4798113493170692
Energy: 0.4748745004709046
Energy: 0.4809250561081857
Energy: 0.5154989652213791
Energy: 0.48095581763548645
Energy: 0.5053389865198
Energy: 0.48769032004225155
Energy: 0.5158218622411316
Energy: 0.4763643415162617
Energy: 0.48134993873028176
Energy: 0.4796734913447123
Energy: 0.47972072322299647
Energy: 0.5155624863422897
Energy: 0.475363906674862
Energy: 0.4809093902773285
Energy: 0.479455523589434
Energy: 0.47915732663374305
Energy: 0.4824236268568078
Energy: 0.5012216565992611
Energy: 0.48038633144012194
Energy: 0.47824656795055676
Energy: 0.4743623751008128
Energy: 0.4819894042278392
Energy: 0.5024379238555533
Energy: 0.480992328935257
Energy: 0.47712836859628
Energy: 0.47453168415342656
Energy: 0.47988778992510883
Energy: 0.474505258286224
Energy: 0.4793018159385887
Energy: 0.4743590238852298
Energy: 0.5044016861322073
Energy: 0.4797906720843355
Energy: 0.4787618877326854
Energy: 0.4791272746809058
Energy: 0.47423727967228935
Energy: 0.4800219557655416
Energy: 0.5066526137480812
Energy: 0.4806127774857852
Energy: 0.5021076248943623
Energy: 0.5185686476255364
Energy: 0.48136487375010906
Energy: 0.5091338504353513
Energy: 0.48120568614347053
Energy: 0.5032320093632334
Energy: 0.4829448968274239
Energy: 0.47945536712635795
Energy: 0.47440583992521557
Energy: 0.4808569923515357
Energy: 0.4823433881046293
Energy: 0.4798987832743103
Energy: 0.5036252926025433
Energy: 0.47442904723249
Energy: 0.48098930981523436
Energy: 0.475363088221329
Energy: 0.5256593366480592
Energy: 0.5029469496671133

minimum gb energy = 0.4736345938627848 eV
minimum distance =  2.62217172901675 Angstroms
sigma value = 15


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

Energy: 0.9472795381200726
Energy: 0.5302388961585662
Energy: 0.5299510180385981
Energy: 0.4989972022453399
Energy: 0.500773766492731
Energy: 0.4915759339971058
Energy: 0.5266054366637561
Energy: 0.5302967580061488
Energy: 0.5118603918874821
Energy: 0.5454164539175566
Energy: 0.4945094978038831
Energy: 0.5287410644937616
Energy: 0.5228252501174188
Energy: 0.5237267340578169
Energy: 0.5192769122338331
Energy: 0.48149317625042526
Energy: 0.5284193775529734
Energy: 0.5224971150821733
Energy: 0.5262394360440961
Energy: 0.5073386270124149
Energy: 0.5449759792577121
Energy: 0.508775339445612
Energy: 0.5268149437068731
Energy: 0.5209529729496366
Energy: 0.5711295894841606
Energy: 0.5488301816942468
Energy: 0.5288661562476721
Energy: 0.5273500462702481
Energy: 0.5173340579215414
Energy: 0.5588964999923791
Energy: 0.5201948942114255
Energy: 0.49442946350029643
Energy: 0.5344640009271641
Energy: 0.5692388277050533
Energy: 0.5598530354557499
Energy: 0.5225507609144242
Energy: 0.4960270180805785
Energy: 0.5347660949105864
Energy: 0.5576020092393866
Energy: 0.559083555857596
Energy: 0.5680816838114153
Energy: 0.5336050564123792
Energy: 0.49896633638156523
Energy: 0.4960261069313466
Energy: 0.49274562386404525
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Energy: 0.5335529782652885
Energy: 0.5085767192174396
Energy: 0.49345238726573615
Energy: 0.5574225587631805
Energy: 0.5437650664443615
Energy: 0.49286311840082064
Energy: 0.4931892624626497
Energy: 0.561570454532985
Energy: 0.5826497542711573
Energy: 0.5328231911202388
Energy: 0.49618142075197036
Energy: 0.4933254952680113
Energy: 0.5715599189917837
Energy: 0.5840302536505991
Energy: 0.49678665042005604
Energy: 0.4937730446892216
Energy: 0.4997868058317555
Energy: 0.5096679971783005
Energy: 0.5332232602771124
Energy: 0.4957282095952522
Energy: 0.4929612737583829
Energy: 0.4994325727989357
Energy: 0.4968715637637983
Energy: 0.5286549387876346
Energy: 0.4973897115392554
Energy: 0.49528761730507587
Energy: 0.49896047934894405
Energy: 0.5087664997258318
Energy: 0.527174039958478
Energy: 0.49678834184975507
Energy: 0.4930195728597941
Energy: 0.5187903597286777
Energy: 0.5089534803360044
Energy: 0.5262089768427555
Energy: 0.49218521795455267
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Energy: 0.5381228689138735
Energy: 0.5194103284677901
Energy: 0.5061304816546257
Energy: 0.4919158276385324
Energy: 0.5821157032310714
Energy: 0.5413190380039635
Energy: 0.5439023557921773
Energy: 0.499425593999031
Energy: 0.5365500036362633
Energy: 0.5254592410230062
Energy: 0.49313720498099534
Energy: 0.5017498429436482
Energy: 0.5068981580272531
Energy: 0.526041149730528
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Energy: 0.4930433640299265
Energy: 0.5019013413680681
Energy: 0.5035596308026351
Energy: 0.5029796865921263
Energy: 0.531209121403309
Energy: 0.49918240765117877
Energy: 0.5032085953581275
Energy: 0.5009158945690616
Energy: 0.5262914139855256
Energy: 0.519030854012875
Energy: 0.5011093104848333
Energy: 0.5040838731853846
Energy: 0.4920669271998422
Energy: 0.5873839260688247
Energy: 0.5578791887963709
Energy: 0.5019283237995756
Energy: 0.4850979990820912
Energy: 0.5347247308596855
Energy: 0.5806796006375811
Energy: 0.5323764879902065
Energy: 0.5012039160513839
Energy: 0.48617908572168367
Energy: 0.5346575676586898
Energy: 0.5344094784274672
Energy: 0.5030242581345687
Energy: 0.5466186182533127
Energy: 0.49470798377630604
Energy: 0.5339569681800546
Energy: 0.5274293310342737
Energy: 0.5249450218068162
Energy: 0.5459667912560111
Energy: 0.5017650040945064
Energy: 0.5183260724444662
Energy: 0.5295676775072369
Energy: 0.537093921428484
Energy: 0.542910024388746
Energy: 0.5372797828976594
Energy: 0.5240629539912799
Energy: 0.5247633205852349
Energy: 0.5345247580671093
Energy: 0.48098400602621333
Energy: 0.5363496918363025
Energy: 0.5218424499203774
Energy: 0.5028238018990164
Energy: 0.5263056184540997
Energy: 0.5670579418808138
Energy: 0.55194197147544
Energy: 0.5337571171952975
Energy: 0.5027392332624956
Energy: 0.5291369516846988
Energy: 0.5668986856739744
Energy: 0.516222173963911
Energy: 0.5371069671780581
Energy: 0.5753535979150373
Energy: 0.5648488704014589
Energy: 0.5342038066600511
Energy: 0.5169071368478563
Energy: 0.5042969169250181
Energy: 0.5737330824042285
Energy: 0.565203683553495
Energy: 0.534400036555279
Energy: 0.5174109207456064
Energy: 0.5033158296849481
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Energy: 0.5026286294263884
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Energy: 0.49469850976565233
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Energy: 0.5213948751167079
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Energy: 0.5008772353889841
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Energy: 0.5043937512640826
Energy: 0.5231183326429255
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Energy: 0.49885719369325526
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Energy: 0.5015372449527992
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Energy: 0.5365811997716943
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Energy: 0.5411859670384525
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Energy: 0.48476715072713034
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Energy: 0.5259564996741876
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Energy: 0.5163208296686451
Energy: 0.5627233994294767
Energy: 0.5152331379196985
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Energy: 0.5752390203548304
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Energy: 0.5848117745062389
Energy: 0.5312914713134725
Energy: 0.49319865758206916
Energy: 0.5787381088651806
Energy: 0.5701572197231409
Energy: 0.5835815812414067
Energy: 0.5222098199204958
Energy: 0.4932724621759687
Energy: 0.49487331978959886
Energy: 0.562107094224522
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Energy: 0.4965486702112625
Energy: 0.4989818684904093
Energy: 0.494767375587999
Energy: 0.5797623868279662
Energy: 0.4952596793062529
Energy: 0.4974118008692111
Energy: 0.5007238588142069
Energy: 0.5060289233787374
Energy: 0.528495129100692
Energy: 0.5402462142761096
Energy: 0.49574288640724884
Energy: 0.49299057840365523
Energy: 0.48407899824096384
Energy: 0.5333448469899256
Energy: 0.5266357576611956
Energy: 0.4929159155600759
Energy: 0.4932900221495865
Energy: 0.543672567819748
Energy: 0.5065179712093818
Energy: 0.49607534449556334
Energy: 0.5283031015293226
Energy: 0.5209407381396766
Energy: 0.5447706259418147
Energy: 0.5016710518608648
Energy: 0.48773615766276757
Energy: 0.5389806713944533
Energy: 0.5387810372300963
Energy: 0.4943426707988121
Energy: 0.494325356598484
Energy: 0.5101037234672223
Energy: 0.5808969650935186
Energy: 0.4911113493691084
Energy: 0.4813718409416581
Energy: 0.49689792942579336
Energy: 0.5349735116709154
Energy: 0.5819549648207145
Energy: 0.4912284375419242
Energy: 0.5039160252746707
Energy: 0.49846590491533715
Energy: 0.4942744286444781
Energy: 0.5545800057588149
Energy: 0.5045759983405893
Energy: 0.5009363955883906
Energy: 0.49872003426263806
Energy: 0.5122292808176571
Energy: 0.5435963337554363
Energy: 0.5006898633029372
Energy: 0.49555040121939226
Energy: 0.4852497795395533
Energy: 0.5793780551723604
Energy: 0.5742886559914184
Energy: 0.5718140800183298
Energy: 0.4952777557643311
Energy: 0.5084161381419118
Energy: 0.5794975246544589
Energy: 0.5280132492022901
Energy: 0.511656719008124
Energy: 0.5308112994689743
Energy: 0.5451690055885253
Energy: 0.5263631986687431
Energy: 0.49945883297936156
Energy: 0.4788116133546049
Energy: 0.5037019133601652
Energy: 0.5268589040081797
Energy: 0.526452918218027
Energy: 0.5168047844920746
Energy: 0.48487232278733106

minimum gb energy = 0.4740460238109303 eV
minimum distance =  2.59540460400019 Angstroms
sigma value = 437


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

Energy: 0.6743241727057224
Energy: 0.5180179888232808
Energy: 0.5351596472656132
Energy: 0.5284586969415691
Energy: 0.5042835351365176
Energy: 0.5739913647735992
Energy: 0.4870598161910651
Energy: 0.5296954241271867
Energy: 0.4732402699292914
Energy: 0.5463583546018304
Energy: 0.5080230052142409
Energy: 0.5578981232905313
Energy: 0.5389604995860279
Energy: 0.5441625698297754
Energy: 0.478103171606854
Energy: 0.5092159971020158
Energy: 0.5154712423096593
Energy: 0.5411663900548345
Energy: 0.5681892636201187
Energy: 0.4778442426885014
Energy: 0.5083516128159955
Energy: 0.5150334490704445
Energy: 0.5111602511784875
Energy: 0.48029461459951
Energy: 0.5075102803562845
Energy: 0.5082785690207026
Energy: 0.5159366907410371
Energy: 0.5115453590581833
Energy: 0.47988375654879906
Energy: 0.5080015093490485
Energy: 0.47932952995056094
Energy: 0.4800363680177641
Energy: 0.5109549050025052
Energy: 0.5074194394602515
Energy: 0.5089669206695311
Energy: 0.48089528335122567
Energy: 0.48086453090532205
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Energy: 0.506993140436829
Energy: 0.5098764834159458
Energy: 0.48309404951628465
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Energy: 0.48362260548615105
Energy: 0.5159056182528944
Energy: 0.4837264569337049
Energy: 0.485325107790278
Energy: 0.47848550892796343
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Energy: 0.47829611796920596
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Energy: 0.507974886585496
Energy: 0.6748220919899679
Energy: 0.5121220736091382
Energy: 0.5057430092978078
Energy: 0.5053392083819075
Energy: 0.47906889412603604
Energy: 0.5130416205139675
Energy: 0.5110827465486328
Energy: 0.5050497757654026
Energy: 0.505166164116643
Energy: 0.48004875682879466
Energy: 0.5131796949290677
Energy: 0.5168912545195974
Energy: 0.5112152478832017
Energy: 0.47722932433785137
Energy: 0.4800433597610838
Energy: 0.5680201036113217
Energy: 0.5169907683194582
Energy: 0.5057390347365657
Energy: 0.4779539237562822
Energy: 0.4800739590033916
Energy: 0.5123896872132443
Energy: 0.47844338621849486
Energy: 0.507900321637926
Energy: 0.4660360767506082
Energy: 0.5112227114207343
Energy: 0.478966709550927
Energy: 0.47760414971205145
Energy: 0.5083588184113456
Energy: 0.48414785924605125
Energy: 0.5117340138109935
Energy: 0.47847232752154045
Energy: 0.4695254601407008
Energy: 0.4834847854295385
Energy: 0.47399904867562
Energy: 0.4752885564456904
Energy: 0.517270454352068
Energy: 0.5085579512817776
Energy: 0.4829499026047963
Energy: 0.47448459094425444
Energy: 0.4754029160288296
Energy: 0.5157339787836875
Energy: 0.46748161077017486
Energy: 0.4656326841242728
Energy: 0.5530400035974447
Energy: 0.48198643840463407
Energy: 0.4665996175872091
Energy: 0.4676641889690938
Energy: 0.46566395895644697
Energy: 0.5547058556735133
Energy: 0.4769170136642836
Energy: 0.4807601787602638
Energy: 0.4727190980405115
Energy: 0.46967140299908566
Energy: 0.4700096051013613
Energy: 0.5032933688027381
Energy: 0.4693645858031704
Energy: 0.46787917904785986
Energy: 0.4700051969456611
Energy: 0.4704952991717098
Energy: 0.488217102337452
Energy: 0.4680300203188806
Energy: 0.46750459075035544
Energy: 0.469324609111822
Energy: 0.5410610717157165
Energy: 0.5684760040847028
Energy: 0.46938974124972277
Energy: 0.4683033806066043
Energy: 0.4694595398358979
Energy: 0.5414190133552588
Energy: 0.5676380671498488
Energy: 0.4684090121551289
Energy: 0.48671042906141
Energy: 0.4694033929631213
Energy: 0.5037446689682021
Energy: 0.47866186694672935
Energy: 0.4732451306489923
Energy: 0.5459603198508811
Energy: 0.4702982196493159
Energy: 0.5360767544219345
Energy: 0.47687817073443467
Energy: 0.48609248021338275

minimum gb energy = 0.4656326841242728 eV
minimum distance =  2.68817498182461 Angstroms
sigma value = 33