Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_CuAgAu__MO_318213562153_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ag
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.089642539620402
cohesive_energy=2.8502237652528515
mass=107.8682
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[8.78438200536252e-20, 1.387832637373578e-19, 1.7995007082434398e-19, 2.1466763630649e-19, 2.45753067359358e-19, 2.74198111319394e-19, 2.99905035411924e-19, 3.22771300332372e-19, 3.4296673680394193e-19, 3.6076211267778e-19, 3.7642338927513e-19, 3.90176473501386e-19, 4.0221362655262796e-19, 4.1270307697542594e-19, 4.21790622843474e-19, 4.29609244817394e-19, 4.362759017914679e-19, 4.41886724363736e-19, 4.46520219189264e-19, 4.502340646268759e-19, 4.53068315092422e-19, 4.550598206484839e-19, 4.562342161212059e-19, 4.5662034069e-19, 4.562037747651599e-19, 4.54859548569234e-19, 4.52443466205162e-19, 4.4877768606657e-19, 4.435113314706119e-19, 4.36309547500782e-19, 4.26794220471456e-19, 4.1452955833818596e-19, 3.9899004716502e-19, 3.7954603153479592e-19, 3.5541725142675597e-19, 3.2562157256425796e-19, 2.88893275406442e-19, 2.43559687547412e-19, 1.87380966052836e-19, 1.173568749578856e-19, 2.94713983117764e-20, -8.16592580287218e-20, -2.23381875018816e-19, -4.06070065710666e-19, -6.449241604840199e-19, -9.62582915177298e-19, -1.3925991128597279e-18, -1.98612224257176e-18, -2.82643184357208e-18, -4.05696758554944e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.008588670155428082
Energy: 0.25370839020107855
Energy: 0.008951403250782744
Energy: 0.008777826059696844
Energy: 0.2538626184974326
Energy: 0.008936340764842864
Energy: 0.25370839020179997
Energy: 0.06597652206532909
Energy: 0.06616663285139233
Energy: 0.06599639403110427
Energy: 0.06627999901169461
Energy: 0.0661258294685065
Energy: 0.008951403250537705
Energy: 0.06616663285116091
Energy: 0.06605933884769276
Energy: 0.008965239800275105
Energy: 0.06615593267919408
Energy: 0.06631517279903282
Energy: 0.008777826060173305
Energy: 0.06599639403159435
Energy: 0.008965239800275105
Energy: 0.008908448888195652
Energy: 0.0661563437334221
Energy: 0.008962710045995264
Energy: 0.2538626184971876
Energy: 0.06627999901144957
Energy: 0.0661559326779961
Energy: 0.0661563437334221
Energy: 0.06622243412071935
Energy: 0.0662285975467216
Energy: 0.008936340765809401
Energy: 0.06612582946658703
Energy: 0.06631517279855635
Energy: 0.00896271004648534
Energy: 0.06622859754647657
Energy: 0.009011989160191651

minimum gb energy = 0.008588670155428082 eV
minimum distance =  2.88699589201995 Angstroms
sigma value = 1


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

Energy: 0.801550168381271
Energy: 0.5110925137655531
Energy: 0.5099674153559562
Energy: 0.47659423866313616
Energy: 0.5007830632202017
Energy: 0.5095739117966525
Energy: 0.7122929949807852
Energy: 0.4651099731539067
Energy: 0.4693501013635841
Energy: 0.4683615554148211
Energy: 0.47723783727630803
Energy: 0.47686337371856174
Energy: 0.7240912404552703
Energy: 0.47877313502056906
Energy: 0.4653268757502403
Energy: 0.4742364348323854
Energy: 0.47010422328778984
Energy: 0.4760433090676359
Energy: 0.7737132276041085
Energy: 0.4712887537513985
Energy: 0.46535155275958406
Energy: 0.4935053680412646
Energy: 0.4711483398490783
Energy: 0.465463247804331
Energy: 0.7124099063649327
Energy: 0.4856031560658174
Energy: 0.48731328709916055
Energy: 0.4742908168458206
Energy: 0.47245909256113655
Energy: 0.47593554869469784
Energy: 0.7083182602823065
Energy: 0.4939596055645765
Energy: 0.4933093820242667
Energy: 0.47449298427847053
Energy: 0.472892469010586
Energy: 0.4745061394039092
Energy: 0.7099243489989596
Energy: 0.4813305952968924
Energy: 0.4768824076510521
Energy: 0.47446711801488917
Energy: 0.4718889925503062
Energy: 0.4755945871683024
Energy: 0.6164091001700219
Energy: 0.47669420227103676
Energy: 0.48059703322899733
Energy: 0.4521850409118315
Energy: 0.47337507831036607
Energy: 0.48141011410340034
Energy: 0.5862189518405417
Energy: 0.4744453333963561
Energy: 0.4738923008956474
Energy: 0.47266986053173615
Energy: 0.47453185932687736
Energy: 0.47417954613373703
Energy: 0.5833343138783345
Energy: 0.4756908419130364
Energy: 0.4753686807550801
Energy: 0.47068175607119506
Energy: 0.47605118376753025
Energy: 0.48532442556135874
Energy: 0.5788186699898038
Energy: 0.472009160617632
Energy: 0.46182113884886644
Energy: 0.5068112061658152
Energy: 0.47735014339211296
Energy: 0.4789057730919467
Energy: 0.5225587061486648
Energy: 0.4791440164165991
Energy: 0.4764253968345319
Energy: 0.4782229275117653
Energy: 0.4713506853269813
Energy: 0.47582703639503
Energy: 0.5222636432343394
Energy: 0.4767851713633651
Energy: 0.47696347206293094
Energy: 0.4818372765745068
Energy: 0.48653714232580003
Energy: 0.47902259637101163
Energy: 0.5677922709265382
Energy: 0.4716854295305278
Energy: 0.46425990613696344
Energy: 0.4788443334030332
Energy: 0.4726141763440044
Energy: 0.4705957513479718
Energy: 0.5428216117193404
Energy: 0.47466586440357816
Energy: 0.4754854989947178
Energy: 0.4771210540786042
Energy: 0.47472991171746476
Energy: 0.4781316977111188
Energy: 0.5434258349884615
Energy: 0.4711975329017056
Energy: 0.47082614782455906
Energy: 0.4784462550922036
Energy: 0.4749847531286007
Energy: 0.4789779833678467
Energy: 0.6480340509177082
Energy: 0.47350715093862616
Energy: 0.475990030839522
Energy: 0.47053896389397487
Energy: 0.4739701742458356
Energy: 0.47598637353724477
Energy: 0.6473922332413763
Energy: 0.47534483697295565
Energy: 0.4774783813487951
Energy: 0.4764942102380701
Energy: 0.47482827345617934
Energy: 0.4830898013370727
Energy: 0.6475436418284514
Energy: 0.482528173344035
Energy: 0.4762939634614781
Energy: 0.4741898902425306
Energy: 0.47670208747806053
Energy: 0.48308498610167017
Energy: 0.6862634837078507
Energy: 0.4776002562133253
Energy: 0.4752487653193903
Energy: 0.4750286056084667
Energy: 0.4753142225415772
Energy: 0.4753198310794664
Energy: 0.735532349021779
Energy: 0.46674601350883155
Energy: 0.4630844421871619
Energy: 0.47710089536688294
Energy: 0.4664996864221409
Energy: 0.4667814984301909
Energy: 0.7364116957930621
Energy: 0.4910327572353357
Energy: 0.47273860914400806
Energy: 0.47017931894914866
Energy: 0.48162123122352685
Energy: 0.47086413901537766
Energy: 0.7345210682243577
Energy: 0.46532944178041274
Energy: 0.46518700820538256
Energy: 0.4781089811601746
Energy: 0.4774523982769538
Energy: 0.4762301635648601

minimum gb energy = 0.4521850409118315 eV
minimum distance =  2.71729096595644 Angstroms
sigma value = 33


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

Energy: 0.9230969740175026
Energy: 0.5077640188633442
Energy: 0.524704567957022
Energy: 0.5267668457556717
Energy: 0.5109737007070241
Energy: 0.551459544460361
Energy: 0.6959259335793184
Energy: 0.48697996496052665
Energy: 0.4695307211749047
Energy: 0.4770699091981329
Energy: 0.49691718170535426
Energy: 0.468774305588437
Energy: 0.690502610982619
Energy: 0.4830000961278174
Energy: 0.4875805373758194
Energy: 0.49292799045851043
Energy: 0.47864028811131526
Energy: 0.4863953980499515
Energy: 0.7301704891252305
Energy: 0.5287460316857715
Energy: 0.48220992017780456
Energy: 0.5009913866252166
Energy: 0.5011767902960941
Energy: 0.48675723151412903
Energy: 0.6990029928896965
Energy: 0.47664288622299317
Energy: 0.4765369106414306
Energy: 0.4681416107041683
Energy: 0.4875934962861924
Energy: 0.48118075376048774
Energy: 0.741300285815995
Energy: 0.4953435425799369
Energy: 0.5022960778889575
Energy: 0.48091454897505415
Energy: 0.5064066501086409
Energy: 0.5051981456231248
Energy: 0.7402637566371083
Energy: 0.5379891997378353
Energy: 0.5227014368393865
Energy: 0.4891666641549884
Energy: 0.5385128576258086
Energy: 0.5274623618171775
Energy: 0.6992842441158157
Energy: 0.5264044689962671
Energy: 0.48576837901324577
Energy: 0.4772059072853355
Energy: 0.4945721339817171
Energy: 0.4861351473558969
Energy: 0.6184760502271319
Energy: 0.49464974852418364
Energy: 0.5288738653509432
Energy: 0.5304064890012201
Energy: 0.4952936362881454
Energy: 0.5301734863904864
Energy: 0.6158159934047724
Energy: 0.5239931301615138
Energy: 0.5500919645611019
Energy: 0.5335640874473455
Energy: 0.5218811471211614
Energy: 0.5174762739833023
Energy: 0.6253610833531296
Energy: 0.4929635144018094
Energy: 0.49292998388300663
Energy: 0.5086586425166146
Energy: 0.457906447227967
Energy: 0.4930544376834789
Energy: 0.5690082043766538
Energy: 0.4589374939493775
Energy: 0.5271452707817893
Energy: 0.5488688052229259
Energy: 0.476726041052093
Energy: 0.5198714588032077
Energy: 0.5713789257703754
Energy: 0.5287914966929965
Energy: 0.5297978625174873
Energy: 0.550405700197468
Energy: 0.5278584603901109
Energy: 0.5190956419783548
Energy: 0.5743532946715647
Energy: 0.48695296479342237
Energy: 0.5063164259989541
Energy: 0.5630817144135482
Energy: 0.4863748218730007
Energy: 0.5062785040836238
Energy: 0.6080416880273765
Energy: 0.5323929881400122
Energy: 0.5286119197119117
Energy: 0.5436663432060982
Energy: 0.5191461795460549
Energy: 0.5269367548358525
Energy: 0.6092684529770226
Energy: 0.5333809993876943
Energy: 0.5503784598422246
Energy: 0.5447374988876337
Energy: 0.5334644656746717
Energy: 0.5541750965609159
Energy: 0.6993333165346647
Energy: 0.544513174125213
Energy: 0.5465860102074183
Energy: 0.5389634129392025
Energy: 0.5512483922829333
Energy: 0.5470090031293547
Energy: 0.654665234168878
Energy: 0.5114087252780499
Energy: 0.5115168889983098
Energy: 0.4952013441289509
Energy: 0.5121212129365975
Energy: 0.5267194415487434
Energy: 0.6482627677184386
Energy: 0.5335997004843521
Energy: 0.5470793578277996
Energy: 0.4953973878263563
Energy: 0.5324273079583233
Energy: 0.5349372741963527
Energy: 0.7163223630217749
Energy: 0.5267299519087458
Energy: 0.5220410252419628
Energy: 0.5235963208473261
Energy: 0.5328534660452137
Energy: 0.5504060231340943
Energy: 0.7845651673877845
Energy: 0.5545436934745721
Energy: 0.49277616084962034
Energy: 0.45770969883730805
Energy: 0.5545926664731525
Energy: 0.492662540081497
Energy: 0.6192572857904445
Energy: 0.5437471620411686
Energy: 0.5356558076394161
Energy: 0.48438848757729935
Energy: 0.5490828718434835
Energy: 0.5320054188969046
Energy: 0.6820773743828568
Energy: 0.5212048267149327
Energy: 0.5207854366978611
Energy: 0.5323049439913491
Energy: 0.5484008091063338
Energy: 0.5219213353065385
Energy: 0.7308322851267576
Energy: 0.5559668860680387
Energy: 0.5656862171564383
Energy: 0.5065879389964754
Energy: 0.5564126178700857
Energy: 0.5183920348559519
Energy: 0.6835411589047751
Energy: 0.5257342179085878
Energy: 0.5255461081657888
Energy: 0.5342696096942623
Energy: 0.5407668601641284
Energy: 0.5309768672563736
Energy: 0.7434463609476636
Energy: 0.5521274526094102
Energy: 0.5488568491964629
Energy: 0.5344605838681095
Energy: 0.5523635215738472
Energy: 0.5325954432409815
Energy: 0.7398132743738732
Energy: 0.5349230189113269
Energy: 0.5419606685247169
Energy: 0.5296517301605514
Energy: 0.5389062462805938
Energy: 0.5461776588445992
Energy: 0.6992827838996216
Energy: 0.49593814117669954
Energy: 0.5274554137427099
Energy: 0.5210895098677313
Energy: 0.49456247421243227
Energy: 0.517700970134401
Energy: 0.6175096632558249
Energy: 0.4958836988202985
Energy: 0.527338292079873
Energy: 0.5314870873478807
Energy: 0.4951106207893767
Energy: 0.5298545796399646
Energy: 0.6169032012305404
Energy: 0.531987732160276
Energy: 0.5296311487881581
Energy: 0.5326023740456902
Energy: 0.5217534633108828
Energy: 0.5409928691967192
Energy: 0.6166936939608155
Energy: 0.48751845785553166
Energy: 0.4925350104091856
Energy: 0.5379851706001114
Energy: 0.45735916776599495
Energy: 0.4924967215578909
Energy: 0.5715002899832586
Energy: 0.458270109800463
Energy: 0.4581461160623649
Energy: 0.5506525326337192
Energy: 0.4594561402461606
Energy: 0.5449759754192494
Energy: 0.5697712731984235
Energy: 0.5287520133907031
Energy: 0.517650393525853
Energy: 0.5488038749178613
Energy: 0.5278068472840755
Energy: 0.5161519356478154
Energy: 0.5726311940263544
Energy: 0.5059597021044836
Energy: 0.5057240564496609
Energy: 0.5479741104497926
Energy: 0.5061988539538932
Energy: 0.5054972344326163
Energy: 0.6067423174584613
Energy: 0.5290859054775117
Energy: 0.5304929382710674
Energy: 0.4917906439573822
Energy: 0.5316639882587847
Energy: 0.5268607627562611
Energy: 0.6071851187857552
Energy: 0.48719125894717663
Energy: 0.5297075064428475
Energy: 0.5538952539392913
Energy: 0.5327897514964754
Energy: 0.48285224101721497
Energy: 0.6071604495384741
Energy: 0.4892817495514853
Energy: 0.48920066535896994
Energy: 0.4976202463706317
Energy: 0.48156407418524877
Energy: 0.4951404721371441
Energy: 0.6606994074932585
Energy: 0.4797225852976132
Energy: 0.5002230023016541
Energy: 0.4950582833725527
Energy: 0.4789395235909505
Energy: 0.4848509344638893
Energy: 0.6531599397443553
Energy: 0.4789162847290128
Energy: 0.47907593891762373
Energy: 0.4955958911174668
Energy: 0.4858004455669825
Energy: 0.48667381228222517
Energy: 0.6990310805891469
Energy: 0.5008730507131656
Energy: 0.4850307572593032
Energy: 0.4805019948703484
Energy: 0.4791498377582721
Energy: 0.4826227418552101
Energy: 0.8190033148095767
Energy: 0.5117689104385347
Energy: 0.4925872483809447
Energy: 0.45722723434523127
Energy: 0.4909534134764675
Energy: 0.5177141382126348

minimum gb energy = 0.45722723434523127 eV
minimum distance =  2.64401618740452 Angstroms
sigma value = 51


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

Energy: 0.833467401929862
Energy: 0.5112900851043819
Energy: 0.4863335589697361
Energy: 0.5496712286538813
Energy: 0.5110790234200978
Energy: 0.5495873228997764
Energy: 0.6325483326374443
Energy: 0.5012887997003681
Energy: 0.4872494594605435
Energy: 0.47445556316303406
Energy: 0.5008383918160881
Energy: 0.48748758680546195
Energy: 0.7279552464354754
Energy: 0.5008537138247322
Energy: 0.4945104624882462
Energy: 0.5030902722368558
Energy: 0.5018345448108106
Energy: 0.5140669895284615
Energy: 0.7275546469127491
Energy: 0.5027231821366823
Energy: 0.49828660441509154
Energy: 0.5053659581584751
Energy: 0.5022821748953457
Energy: 0.49424751537257144
Energy: 0.6330522479812093
Energy: 0.5056035144020872
Energy: 0.5154278945381131
Energy: 0.4743952250589817
Energy: 0.511501405629373
Energy: 0.5155248297561328
Energy: 0.6322772026617557
Energy: 0.5156804753149935
Energy: 0.5150569002899502
Energy: 0.5114883260220057
Energy: 0.506487642734389
Energy: 0.514675094715911
Energy: 0.6324280267277856
Energy: 0.5056059748214692
Energy: 0.5162378920040486
Energy: 0.5133531671406428
Energy: 0.47440389783765163
Energy: 0.5154172009372361
Energy: 0.626571494382727
Energy: 0.4960749229515314
Energy: 0.50037197066742
Energy: 0.49171601600220377
Energy: 0.4960174617810489
Energy: 0.5001851757750057
Energy: 0.5358008221048104
Energy: 0.49691129526024747
Energy: 0.5005028607792521
Energy: 0.49432295647195407
Energy: 0.49025549214083747
Energy: 0.5111825457830004
Energy: 0.5357170110401004
Energy: 0.475270353833719
Energy: 0.5002882587463048
Energy: 0.5008032299700232
Energy: 0.4752280488360347
Energy: 0.4865509522787504
Energy: 0.5361064923157307
Energy: 0.4817888703758011
Energy: 0.48268661301305893
Energy: 0.5116739171222182
Energy: 0.4823827036531198
Energy: 0.49262853065056994
Energy: 0.5608568839221845
Energy: 0.47540836343451637
Energy: 0.49535920166893516
Energy: 0.5016616134572707
Energy: 0.5019559963940515
Energy: 0.5049590389648827
Energy: 0.559895347325416
Energy: 0.5056918605961677
Energy: 0.5073241586319766
Energy: 0.5118585918791052
Energy: 0.5055357834470995
Energy: 0.5112189917968782
Energy: 0.5608563053662647
Energy: 0.46758907326303784
Energy: 0.4836715347801172
Energy: 0.494996194712559
Energy: 0.49518354096603623
Energy: 0.484542801130794
Energy: 0.6765383681168274
Energy: 0.5082667604642805
Energy: 0.5057730586262622
Energy: 0.5107620421135416
Energy: 0.49204487031927846
Energy: 0.5058303285306239
Energy: 0.6766521399364457
Energy: 0.5022841753392713
Energy: 0.4961704860206037
Energy: 0.5111921084532596
Energy: 0.5018930832389409
Energy: 0.47844841272463584
Energy: 0.6799269661125702
Energy: 0.4951941588393255
Energy: 0.5117509042369469
Energy: 0.5071201421418334
Energy: 0.501764479648557
Energy: 0.503736810970772
Energy: 0.779142525192634
Energy: 0.49575638475634
Energy: 0.48656941877211485
Energy: 0.49508007860843073
Energy: 0.48784677156518325
Energy: 0.5141087088385093

minimum gb energy = 0.46758907326303784 eV
minimum distance =  2.66729788591301 Angstroms
sigma value = 19


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

Energy: 0.7538379037322495
Energy: 0.4853038345785838
Energy: 0.4774556800272828
Energy: 0.5435097794952586
Energy: 0.48711047733875246
Energy: 0.5284380510677787
Energy: 0.6941451952306188
Energy: 0.4872584472312936
Energy: 0.48785269897100625
Energy: 0.4951619146573288
Energy: 0.48930303816988296
Energy: 0.48613802719492744
Energy: 0.7929370923689072
Energy: 0.48853609937247844
Energy: 0.49121485026826617
Energy: 0.5116991522754492
Energy: 0.49630982255210304
Energy: 0.48620808289242584
Energy: 0.6244517174000915
Energy: 0.5486232976962693
Energy: 0.49570063567281386
Energy: 0.5166838838479074
Energy: 0.49143240205030064
Energy: 0.5448048840847936
Energy: 0.6674239336901955
Energy: 0.5060310134400918
Energy: 0.4784921110046266
Energy: 0.5138094489554633
Energy: 0.49098854597528424
Energy: 0.5044413535950618
Energy: 0.6655723061650806
Energy: 0.4950388871685621
Energy: 0.5651253733100211
Energy: 0.5669498377821917
Energy: 0.4945068222523143
Energy: 0.5634010022098164
Energy: 0.6660794720257995
Energy: 0.4862727581319958
Energy: 0.5698139213089554
Energy: 0.5643797356013112
Energy: 0.48754416405998624
Energy: 0.5680082929300247
Energy: 0.6293301744060693
Energy: 0.4570595814652266
Energy: 0.4568959796103057
Energy: 0.5010624765770928
Energy: 0.459278491315265
Energy: 0.4585573104790571
Energy: 0.5677609647898264
Energy: 0.4582672545256724
Energy: 0.45808299152995796
Energy: 0.5557068531560436
Energy: 0.4589307426120508
Energy: 0.4579280977528004
Energy: 0.5675093881265559
Energy: 0.5528007354564946
Energy: 0.5529692189040691
Energy: 0.5614824198027832
Energy: 0.5675687126375251
Energy: 0.5576124146816721
Energy: 0.5697078619232477
Energy: 0.5169928512438636
Energy: 0.5172076633169884
Energy: 0.5603330038538589
Energy: 0.5170957413489945
Energy: 0.5597704264361159
Energy: 0.6158944220361443
Energy: 0.5639017178257285
Energy: 0.5640799950119587
Energy: 0.5604090839535917
Energy: 0.5628508009857591
Energy: 0.5598541070313449
Energy: 0.5144932079632697
Energy: 0.5716760852183316
Energy: 0.5714840673966546
Energy: 0.4966087734107126
Energy: 0.5718965783681914
Energy: 0.5716168987111861
Energy: 0.6162935887523489
Energy: 0.5716375760099033
Energy: 0.5720712310605314
Energy: 0.5597533814198966
Energy: 0.5710402697935683
Energy: 0.573406019349433
Energy: 0.7039697448942929
Energy: 0.5510942756356516
Energy: 0.5509888901162531
Energy: 0.4584939128700072
Energy: 0.5549851572896791
Energy: 0.45791821172243935
Energy: 0.7006092483276194
Energy: 0.5688699070723501
Energy: 0.45737983223126505
Energy: 0.45899159744193607
Energy: 0.5810781932611019
Energy: 0.4593494138612675
Energy: 0.7511999840888113
Energy: 0.5642894175402056
Energy: 0.5544210628833754
Energy: 0.5757611285817044
Energy: 0.5637755338147716
Energy: 0.5553861014594383
Energy: 0.6223700590453242
Energy: 0.5629973739828872
Energy: 0.5592797625383141
Energy: 0.5170436600375181
Energy: 0.5635422272976118
Energy: 0.5517171738524156
Energy: 0.6224393124131694
Energy: 0.5551077776158259
Energy: 0.5503374272648011
Energy: 0.517889911000613
Energy: 0.5551170723048311
Energy: 0.5500267851968724
Energy: 0.6699678840796345
Energy: 0.4972532332056032
Energy: 0.5674303811512529
Energy: 0.556446499227306
Energy: 0.496998677391987
Energy: 0.5704198365805377
Energy: 0.6655333446579909
Energy: 0.5568126816839138
Energy: 0.5580182284917785
Energy: 0.5659683719675691
Energy: 0.5553070651898521
Energy: 0.5633923701450275
Energy: 0.6700871822230675
Energy: 0.5570989405182981
Energy: 0.5633592088611271
Energy: 0.5621838601212138
Energy: 0.555610808011528
Energy: 0.5631087089317578
Energy: 0.6132814107665083
Energy: 0.4574046280788863
Energy: 0.4574204079478235
Energy: 0.6261659310399676
Energy: 0.4572555978933968
Energy: 0.45751648223452346
Energy: 0.5644147521856466
Energy: 0.5051370979928115
Energy: 0.48090243125632925
Energy: 0.5618019972044369
Energy: 0.4821297566887311
Energy: 0.5504410278752634
Energy: 0.5645235434294295
Energy: 0.5079288658058294
Energy: 0.5494690206772442
Energy: 0.5561301180826445
Energy: 0.5112910253867043
Energy: 0.5544709427708806
Energy: 0.6309512538655114
Energy: 0.5168218994474283
Energy: 0.5169125336667661
Energy: 0.5180775423752477
Energy: 0.5167659001794898
Energy: 0.49491019463097574
Energy: 0.655629823154674
Energy: 0.5098068451944596
Energy: 0.5055568821176387
Energy: 0.49115002162325166
Energy: 0.50969409080936
Energy: 0.5103791732211305
Energy: 0.5147280245353391
Energy: 0.5052057142974787
Energy: 0.5121135434637001
Energy: 0.4940940316546353
Energy: 0.5074197009677122
Energy: 0.5028539239216566
Energy: 0.6570603127146207
Energy: 0.5054041811200086
Energy: 0.5100649058522465
Energy: 0.48146596771562816
Energy: 0.5114216300014772
Energy: 0.505164146339973
Energy: 0.7523862412552459
Energy: 0.4863685876599395
Energy: 0.4581207614983117
Energy: 0.45922781242391014
Energy: 0.48598633549629083
Energy: 0.49782039393620864

minimum gb energy = 0.4568959796103057 eV
minimum distance =  2.67668865055391 Angstroms
sigma value = 27


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

Energy: 0.5878268799192202
Energy: 0.466031795703867
Energy: 0.5236017700059283
Energy: 0.4694701452456746
Energy: 0.8736088168693935
Energy: 0.5218507731937662
Energy: 0.5804857404694923
Energy: 0.4884108959268139
Energy: 0.44292519899923005
Energy: 0.44504833710801056
Energy: 0.4881611581673514
Energy: 0.4223266836541472
Energy: 0.5288259996001753
Energy: 0.48543205543550366
Energy: 0.44386500985708804
Energy: 0.4228419105541396
Energy: 0.4856930907499575
Energy: 0.4428259763183006
Energy: 0.5284812849205603
Energy: 0.44684335882764376
Energy: 0.42232003951328634
Energy: 0.4223892734453077
Energy: 0.4630057674819706
Energy: 0.4226468024572607
Energy: 0.5814314443399902
Energy: 0.43876412767932294
Energy: 0.42261070514205396
Energy: 0.46380389655863835
Energy: 0.4210811795177733
Energy: 0.4226619123276969
Energy: 0.49535307186807215
Energy: 0.399399814498485
Energy: 0.39956435588212613
Energy: 0.48482008948952005
Energy: 0.3984860237247908
Energy: 0.4386374214485094
Energy: 0.4982684599596644
Energy: 0.4425218385810082
Energy: 0.4436346052108549
Energy: 0.4875144391006977
Energy: 0.44339199784080974
Energy: 0.44288538227207147
Energy: 0.497737307490738
Energy: 0.44190263689418297
Energy: 0.4418508259781577
Energy: 0.48724906547197516
Energy: 0.44213444060976936
Energy: 0.4402042935158088
Energy: 0.5288612777882833
Energy: 0.4426756321049447
Energy: 0.4391990975731954
Energy: 0.48857582493962587
Energy: 0.42097161970077557
Energy: 0.422314437055982
Energy: 0.46341552697154037
Energy: 0.44241825884411845
Energy: 0.44232296601577725
Energy: 0.4653273380069249
Energy: 0.45052406870366146
Energy: 0.44343874197458816
Energy: 0.529225193797737
Energy: 0.46327500786745096
Energy: 0.46328580426955374
Energy: 0.4590650282607771
Energy: 0.46385395336997726
Energy: 0.46369807342376385
Energy: 0.5203529844029801
Energy: 0.4429757449706948
Energy: 0.4425955582082213
Energy: 0.4447985616145553
Energy: 0.44320869340904595
Energy: 0.42251145979410454

minimum gb energy = 0.3984860237247908 eV
minimum distance =  2.75197501280881 Angstroms
sigma value = 9


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

Energy: 1.0048431739968873
Energy: 0.41283765097277636
Energy: 0.4042856274136429
Energy: 0.3881723753990021
Energy: 0.416865035656571
Energy: 0.41581497219964164
Energy: 0.4860038600767561
Energy: 0.41465863107973583
Energy: 0.38941686409675447
Energy: 0.40069191381167873
Energy: 0.41514605470891136
Energy: 0.40073453338464843
Energy: 0.4461768571632049
Energy: 0.4128104947937171
Energy: 0.4138323216902902
Energy: 0.41644546279039074
Energy: 0.42123679810937303
Energy: 0.40720840220710364
Energy: 0.44643463257421584
Energy: 0.3893183500329405
Energy: 0.38900960539092316
Energy: 0.4144016040105855
Energy: 0.41028257601868734
Energy: 0.38956199715817386
Energy: 0.4697217256254163
Energy: 0.4054701562980122
Energy: 0.3808728920782922
Energy: 0.4259517908404049
Energy: 0.40516916941944126
Energy: 0.4089970853023477
Energy: 0.4347713537629432
Energy: 0.3898094711163753
Energy: 0.40507575396386414
Energy: 0.43477630488117835
Energy: 0.4040985868440025
Energy: 0.39963114708297026
Energy: 0.43430532201650207
Energy: 0.3899242745668251
Energy: 0.3896323545891525
Energy: 0.4351062673156
Energy: 0.3918823972424607
Energy: 0.43497869803945866
Energy: 0.43496644601144546
Energy: 0.40396098548799764
Energy: 0.40312806855202
Energy: 0.435210521081397
Energy: 0.4060527081226545
Energy: 0.40401746328541294
Energy: 0.4267986907708333
Energy: 0.40946120108078193
Energy: 0.4131724687735748
Energy: 0.42606833576648007
Energy: 0.42112648803096264
Energy: 0.4085462138940807
Energy: 0.41563039786713074
Energy: 0.392144460753556
Energy: 0.3899735112632034
Energy: 0.41066150500206733
Energy: 0.4144883374611731
Energy: 0.38894975124148123
Energy: 0.41076656433008746
Energy: 0.42907633393327044
Energy: 0.40927103450602625
Energy: 0.4124944843516539
Energy: 0.4343387672619073
Energy: 0.40926222186047073
Energy: 0.4261088902316921
Energy: 0.4349481899643506
Energy: 0.4129129085807082
Energy: 0.3992499498541596
Energy: 0.4349287968727442
Energy: 0.38612678948895085
Energy: 0.6020855249775133
Energy: 0.4121033926462
Energy: 0.4038132929737219
Energy: 0.41496870318635254
Energy: 0.41964720959195523
Energy: 0.4099926934168378
Energy: 0.47919143492855787
Energy: 0.41963690306901763
Energy: 0.409289048421172
Energy: 0.3993630721882089
Energy: 0.43553459257067195
Energy: 0.4102346109245654
Energy: 0.42816698571144207
Energy: 0.40668809147649687
Energy: 0.40674557938721945
Energy: 0.42212650679139296
Energy: 0.4082690236887409
Energy: 0.4182998801430996
Energy: 0.4271271165033192
Energy: 0.3985862774264494
Energy: 0.4077907009374934
Energy: 0.4208144066731902
Energy: 0.4156714299387373
Energy: 0.40689270566744995
Energy: 0.4274409752164801
Energy: 0.38894314112451517
Energy: 0.38489306572661885
Energy: 0.4145428063471682
Energy: 0.3980850311070279
Energy: 0.40291038893489756
Energy: 0.46320011432525865
Energy: 0.4061741572620634
Energy: 0.40646541356349164
Energy: 0.4142342792725891
Energy: 0.4034174234884209
Energy: 0.3946098066818237
Energy: 0.44651873068582676
Energy: 0.4002346086968797
Energy: 0.4006817594553015
Energy: 0.4220682272454464
Energy: 0.39967700638212117
Energy: 0.40130500625851684
Energy: 0.4457800797091748
Energy: 0.4035363027226488
Energy: 0.39829627675664275
Energy: 0.4032826625787307
Energy: 0.4030156932947948
Energy: 0.39730492293960434
Energy: 0.44601478240285586
Energy: 0.39766543377252217
Energy: 0.4003444708525504
Energy: 0.41154584888186785
Energy: 0.40443665259275285
Energy: 0.404760514251308
Energy: 0.4654486077943742
Energy: 0.39972297583017974
Energy: 0.4088479911659768
Energy: 0.4056257847443352
Energy: 0.4145136522013648
Energy: 0.39833859224760076
Energy: 0.4633370981889341
Energy: 0.41488477115477046
Energy: 0.39621587780506307
Energy: 0.40530770398789767
Energy: 0.4150893657857072
Energy: 0.3870588319198367
Energy: 0.44611318655306126
Energy: 0.40375659689659477
Energy: 0.40576117988243354
Energy: 0.4124800312291479
Energy: 0.42190879793380703
Energy: 0.4084597136536591
Energy: 0.6105753704471063
Energy: 0.42442430489398275
Energy: 0.4106052504746356
Energy: 0.40506414076286545
Energy: 0.422338635630785
Energy: 0.4082419024795786
Energy: 0.4460125546914459
Energy: 0.3990906430095872
Energy: 0.3862207609448726
Energy: 0.42762394690420436
Energy: 0.39942944411358833
Energy: 0.41015152365656676
Energy: 0.41583570210671417
Energy: 0.3900990355005144
Energy: 0.39009772387303293
Energy: 0.40269568725970034
Energy: 0.3898117885168792
Energy: 0.40898245884529066
Energy: 0.4346970656429882
Energy: 0.3901025031884415
Energy: 0.3857713799421407
Energy: 0.43473890929581693
Energy: 0.3994368682120831
Energy: 0.38605857024493423
Energy: 0.43449726180833914
Energy: 0.4024053262728281
Energy: 0.4084990824591534
Energy: 0.4344007562733098
Energy: 0.4094978900814789
Energy: 0.409165903564662
Energy: 0.42695056453803404
Energy: 0.40395130593640727
Energy: 0.41134147276649036
Energy: 0.4261540889843153
Energy: 0.40601617665438555
Energy: 0.3899431818138795
Energy: 0.4107916297983129
Energy: 0.3905100574823153
Energy: 0.4118673793156832
Energy: 0.4119704788414275
Energy: 0.4095585014155161
Energy: 0.42521195204104767
Energy: 0.41403209921380163
Energy: 0.41280940923765375
Energy: 0.41219440802118934
Energy: 0.40447696043493275
Energy: 0.43423751213614875
Energy: 0.38921564011827064
Energy: 0.44134732306645036
Energy: 0.4362141413555791
Energy: 0.4295820148269753
Energy: 0.4260544196375269
Energy: 0.43572447125501207
Energy: 0.3906150944053503
Energy: 0.4401320549691196
Energy: 0.4343928298240598
Energy: 0.4192662705562306
Energy: 0.4080744416011929
Energy: 0.4342784053879374
Energy: 0.3882414622167833
Energy: 0.43760533154671793
Energy: 0.3999584012236114
Energy: 0.41176313205898635
Energy: 0.4116664876219459
Energy: 0.4259581017512414
Energy: 0.4099862652843828
Energy: 0.43953491416840706
Energy: 0.4068516831840578
Energy: 0.39332115014240093
Energy: 0.4200110584672015
Energy: 0.4077078220498755
Energy: 0.3890740077875351
Energy: 0.4278268256722855
Energy: 0.41491436939522863
Energy: 0.40668729055728003
Energy: 0.4214649724336009
Energy: 0.4132928162968221
Energy: 0.4139460887833998
Energy: 0.4275044613743553
Energy: 0.3999759029609108
Energy: 0.399901326520793
Energy: 0.42133071063387734
Energy: 0.40060386948442667
Energy: 0.4009998572222663
Energy: 0.4399867051955731
Energy: 0.3884474924717714
Energy: 0.38866488456360154
Energy: 0.3982546553862386
Energy: 0.38739714357980704
Energy: 0.42178486294105283
Energy: 0.44659176443544624
Energy: 0.4027535326795339
Energy: 0.3992839881624006
Energy: 0.4161188744926747
Energy: 0.40108277313616875
Energy: 0.40000283668981235
Energy: 0.44403546261484056
Energy: 0.39668468398365103
Energy: 0.3985864821993311
Energy: 0.4023529034571025
Energy: 0.4037515105284493
Energy: 0.40671984030265373
Energy: 0.4464634876341069
Energy: 0.4039072352437927
Energy: 0.39953692100666865
Energy: 0.39711578066373604
Energy: 0.4035786611880353
Energy: 0.39628344235029866
Energy: 0.4634917493656137
Energy: 0.39705511833037094
Energy: 0.40584580186288327
Energy: 0.40529281819838797
Energy: 0.4153494942659197
Energy: 0.38654625836375933

minimum gb energy = 0.3808728920782922 eV
minimum distance =  2.70191061155871 Angstroms
sigma value = 57


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

Energy: 0.46233890358309465
Energy: 0.31411709798919496
Energy: 0.1974698110267981
Energy: 0.19624553182820648
Energy: 0.31755901557808663
Energy: 0.43810590900189583
Energy: 0.3014993388248699
Energy: 0.3387974836204848
Energy: 0.3274830982369633
Energy: 0.3386337884025727
Energy: 0.33840912837088777
Energy: 0.330858714634175
Energy: 0.34440023030081585
Energy: 0.39497538653653586
Energy: 0.3140675076706849
Energy: 0.3140993849732108
Energy: 0.3059746286741705
Energy: 0.44372468245441965
Energy: 0.47191612450245596
Energy: 0.32222694933713797
Energy: 0.3602086496139591
Energy: 0.3385319882367385
Energy: 0.3173031304957261
Energy: 0.3137570578589031
Energy: 0.4735539862979523
Energy: 0.28494185811137457
Energy: 0.28398270883322074
Energy: 0.31696107566558396
Energy: 0.2851495433885706
Energy: 0.4451049499895172
Energy: 0.30443628968332626
Energy: 0.28531148163480613
Energy: 0.2881379936438216
Energy: 0.4355174218704128
Energy: 0.2865653872360197
Energy: 0.2700822086446727
Energy: 0.4540401951627722
Energy: 0.4393025607946139
Energy: 0.31430592518302064
Energy: 0.31940476856149985
Energy: 0.3094050620393329
Energy: 0.44040776132774834
Energy: 0.4421602739174174
Energy: 0.35468981426031426
Energy: 0.3679673374783542
Energy: 0.31937745620600927
Energy: 0.575758589928278
Energy: 0.47932625612813284
Energy: 0.31715166534918027
Energy: 0.42788378771026403
Energy: 0.48827576608750284
Energy: 0.47237930344289175
Energy: 0.47223904757506796
Energy: 0.49053770603732194
Energy: 0.3762004029746902
Energy: 0.3182280393568638
Energy: 0.1972436215062554
Energy: 0.19586749486400837
Energy: 0.3061610201759837
Energy: 0.3560648761872374
Energy: 0.3727138487653461
Energy: 0.3054447774328205
Energy: 0.4446719852753815
Energy: 0.19603891355957345
Energy: 0.3055355938856523
Energy: 0.3425121865305728
Energy: 0.3130622344482708
Energy: 0.47481668984372466
Energy: 0.4773831950862496
Energy: 0.4776539811403397
Energy: 0.4724607042464209
Energy: 0.4618272999790033
Energy: 0.46198463701833836
Energy: 0.30653809023766504
Energy: 0.47415188357101856
Energy: 0.35837675663547375
Energy: 0.3340824232602572
Energy: 0.3533755536353535
Energy: 0.46231029314563643
Energy: 0.43607391976453086
Energy: 0.33917373624047115
Energy: 0.33071835324039156
Energy: 0.35404944292478935
Energy: 0.3318509708802034
Energy: 0.3159215801214275
Energy: 0.2858371381531045
Energy: 0.2887519006304166
Energy: 0.30583897758899087
Energy: 0.28508876075223255
Energy: 0.2859770840103455
Energy: 0.46088848997760185
Energy: 0.3098364358605158
Energy: 0.359743525488555
Energy: 0.3401730592845217
Energy: 0.2849023024618086
Energy: 0.3095010086141757
Energy: 0.4611632639082043
Energy: 0.47937802138176133
Energy: 0.3147460171619937
Energy: 0.3401705695752722
Energy: 0.3082248444659261
Energy: 0.3330040378624139
Energy: 0.34423373256717393
Energy: 0.44192098776513106
Energy: 0.31401255684602647
Energy: 0.3150405209771677
Energy: 0.3139618984589478
Energy: 0.4683639692754579
Energy: 0.46325315530916344
Energy: 0.338538196812247
Energy: 0.3148324137282826
Energy: 0.19602321108097356
Energy: 0.34011261382047586
Energy: 0.3143952456781455

minimum gb energy = 0.19586749486400837 eV
minimum distance =  2.69531846813734 Angstroms
sigma value = 11


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

Energy: 0.8202022584823475
Energy: 0.3473036141144437
Energy: 0.3990174235021686
Energy: 0.3462657776986767
Energy: 0.32680370836593653
Energy: 0.3245116916830931
Energy: 0.32112735891899913
Energy: 0.3340509233728821
Energy: 0.3296693417324707
Energy: 0.32390744308827124
Energy: 0.3249496416591779
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Energy: 0.32635027214030465
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Energy: 0.32560329566326746
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Energy: 0.33151776397023863
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Energy: 0.32599493247486755
Energy: 0.3378197489428777
Energy: 0.324706004965035
Energy: 0.32650806854430364
Energy: 0.3253596010240866
Energy: 0.32409543125668094
Energy: 0.3211408600780078
Energy: 0.3868926717005861
Energy: 0.361774464244769
Energy: 0.33263289429350096
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Energy: 0.3270909859144788
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Energy: 0.3864570788312749
Energy: 0.4016080474149601
Energy: 0.3477711483019631
Energy: 0.3686899069926741
Energy: 0.3749709279641943
Energy: 0.3420021909343013
Energy: 0.3316064701128708
Energy: 0.5042008417924329
Energy: 0.38861273076239894
Energy: 0.3870287741724093
Energy: 0.358822465385235
Energy: 0.3640388596216771
Energy: 0.3862792860490785
Energy: 0.5525913751418414
Energy: 0.36143004790150496
Energy: 0.3232863439506639
Energy: 0.41796600464536887
Energy: 0.37610604504906625
Energy: 0.32325018131309535
Energy: 0.3763790340800589
Energy: 0.35335567311575156
Energy: 0.38762502252625436
Energy: 0.3342363363498092
Energy: 0.35856982154524497
Energy: 0.3871025897911723
Energy: 0.374370499701434
Energy: 0.32721956499822724
Energy: 0.36712926018262415
Energy: 0.32489895023332527
Energy: 0.33272626011914613
Energy: 0.3646565192218138
Energy: 0.44244614141247335
Energy: 0.36154450777221847
Energy: 0.332290883176534
Energy: 0.3283354376290287
Energy: 0.3506771587059302
Energy: 0.33444884659216517
Energy: 0.5036573380728842
Energy: 0.3635844299868553
Energy: 0.3549261772882494
Energy: 0.36408896236272087
Energy: 0.38778064896829406
Energy: 0.354138545134759
Energy: 0.4609935063438595
Energy: 0.3539705191986896
Energy: 0.3414300712935971
Energy: 0.49033145882730267
Energy: 0.3413745618274305
Energy: 0.31200978125089085
Energy: 0.32399141210465826
Energy: 0.36347105773743527
Energy: 0.35532547636966505
Energy: 0.3316686637936738
Energy: 0.3608264320494791
Energy: 0.3545064586454022
Energy: 0.32395275346250774
Energy: 0.32613482257226617
Energy: 0.3251702874815919
Energy: 0.3237668159742077
Energy: 0.3275441729199537
Energy: 0.3285046056703104
Energy: 0.39485101484439433
Energy: 0.32698752755804456
Energy: 0.32512026974386277
Energy: 0.36818085605417294
Energy: 0.3255644510665539
Energy: 0.32883085978738413
Energy: 0.3705181199962082
Energy: 0.32502397012543327
Energy: 0.32547023487099264
Energy: 0.3208224300326693
Energy: 0.3356308773514402
Energy: 0.3523773825180943

minimum gb energy = 0.31128629964823595 eV
minimum distance =  2.71072880977237 Angstroms
sigma value = 41


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

Energy: 0.7709022506638313
Energy: 0.40841161973199064
Energy: 0.34817157835612755
Energy: 0.41443572592303274
Energy: 0.4085828769327511
Energy: 0.3569467181084587
Energy: 0.3594798859537751
Energy: 0.35917295690480117
Energy: 0.35030666788279546
Energy: 0.3529044138894571
Energy: 0.35197056725720854
Energy: 0.35043357088573907
Energy: 0.351298003034605
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Energy: 0.3503225735575908
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Energy: 0.35287241822309634
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Energy: 0.35788500945956553
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Energy: 0.3503252569014075
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Energy: 0.3661510252738479
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Energy: 0.35734488394879715
Energy: 0.355473581444964
Energy: 0.3946010971604507
Energy: 0.3552279462335962
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Energy: 0.36037688110686616
Energy: 0.35264979554338
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Energy: 0.35299828102234726
Energy: 0.35269424447838
Energy: 0.36297647188642684
Energy: 0.35157718791499154
Energy: 0.36510916325919607
Energy: 0.3786823156621806
Energy: 0.3790358576801263
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Energy: 0.3497583194705298
Energy: 0.39468600029606965
Energy: 0.35176447670281424
Energy: 0.3506553818522652
Energy: 0.3643694646632126
Energy: 0.3530888649254164
Energy: 0.3506533317212571
Energy: 0.5380651196035643
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Energy: 0.35780690779651586
Energy: 0.35632922173745996
Energy: 0.36559620469182696
Energy: 0.35834701184056456
Energy: 0.39409409420952707
Energy: 0.3557652080000952
Energy: 0.3525108332596533
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Energy: 0.3503058711540726
Energy: 0.4386508983697597
Energy: 0.33500394670362127
Energy: 0.33515664934982986
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Energy: 0.3360941771245662
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Energy: 0.3536674373564642
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Energy: 0.3489831233076046
Energy: 0.37562645743792716
Energy: 0.3513046972387535
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Energy: 0.35163488145124605
Energy: 0.36293077315577926
Energy: 0.35251560341348404
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Energy: 0.7101218917794022
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Energy: 0.3545387195808029
Energy: 0.49856794702633583
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Energy: 0.35420140548907425
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Energy: 0.35486062637350724
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Energy: 0.3357875810453873
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Energy: 0.35281834980027105
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Energy: 0.3505996009455969
Energy: 0.35020467961252766
Energy: 0.3524523521037949
Energy: 0.35308046871139104
Energy: 0.35036884470107965
Energy: 0.3509035519353983
Energy: 0.3512938977765531
Energy: 0.35051644277721933
Energy: 0.35170589516349443
Energy: 0.3523780766237246
Energy: 0.35033218881534267
Energy: 0.3787057170428604
Energy: 0.36004732568923453
Energy: 0.3922640558300898
Energy: 0.37868461983763546
Energy: 0.3510974120666481
Energy: 0.39246225501011195
Energy: 0.39437533653207746
Energy: 0.3516882989208438
Energy: 0.3514970732314061
Energy: 0.36217743441908196
Energy: 0.3525957336104475
Energy: 0.35115656187501393
Energy: 0.3651985022503647
Energy: 0.3796025003440633
Energy: 0.35464444502055065
Energy: 0.3644465676478804
Energy: 0.3795946987974199
Energy: 0.33572463838050526
Energy: 0.3943535715578854
Energy: 0.35272474790913855
Energy: 0.35162148676038174
Energy: 0.36223243867997973
Energy: 0.35332686308396855
Energy: 0.3516224042848196
Energy: 0.39409252546172835
Energy: 0.35556661652754123
Energy: 0.35596657446181745
Energy: 0.3537744923270205
Energy: 0.363584896104231
Energy: 0.36020167300608913
Energy: 0.5382210736527889
Energy: 0.35573221359328394
Energy: 0.3580494599040702
Energy: 0.35242790846152544
Energy: 0.3659647991044541
Energy: 0.35164860714942436
Energy: 0.39454543412667675
Energy: 0.3548878237525082
Energy: 0.35620687200533196
Energy: 0.3630462926219547
Energy: 0.34558476875403427
Energy: 0.35531954510555375
Energy: 0.3542850633292713
Energy: 0.33450085413925196
Energy: 0.3346907776646135
Energy: 0.3696318838346375
Energy: 0.3353643186269942
Energy: 0.3659640662622978
Energy: 0.35281938688227316
Energy: 0.35585159740392674
Energy: 0.35435031215110435
Energy: 0.3527621054300984
Energy: 0.3552649763651408
Energy: 0.36027434101990397
Energy: 0.3537425462759232
Energy: 0.3506276783666822
Energy: 0.3495061268695474
Energy: 0.3536459353999085
Energy: 0.35224983905084506
Energy: 0.348896730950923
Energy: 0.3520629188973399
Energy: 0.3545421157563384
Energy: 0.35397252706781407
Energy: 0.3541326289089322
Energy: 0.353464788372104
Energy: 0.35466723375288967
Energy: 0.5660446521234559
Energy: 0.3531902457463821
Energy: 0.33647879654069124
Energy: 0.33600646731250516
Energy: 0.3632113493363619
Energy: 0.3352597189856183

minimum gb energy = 0.3342820963919492 eV
minimum distance =  2.72000130233848 Angstroms
sigma value = 33


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

Energy: 0.4792857967093272
Energy: 0.42641804979309156
Energy: 0.38422283015938224
Energy: 0.37870419590093224
Energy: 0.4276469717810486
Energy: 0.38374496462426366
Energy: 0.4067917076775294
Energy: 0.3896616885078982
Energy: 0.38903742751275927
Energy: 0.38782893972584037
Energy: 0.3873580659526933
Energy: 0.3775085150502863
Energy: 0.390047294211141
Energy: 0.37871563613788833
Energy: 0.37947986155353286
Energy: 0.3782652237074607
Energy: 0.37858123817527845
Energy: 0.37774621793008895
Energy: 0.3896687662664427
Energy: 0.39112195047696185
Energy: 0.3815600516646678
Energy: 0.37875117712090256
Energy: 0.3785148252815765
Energy: 0.3813734352577643
Energy: 0.38796102303305535
Energy: 0.3811922226416917
Energy: 0.3667275049276766
Energy: 0.38786276118787766
Energy: 0.39178136749932885
Energy: 0.3667506942247223
Energy: 0.4117352072577065
Energy: 0.380997756700115
Energy: 0.38119211262786645
Energy: 0.412751510432566
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Energy: 0.3817635951639984
Energy: 0.41046584286362925
Energy: 0.39001543770000296
Energy: 0.379962209266762
Energy: 0.3878268930175395
Energy: 0.40173368286824634
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Energy: 0.40742163822999106
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Energy: 0.378392975417915
Energy: 0.3674729500116654
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Energy: 0.3668183835453017
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Energy: 0.3907928230096904
Energy: 0.3800205070125987
Energy: 0.3924179358870455
Energy: 0.4002233111581041
Energy: 0.3832145465793717
Energy: 0.47852422213778817
Energy: 0.36910919739592535
Energy: 0.36564087572435333
Energy: 0.3663510795808425
Energy: 0.3752610261522112
Energy: 0.3656782259362817

minimum gb energy = 0.36561822054791837 eV
minimum distance =  2.72614526210622 Angstroms
sigma value = 67


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

Energy: 0.5739401897928993
Energy: 0.4319488434904737
Energy: 0.4128355300937191
Energy: 0.4136259240797461
Energy: 0.43185396497956885
Energy: 0.4123637290489875
Energy: 0.42881025540411133
Energy: 0.4052522555080657
Energy: 0.405046831008245
Energy: 0.40566075370925314
Energy: 0.40705197384593145
Energy: 0.40480911519896007
Energy: 0.42580802511051546
Energy: 0.39222494859393225
Energy: 0.4075427889118701
Energy: 0.4068333636580396
Energy: 0.3909596478519599
Energy: 0.4073878551614336
Energy: 0.42561570522117753
Energy: 0.40638558826606075
Energy: 0.40667941688416215
Energy: 0.40518154011454943
Energy: 0.4064717197317893
Energy: 0.40669189875479994
Energy: 0.42624678800313054
Energy: 0.406281857274371
Energy: 0.4065865804267862
Energy: 0.4265170703262512
Energy: 0.4061889527265658
Energy: 0.40667825152413517
Energy: 0.4272550044857904
Energy: 0.4075669801231463
Energy: 0.4082716729187322
Energy: 0.4275134317295
Energy: 0.4074669851575094
Energy: 0.4083074570292427
Energy: 0.45417365819514294
Energy: 0.40553311581467466
Energy: 0.404981252354758
Energy: 0.3890229605355217
Energy: 0.4069735832972899
Energy: 0.40484883752890155

minimum gb energy = 0.3890229605355217 eV
minimum distance =  2.76728872194393 Angstroms
sigma value = 3


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

Energy: 0.635817391676854
Energy: 0.5219362639210308
Energy: 0.47839318214745863
Energy: 0.5010185596829652
Energy: 0.534300525176709
Energy: 0.47286588064552704
Energy: 0.46306515242345136
Energy: 0.4888896463600183
Energy: 0.4763088120360979
Energy: 0.484188052884565
Energy: 0.49652393194650923
Energy: 0.46744304677911847
Energy: 0.48705124651310405
Energy: 0.4680384731515083
Energy: 0.46846629725335404
Energy: 0.4869601526502335
Energy: 0.4681547328125353
Energy: 0.46577000300826166
Energy: 0.4643287035675126
Energy: 0.46489332174323744
Energy: 0.4646800411726493
Energy: 0.4648086701224352
Energy: 0.4742890921481183
Energy: 0.46461105178051443
Energy: 0.46360083413736936
Energy: 0.4636749054938176
Energy: 0.4638626469681126
Energy: 0.4638325993775738
Energy: 0.469736135551506
Energy: 0.4639128734174526
Energy: 0.4635110773108963
Energy: 0.46387029852988193
Energy: 0.46398301902188566
Energy: 0.4638411042792204
Energy: 0.469865807109844
Energy: 0.46392482659935586
Energy: 0.4664330250216647
Energy: 0.47035669721140577
Energy: 0.4680942726492187
Energy: 0.4643268343167703
Energy: 0.4790867869233349
Energy: 0.47098667111267833
Energy: 0.5928782639105458
Energy: 0.4836430524275918
Energy: 0.485993411561606
Energy: 0.48515255516783956
Energy: 0.4877831669295613
Energy: 0.48526501802214983
Energy: 0.46739086040665334
Energy: 0.4616619584905182
Energy: 0.46268099649776745
Energy: 0.4663445610242785
Energy: 0.4609421708118681
Energy: 0.4797785541288357
Energy: 0.5323070494056077
Energy: 0.4605936390728553
Energy: 0.4612981650202332
Energy: 0.49398924847257525
Energy: 0.46062151450617944
Energy: 0.4852006382316772
Energy: 0.4807189780250471
Energy: 0.46501879760258896
Energy: 0.4672205781482074
Energy: 0.47185952695389566
Energy: 0.45827118819313817
Energy: 0.4833134528901187
Energy: 0.4900333347463566
Energy: 0.4619948197213165
Energy: 0.4614588075152703
Energy: 0.4676519844488013
Energy: 0.46961653158689404
Energy: 0.46164543165761046
Energy: 0.4781703948778901
Energy: 0.46125353189850565
Energy: 0.46182237370274876
Energy: 0.4572069612937215
Energy: 0.4616962455640978
Energy: 0.46182887282067336
Energy: 0.5009997384495314
Energy: 0.4627387059933049
Energy: 0.46206302148889866
Energy: 0.47915541746871415
Energy: 0.46243147825179004
Energy: 0.4620923785737372
Energy: 0.49765224760241916
Energy: 0.4868142898061337
Energy: 0.49485495573892146
Energy: 0.46756622159449995
Energy: 0.48743564488030616
Energy: 0.4630557651311991
Energy: 0.4841755699153904
Energy: 0.4843027659060257
Energy: 0.4667079251452048
Energy: 0.48257555838174565
Energy: 0.48890717258721844
Energy: 0.46867754696353475
Energy: 0.5388128920721772
Energy: 0.4682492803812742
Energy: 0.46807529216799515
Energy: 0.5393249355561728
Energy: 0.4687996498579712
Energy: 0.46624858227678023
Energy: 0.46764309152326716
Energy: 0.48231331341435846
Energy: 0.468246378635524
Energy: 0.4673744116260339
Energy: 0.4638831446169987
Energy: 0.4684633814720007
Energy: 0.5442386871009393
Energy: 0.4632972421968006
Energy: 0.46237532083055427
Energy: 0.45972029106002404
Energy: 0.4735104493255384
Energy: 0.46232365749886745
Energy: 0.5185884180615646
Energy: 0.4655862472179754
Energy: 0.4657362370828719
Energy: 0.4696857877628448
Energy: 0.46738676342883784
Energy: 0.46102650286337693
Energy: 0.4712759094610694
Energy: 0.46773297485675996
Energy: 0.4672702591746298
Energy: 0.4683640143173332
Energy: 0.4678537660106995
Energy: 0.4784945245608744
Energy: 0.4716307951947114
Energy: 0.46913519654676483
Energy: 0.47099831712735357
Energy: 0.4724093607671545
Energy: 0.46738202290940034
Energy: 0.47030478350811983
Energy: 0.47495750650524987
Energy: 0.47187628912969976
Energy: 0.4735565986504835
Energy: 0.47570131558653983
Energy: 0.4695454918756539
Energy: 0.47334136416916617
Energy: 0.4743642613927799
Energy: 0.4615666813316221
Energy: 0.4613002201429287
Energy: 0.4748588885242918
Energy: 0.46121252876765123
Energy: 0.4745974809386292
Energy: 0.47423186574949044
Energy: 0.4680244561867246
Energy: 0.4677942709324448
Energy: 0.4652966630442048
Energy: 0.47223734270334694
Energy: 0.4686041259168617
Energy: 0.5504631234558588
Energy: 0.4978872814341357
Energy: 0.49836022467801167
Energy: 0.46814074931855304
Energy: 0.46394903397719156
Energy: 0.46829021963743245
Energy: 0.4541768144403808
Energy: 0.47877120713042837
Energy: 0.48089294521194215
Energy: 0.4818849988309224
Energy: 0.4787421806667592
Energy: 0.46813535042528137
Energy: 0.47592054726874533
Energy: 0.467014061829341
Energy: 0.4680160500590803
Energy: 0.46871495535635443
Energy: 0.4665788930213384
Energy: 0.46932766913082297
Energy: 0.4716997667953987
Energy: 0.46899780550528997
Energy: 0.4689295553088232
Energy: 0.4718782969237491
Energy: 0.4692105773969361
Energy: 0.468917791528218
Energy: 0.47126573975842934
Energy: 0.47528383363210436
Energy: 0.4718898735494188
Energy: 0.4723584746294636
Energy: 0.47341180219990225
Energy: 0.47288703419315875
Energy: 0.4713253908939227
Energy: 0.4719986819912022
Energy: 0.4716404417329773
Energy: 0.47164171291382834
Energy: 0.5045590089267671
Energy: 0.4754874894587654
Energy: 0.475439017354393
Energy: 0.47121929601757007
Energy: 0.47251018319338806
Energy: 0.466871857106057
Energy: 0.4722926627829112
Energy: 0.4733835512984097
Energy: 0.5779023487612771
Energy: 0.47162148686800665
Energy: 0.4769052767266376
Energy: 0.4616069801434862
Energy: 0.4717602840013184
Energy: 0.4680238681682044
Energy: 0.45962241336911586
Energy: 0.4630350731493996
Energy: 0.4620327202031027
Energy: 0.48234682494703446
Energy: 0.4647522895034718
Energy: 0.46116666746023827
Energy: 0.46901300788268874
Energy: 0.48450246366872407
Energy: 0.4847568377925744
Energy: 0.4674374528298719
Energy: 0.4799552203111943
Energy: 0.47658522663168984
Energy: 0.4914643808007582
Energy: 0.460983189143835
Energy: 0.46196102373353626
Energy: 0.49198730522010803
Energy: 0.46080180099062357
Energy: 0.4847040777796886
Energy: 0.4906324069340842
Energy: 0.46237278552437144
Energy: 0.4615974717398404
Energy: 0.48502853881801233
Energy: 0.4598807174694594
Energy: 0.4624841473205368
Energy: 0.478652672448435
Energy: 0.46215635105638186
Energy: 0.46156739184446927
Energy: 0.46056998219817247
Energy: 0.46253866138645
Energy: 0.46235798429378494
Energy: 0.5055650228844804
Energy: 0.46619907728270116
Energy: 0.46085753285667996
Energy: 0.4756571940721813
Energy: 0.4648228695599334
Energy: 0.46179273691446043
Energy: 0.4988644914854933
Energy: 0.46291937137988504
Energy: 0.4629714709963389
Energy: 0.46693538604824647
Energy: 0.4640941815338227
Energy: 0.4627992303247339
Energy: 0.46410408339345377
Energy: 0.46149118097169767
Energy: 0.4629413832777357
Energy: 0.48641821031103527
Energy: 0.4866793278860212
Energy: 0.4627565048787936
Energy: 0.530056806608586
Energy: 0.46680665245305925
Energy: 0.46814209629618164
Energy: 0.5069378214143041
Energy: 0.47463808195217605
Energy: 0.47042944552383625
Energy: 0.5819125472971819
Energy: 0.4679317349585331
Energy: 0.4681608656717728
Energy: 0.506032821287722
Energy: 0.46791806370027655
Energy: 0.4882044655796374
Energy: 0.4680900836743635
Energy: 0.46464408827356346
Energy: 0.46183283430485744
Energy: 0.46433269559283674
Energy: 0.4870445285193641
Energy: 0.4835668076659416
Energy: 0.589010228486395
Energy: 0.4623141987430036
Energy: 0.4774098405490084
Energy: 0.4979150906514111
Energy: 0.46193125814097036
Energy: 0.47745672182889004
Energy: 0.4693716938626539
Energy: 0.4657696001428442
Energy: 0.4669884183303127
Energy: 0.4675711241337656
Energy: 0.4682106009799892
Energy: 0.4678022018115567
Energy: 0.4620112211541708
Energy: 0.46542221986336185
Energy: 0.464637388093609
Energy: 0.4659211111146452
Energy: 0.4660488019852835
Energy: 0.46451893724498383
Energy: 0.46202064014961164
Energy: 0.4706017056034132
Energy: 0.4670377025222758
Energy: 0.46434472022973583
Energy: 0.4641662364805671
Energy: 0.4654394948840914
Energy: 0.4619922369249923
Energy: 0.4602400542124414
Energy: 0.464953111172208
Energy: 0.46228907797679225
Energy: 0.4614426287089452
Energy: 0.46393676257204575
Energy: 0.49997680113190435
Energy: 0.460319932769478
Energy: 0.46124606338362606
Energy: 0.4899745888000157
Energy: 0.46134596046019655
Energy: 0.4647703129504785
Energy: 0.46582550079286467
Energy: 0.4792739294515072
Energy: 0.48385754728458796
Energy: 0.4760276977634337
Energy: 0.4802300913668711
Energy: 0.47178146633179474

minimum gb energy = 0.4541768144403808 eV
minimum distance =  2.68425618639956 Angstroms
sigma value = 81


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

Energy: 0.9222519440709769
Energy: 0.502441580843704
Energy: 0.4673711378712462
Energy: 0.4602653248495803
Energy: 0.501829117632318
Energy: 0.4608947260804177
Energy: 0.46006323144512623
Energy: 0.4690382737291324
Energy: 0.47518764887938786
Energy: 0.4742315614358235
Energy: 0.46554181715607873
Energy: 0.47641440740772206
Energy: 0.4755501696708339
Energy: 0.4559942116354894
Energy: 0.45590834338693875
Energy: 0.4819542992158767
Energy: 0.4660713120583387
Energy: 0.48801140286382216
Energy: 0.4691013106661749
Energy: 0.4673171005327065
Energy: 0.4705833288145385
Energy: 0.46932253575210764
Energy: 0.4660397280086869
Energy: 0.471436254939775
Energy: 0.47118610494803836
Energy: 0.4698151883237601
Energy: 0.46991021092511176
Energy: 0.4720221474336833
Energy: 0.47663807685640186
Energy: 0.4705437358369748
Energy: 0.476171561252824
Energy: 0.4746609904523652
Energy: 0.4747688189034935
Energy: 0.4715611974025437
Energy: 0.4734535598248285
Energy: 0.47108676270836625
Energy: 0.4692040537588687
Energy: 0.47113206392960416
Energy: 0.4702818942475721
Energy: 0.48999368759364237
Energy: 0.47072434520575857
Energy: 0.47243574621024303
Energy: 0.5570747974645992
Energy: 0.5039800611971749
Energy: 0.5038375345462869
Energy: 0.4504457037872542
Energy: 0.5035997998698594
Energy: 0.4684888311423904
Energy: 0.4635575634621838
Energy: 0.45654985029559414
Energy: 0.4781596297063723
Energy: 0.4787487035459717
Energy: 0.4566829531854442
Energy: 0.46784729834581185
Energy: 0.4800955421733955
Energy: 0.44106111474940296
Energy: 0.4411608159066666
Energy: 0.4648941172754166
Energy: 0.4403390465678719
Energy: 0.45045163795609366
Energy: 0.43393549853110397
Energy: 0.452486484207325
Energy: 0.4523102568928702
Energy: 0.46267272573493606
Energy: 0.4400967676861254
Energy: 0.4637266638329716
Energy: 0.46516061335897063
Energy: 0.4552606578672385
Energy: 0.4568936887022837
Energy: 0.4653410895487875
Energy: 0.46633108998941986
Energy: 0.45655518663907685
Energy: 0.4648708015451649
Energy: 0.44148136230285717
Energy: 0.49007319636068314
Energy: 0.465910273562985
Energy: 0.48375043594368256
Energy: 0.46521345352703464
Energy: 0.433355204959784
Energy: 0.4789142888506248
Energy: 0.4796019818049585
Energy: 0.46214861636229104
Energy: 0.48299578998948023
Energy: 0.4790031999264371
Energy: 0.5796646798652433
Energy: 0.47270040534810776
Energy: 0.48945297933005966
Energy: 0.43710617107850785
Energy: 0.4885871689401319
Energy: 0.43507075518865174
Energy: 0.4324796992104056
Energy: 0.4262532120324345
Energy: 0.4373366516411149
Energy: 0.43385975895680984
Energy: 0.42717879440875817
Energy: 0.42729635619163486
Energy: 0.5240533937206759
Energy: 0.4500119469994523
Energy: 0.4499230698365844
Energy: 0.49393959152385597
Energy: 0.45012077913222065
Energy: 0.45735738897991146
Energy: 0.4272478135683247
Energy: 0.42751456176002445
Energy: 0.4260489579980107
Energy: 0.42676979119489283
Energy: 0.42701572542880645
Energy: 0.42704193341767827
Energy: 0.42871749995812175
Energy: 0.42763695155352466
Energy: 0.4287071902305631
Energy: 0.4277883641018427
Energy: 0.42653429215203953
Energy: 0.4263763494362193
Energy: 0.42801367770572485
Energy: 0.42731112902712803
Energy: 0.4285461416604324
Energy: 0.4263529276740572
Energy: 0.42654658784800914
Energy: 0.4296506530694087
Energy: 0.4270512530955351
Energy: 0.4266949895580595
Energy: 0.4372345928281961
Energy: 0.4272248187549173
Energy: 0.4268037119599903
Energy: 0.44091721131313694
Energy: 0.48379001307319003
Energy: 0.45956278869012157
Energy: 0.4763243486371595
Energy: 0.4792641926889265
Energy: 0.4470884968088424
Energy: 0.4769082670065313
Energy: 0.4336234676037841
Energy: 0.42705491655614514
Energy: 0.4405650457146316
Energy: 0.4354694652567217
Energy: 0.42689134625068537
Energy: 0.42660996819348906
Energy: 0.491933591414381
Energy: 0.4906370647035548
Energy: 0.4336247107860111
Energy: 0.4275635283654574
Energy: 0.48984007311327515
Energy: 0.42784219567674525
Energy: 0.4333660403269194
Energy: 0.483747272246933
Energy: 0.48243209373027796
Energy: 0.46941414136021403
Energy: 0.4798019111395669
Energy: 0.4817036491827105
Energy: 0.5225544616169632
Energy: 0.5122371588647187
Energy: 0.5026514268536353
Energy: 0.45647899389576263
Energy: 0.5124731714991291
Energy: 0.505228346768881
Energy: 0.4886475709869589
Energy: 0.4603912341130013
Energy: 0.4675087923350232
Energy: 0.45881868463702663
Energy: 0.5043038610443376
Energy: 0.46725550582750697
Energy: 0.4332126903627452
Energy: 0.45349976890148785
Energy: 0.4814958099743781
Energy: 0.47826393549238894
Energy: 0.440667823599147
Energy: 0.4662476460979872
Energy: 0.5240063836978598
Energy: 0.4409260458924196
Energy: 0.44076408738098366
Energy: 0.46491218139523743
Energy: 0.4401537510277242
Energy: 0.44237200455506714
Energy: 0.4676847157921418
Energy: 0.45701152448339183
Energy: 0.45546540077705494
Energy: 0.46384232632456834
Energy: 0.45683030082610226
Energy: 0.483122496613192
Energy: 0.46451284185854474
Energy: 0.49325490882709216
Energy: 0.4686766788939581
Energy: 0.46607897529523035
Energy: 0.49337922939982054
Energy: 0.46462117930721636
Energy: 0.4676654240781358
Energy: 0.46591818309747457
Energy: 0.46090797838795
Energy: 0.46378389089590694
Energy: 0.4654921825312697
Energy: 0.4673353403354427
Energy: 0.5396147728751534
Energy: 0.4711437849641673
Energy: 0.47147650729871
Energy: 0.4765592927222694
Energy: 0.47132012243126903
Energy: 0.47298746071105285
Energy: 0.4753370749487325
Energy: 0.46862452786373293
Energy: 0.46926323642199297
Energy: 0.4751769287764341
Energy: 0.4750145816833458
Energy: 0.4759069387195242
Energy: 0.47477204632884573
Energy: 0.47592487864168626
Energy: 0.47588370998273566
Energy: 0.47496367554671604
Energy: 0.4585093749989694
Energy: 0.4772569587799139
Energy: 0.5299873379549076
Energy: 0.4567418678196071
Energy: 0.4500788376935895
Energy: 0.510515263620066
Energy: 0.4568347219862229
Energy: 0.5149122662511196
Energy: 0.4694737782918724
Energy: 0.4722678798489839
Energy: 0.47460660998001736
Energy: 0.47408658691393735
Energy: 0.4633648318597939
Energy: 0.4752332761238397
Energy: 0.5385735436277101
Energy: 0.473523754820604
Energy: 0.46104729076550366
Energy: 0.45795087364582
Energy: 0.42851734995151547
Energy: 0.459026176362322

minimum gb energy = 0.4260489579980107 eV
minimum distance =  2.72250714687707 Angstroms
sigma value = 43


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

Energy: 0.6505529254603563
Energy: 0.4913425317273553
Energy: 0.4522197205454728
Energy: 0.4557571559400689
Energy: 0.5386404905906046
Energy: 0.4532521578495456
Energy: 0.4456021991356307
Energy: 0.4554363021141542
Energy: 0.448594215759064
Energy: 0.4773361782977442
Energy: 0.44766577726710505
Energy: 0.4507446837299973
Energy: 0.4458661163887137
Energy: 0.4439074587599645
Energy: 0.4429299048938178
Energy: 0.4817269116969027
Energy: 0.44453265209579157
Energy: 0.44769883143272476
Energy: 0.4481304358432524
Energy: 0.44358867552344944
Energy: 0.4522576840312995
Energy: 0.4481318641179213
Energy: 0.45228726277551534
Energy: 0.45125914791609595
Energy: 0.4466067878568338
Energy: 0.45276187858901945
Energy: 0.45179529950698266
Energy: 0.4499268397533648
Energy: 0.45273316656990364
Energy: 0.45280034211157144
Energy: 0.44659487284538285
Energy: 0.45276340332323933
Energy: 0.45155101566435407
Energy: 0.45278317414984837
Energy: 0.4511994222564869
Energy: 0.4515920575506575
Energy: 0.44611031980653276
Energy: 0.4465567476745197
Energy: 0.4462574892978375
Energy: 0.4488922054406996
Energy: 0.44714172978782546
Energy: 0.4530378672616213
Energy: 0.5588126417960281
Energy: 0.44532756236017035
Energy: 0.4454416756398051
Energy: 0.451341111394197
Energy: 0.445067693407398
Energy: 0.48584251075848717
Energy: 0.4470970779330074
Energy: 0.44505807778010653
Energy: 0.44789760127134026
Energy: 0.4458308495683582
Energy: 0.4448575561134969
Energy: 0.45255478557012724
Energy: 0.5541153018382547
Energy: 0.4529208665572138
Energy: 0.44973558359864463
Energy: 0.4520003586799254
Energy: 0.45335755198303956
Energy: 0.44957481533068205
Energy: 0.45312617411860673
Energy: 0.4574141327936925
Energy: 0.46576291873974485
Energy: 0.44524122745819855
Energy: 0.4467480047871791
Energy: 0.4610424205596335
Energy: 0.45252454439868
Energy: 0.4455900552247886
Energy: 0.4455570913872601
Energy: 0.4472861392226766
Energy: 0.44535869369146713
Energy: 0.4511516831733328
Energy: 0.5222077920267408
Energy: 0.4469683916495898
Energy: 0.4533919906484761
Energy: 0.4460494873769185
Energy: 0.44802591073080766
Energy: 0.45338349991384225
Energy: 0.4531348629257894
Energy: 0.45335793285125264
Energy: 0.45059586918307976
Energy: 0.4466438761878464
Energy: 0.4479303181368051
Energy: 0.4485725457083411
Energy: 0.45298493589762473
Energy: 0.45425840303909404
Energy: 0.4500778753720844
Energy: 0.4581708497852123
Energy: 0.44844614838833713
Energy: 0.46308775331422514
Energy: 0.4523860047703492
Energy: 0.45285278617155195
Energy: 0.4628504929568298
Energy: 0.4522637898846478
Energy: 0.45504861369523103
Energy: 0.45592842794396077
Energy: 0.45253569127594456
Energy: 0.46339600170443
Energy: 0.4643972717481001
Energy: 0.4525885555241588
Energy: 0.4536556547237595
Energy: 0.46598658734199044
Energy: 0.4518686623231196
Energy: 0.45685236458778167
Energy: 0.4623678272739737
Energy: 0.4625727674255693
Energy: 0.4573474018723393
Energy: 0.4581935702688001
Energy: 0.4482429849167691
Energy: 0.45224703166195473
Energy: 0.4575121896885639
Energy: 0.4535531613138042
Energy: 0.4524219730275517
Energy: 0.4527556694762369
Energy: 0.5190294294440324
Energy: 0.4522725446264578
Energy: 0.45749416007158894
Energy: 0.454570234737919
Energy: 0.478292758963543
Energy: 0.44851086749154895
Energy: 0.45153919441317797
Energy: 0.4573939952083901
Energy: 0.45692571393477266
Energy: 0.46078587905405244
Energy: 0.45321009637435544
Energy: 0.4614416216327075
Energy: 0.5049612100008645
Energy: 0.4534386067432231
Energy: 0.48829068193637204
Energy: 0.49727447664686214
Energy: 0.4418815381757066
Energy: 0.4842174891216627
Energy: 0.45799930828189533
Energy: 0.45691900430994686
Energy: 0.45715280089900234
Energy: 0.46127006335178633
Energy: 0.4650129244044963
Energy: 0.4615853071104088
Energy: 0.4855680814095283
Energy: 0.47999269451906323
Energy: 0.45226678160359984
Energy: 0.4577007246357967
Energy: 0.4523837642015117
Energy: 0.4525176945861261
Energy: 0.45844253130922114
Energy: 0.45200312548081534
Energy: 0.45215434334866506
Energy: 0.4573696967647759
Energy: 0.4517647143250936
Energy: 0.45724731553906306
Energy: 0.4792657147261631
Energy: 0.4584419704762809
Energy: 0.4585476865851054
Energy: 0.4487065500287763
Energy: 0.45287361490557526
Energy: 0.46486940775431096
Energy: 0.4790435604439602
Energy: 0.4537522424232212
Energy: 0.45762463899741707
Energy: 0.44504969194761007
Energy: 0.45723018227425033
Energy: 0.4618161321248574
Energy: 0.48085459920978657
Energy: 0.45411962511249876
Energy: 0.45206408515204505
Energy: 0.44531133236804815
Energy: 0.44884701077942835
Energy: 0.451978958650294
Energy: 0.4451111095207845
Energy: 0.44806324151689386
Energy: 0.44762556453590807
Energy: 0.4449805728463662
Energy: 0.4513229781822092
Energy: 0.4475719927925413
Energy: 0.4479000705533789
Energy: 0.4506156326419127
Energy: 0.45207809316485453
Energy: 0.4768596828623642
Energy: 0.4466519572745563
Energy: 0.44816012746415684
Energy: 0.60389450515569
Energy: 0.47681541632526625
Energy: 0.4626494412667415
Energy: 0.45955701814764194
Energy: 0.4775278227003265
Energy: 0.4418993569436658

minimum gb energy = 0.4418815381757066 eV
minimum distance =  2.69413037665402 Angstroms
sigma value = 57


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

Energy: 0.5536739701551198
Energy: 0.516978431158087
Energy: 0.4567073107096196
Energy: 0.43615828289627223
Energy: 0.507073927025156
Energy: 0.45684075261275414
Energy: 0.4501261144159069
Energy: 0.4495545118893542
Energy: 0.4406006952190077
Energy: 0.441466504701272
Energy: 0.44079599849790396
Energy: 0.44928126756857467
Energy: 0.44142641472632904
Energy: 0.4255755104038021
Energy: 0.42583119645714335
Energy: 0.45338967902275734
Energy: 0.42575099691259644
Energy: 0.4267692830205722
Energy: 0.45427019109355743
Energy: 0.4253635172659873
Energy: 0.4257310265081053
Energy: 0.4546606959562482
Energy: 0.4253070228206286
Energy: 0.4505956721149832
Energy: 0.4602869078885527
Energy: 0.4415725014557608
Energy: 0.442322086725358
Energy: 0.4504342513494945
Energy: 0.4466498822759658
Energy: 0.44076204582719436
Energy: 0.4258379397936475
Energy: 0.44167122801048986
Energy: 0.441566971240339
Energy: 0.44280672695021106
Energy: 0.4459940918212224
Energy: 0.4389765102190787
Energy: 0.44115902481714675
Energy: 0.45900388472637355
Energy: 0.449986090541341
Energy: 0.44291677475363495
Energy: 0.4568043898362446
Energy: 0.4489258551359378
Energy: 0.4633386642673588
Energy: 0.44875012122202645
Energy: 0.4402176280191076
Energy: 0.4428815956796181
Energy: 0.4485477228705493
Energy: 0.4503924888576153
Energy: 0.4420638922102864
Energy: 0.4645786551784814
Energy: 0.44574875448679335
Energy: 0.44120867148814596
Energy: 0.461721030104
Energy: 0.44919872518113596
Energy: 0.44494582123644993
Energy: 0.4483672486188979
Energy: 0.4532564690161453
Energy: 0.4447178218773747
Energy: 0.443782827254364
Energy: 0.4544146601325238
Energy: 0.4686108305650239
Energy: 0.4426599315226307
Energy: 0.4476848819300851
Energy: 0.45329697124210505
Energy: 0.45182456094348705
Energy: 0.4457630000557152
Energy: 0.4326767464606063
Energy: 0.4600000029431991
Energy: 0.4455605573123767
Energy: 0.4340778586079711
Energy: 0.4823503414981558
Energy: 0.42515780695419875
Energy: 0.43307344612308774
Energy: 0.4540751406500288
Energy: 0.4732213745640623
Energy: 0.42504505681410154
Energy: 0.45755419163117306
Energy: 0.4743516930966212
Energy: 0.4411605862246998
Energy: 0.44734105207282443
Energy: 0.45061137172267896
Energy: 0.4403937524767156
Energy: 0.4661794621104405
Energy: 0.4459346440195149
Energy: 0.44197386453177334
Energy: 0.4330215488947185
Energy: 0.43648426336311014
Energy: 0.4426846634893164
Energy: 0.43302879664504385
Energy: 0.4363376365725626
Energy: 0.4587917641738438
Energy: 0.44711983346677864
Energy: 0.44680691472688
Energy: 0.4572501762096385
Energy: 0.44508548615773436
Energy: 0.44892508859156616
Energy: 0.46217239016112815
Energy: 0.4406842533123814
Energy: 0.44055472879249546
Energy: 0.4445352936065979
Energy: 0.4464029735104479
Energy: 0.4399951668561946
Energy: 0.4617520689247504
Energy: 0.4463717675333805
Energy: 0.445192973020591
Energy: 0.44731988968166175
Energy: 0.4484155510072621
Energy: 0.43995184728749714
Energy: 0.46696283065934435
Energy: 0.4558530457880193
Energy: 0.4486649795074588
Energy: 0.44461131393589787
Energy: 0.45459020226904306
Energy: 0.44603809092627095
Energy: 0.46716475712403904
Energy: 0.454496882866728
Energy: 0.4553070857726071
Energy: 0.4449598586382829
Energy: 0.4544942860418577
Energy: 0.44707456918173316
Energy: 0.45320797624573617
Energy: 0.464708987330744
Energy: 0.4405917045017294
Energy: 0.4408060421488651
Energy: 0.4638871979590147
Energy: 0.44130505253271923
Energy: 0.48754122640907305
Energy: 0.4481377531938053
Energy: 0.44395134798136565
Energy: 0.4420878571416258
Energy: 0.44866544303235373
Energy: 0.4436939813142077
Energy: 0.4409508842199698
Energy: 0.46381642632848646
Energy: 0.4427310715141714
Energy: 0.44047371813286973
Energy: 0.4654293186918525
Energy: 0.4457910583501632
Energy: 0.43315486610671566
Energy: 0.4544294994839431
Energy: 0.4729405084108287
Energy: 0.42530146572395283
Energy: 0.4431043605044375
Energy: 0.47417036879928987

minimum gb energy = 0.42504505681410154 eV
minimum distance =  2.67399970600048 Angstroms
sigma value = 17


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

Energy: 0.7278986865565163
Energy: 0.4694452951988171
Energy: 0.5388796347510335
Energy: 0.4348880160453825
Energy: 0.46967579365646944
Energy: 0.45228170186515293
Energy: 0.49688716426380897
Energy: 0.48248684518928925
Energy: 0.44438228680822744
Energy: 0.4891029472677785
Energy: 0.4878745550634542
Energy: 0.4458076935243317
Energy: 0.46471268204632965
Energy: 0.4194109089807019
Energy: 0.4288990955850187
Energy: 0.4741850766718341
Energy: 0.4190638776138302
Energy: 0.42923601665114275
Energy: 0.47374949094183255
Energy: 0.4287443691408397
Energy: 0.43268242934472945
Energy: 0.4737174150439121
Energy: 0.42577339809494597
Energy: 0.44682395982086043
Energy: 0.42756055125935327
Energy: 0.41849184055758054
Energy: 0.41763115452783073
Energy: 0.4280848450832996
Energy: 0.4225129645072834
Energy: 0.41173063915918323
Energy: 0.4307547747468458
Energy: 0.4182599660943616
Energy: 0.42044694398527654
Energy: 0.4054786223042997
Energy: 0.4256057645656296
Energy: 0.40431133095770344
Energy: 0.4243588958815446
Energy: 0.42213100995522745
Energy: 0.4224401580917909
Energy: 0.4235130462778458
Energy: 0.4246045534086058
Energy: 0.4126182175878608
Energy: 0.41395997845508964
Energy: 0.4030545704896167
Energy: 0.4032107372992855
Energy: 0.4028368789054324
Energy: 0.4025804291567189
Energy: 0.40247694863604594
Energy: 0.42350750867552045
Energy: 0.40116151175303916
Energy: 0.40087525967908894
Energy: 0.4244892428587085
Energy: 0.4024203357797945
Energy: 0.41307500083588217
Energy: 0.42585682047889256
Energy: 0.41447257773503743
Energy: 0.41475211139777446
Energy: 0.4256505921943584
Energy: 0.4135119563548439
Energy: 0.4204275300866541
Energy: 0.40272705359985655
Energy: 0.41142948610947994
Energy: 0.4115774715161053
Energy: 0.42248612569522465
Energy: 0.42861226083181503
Energy: 0.41765866659058515
Energy: 0.4282209585914469
Energy: 0.4745027426835892
Energy: 0.4750548089064588
Energy: 0.41349688015539754
Energy: 0.4801982448031602
Energy: 0.4472494264320568
Energy: 0.4298240882080032
Energy: 0.471843283095655
Energy: 0.4721761028358922
Energy: 0.41236716912735344
Energy: 0.47341636850012564
Energy: 0.4690150690267636
Energy: 0.48643303362906715
Energy: 0.48587563237945697
Energy: 0.4405256299356017
Energy: 0.4894806650686754
Energy: 0.48979503662907853
Energy: 0.445467404200425
Energy: 0.45587191387327747
Energy: 0.4744511998265938
Energy: 0.47797238239753703
Energy: 0.474021761745546
Energy: 0.4708177350750324
Energy: 0.4673579661948175
Energy: 0.45886264483250605
Energy: 0.48585100936963643
Energy: 0.43928694972293947
Energy: 0.4894697666713189
Energy: 0.48963217381601415
Energy: 0.47833019409267485
Energy: 0.40866843989927615
Energy: 0.4718301147210282
Energy: 0.5020479397528482
Energy: 0.4356193997521469
Energy: 0.4700274142045816
Energy: 0.5016832648430951

minimum gb energy = 0.40087525967908894 eV
minimum distance =  2.66003487969891 Angstroms
sigma value = 17


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

Energy: 0.7685576163866579
Energy: 0.5038248002753304
Energy: 0.43074049368436257
Energy: 0.43011937809014145
Energy: 0.4829633451207127
Energy: 0.4285700383313032
Energy: 0.43756173357148925
Energy: 0.39355831053262114
Energy: 0.3929661922258229
Energy: 0.4619038723359448
Energy: 0.4780974878026107
Energy: 0.43202759171056515
Energy: 0.5605143487647348
Energy: 0.37748926296891094
Energy: 0.4067982102072105
Energy: 0.48078233730975234
Energy: 0.3774817321694966
Energy: 0.4210114658458679
Energy: 0.47775326549054514
Energy: 0.418051227469019
Energy: 0.4200371304918955
Energy: 0.4780308516698486
Energy: 0.3829273549151435
Energy: 0.4314660754144054
Energy: 0.41686304401717317
Energy: 0.393823400854582
Energy: 0.3948013981166701
Energy: 0.41719409557592135
Energy: 0.4081258080608424
Energy: 0.39303340768601336
Energy: 0.4206301974943911
Energy: 0.4008120743059922
Energy: 0.37588939566461554
Energy: 0.3780922373676703
Energy: 0.411113772641174
Energy: 0.37634821429095705
Energy: 0.3841942577678168
Energy: 0.4159086524581197
Energy: 0.4110062377007218
Energy: 0.3722436959365777
Energy: 0.4131140967804033
Energy: 0.3717321818288174
Energy: 0.39839086357667014
Energy: 0.36565199344448723
Energy: 0.36943573631280324
Energy: 0.3711449408711928
Energy: 0.36504110031992526
Energy: 0.37162107488537116
Energy: 0.38467948583993733
Energy: 0.37106843169580256
Energy: 0.3825139585936466
Energy: 0.3854167043296114
Energy: 0.378853754227911
Energy: 0.3841427706514854
Energy: 0.3841681832168291
Energy: 0.3668131349243439
Energy: 0.366982631889744
Energy: 0.3842804191540667
Energy: 0.36649865106790575
Energy: 0.36712243788357857
Energy: 0.3933032369837235
Energy: 0.36711064184076697
Energy: 0.3663802901106106
Energy: 0.36626116664788705
Energy: 0.38426807157115295
Energy: 0.36645438479627546
Energy: 0.3856436279840724
Energy: 0.3843117233782731
Energy: 0.38396821674713905
Energy: 0.3919452151847428
Energy: 0.38717201214584374
Energy: 0.3827105473333264
Energy: 0.3938078911947365
Energy: 0.37278137397549566
Energy: 0.3701270477731757
Energy: 0.37140112694731814
Energy: 0.37326954169784526
Energy: 0.3701379174320322
Energy: 0.4106942633832872
Energy: 0.3717045368335864
Energy: 0.37144775985383377
Energy: 0.41152296533839955
Energy: 0.37144557535336326
Energy: 0.4110548766069301
Energy: 0.4113303087576531
Energy: 0.3769087371168764
Energy: 0.3715974651112207
Energy: 0.4111906027409085
Energy: 0.3750997887203236
Energy: 0.3929710139796588
Energy: 0.4751613086343545
Energy: 0.40104709066248473
Energy: 0.3992829782171436
Energy: 0.4082511343777426
Energy: 0.41755183672494267
Energy: 0.39747892387641626
Energy: 0.3845862471382228
Energy: 0.4767825754753903
Energy: 0.4683257181114303
Energy: 0.38194187224438775
Energy: 0.4806919379475862
Energy: 0.40177970946177755
Energy: 0.3847687666570595
Energy: 0.4719012930534583
Energy: 0.46525381891736967
Energy: 0.41197950318443133
Energy: 0.4804621433712277
Energy: 0.4080480074309883
Energy: 0.4751079374978639
Energy: 0.46432605246476116
Energy: 0.4359771672066633
Energy: 0.41595387323571803
Energy: 0.40110745642659557
Energy: 0.39412158610489967
Energy: 0.5599621707298846
Energy: 0.4076644979542546
Energy: 0.4075443718670932
Energy: 0.477414621297258
Energy: 0.40674891707633937
Energy: 0.446401651745579
Energy: 0.5172648579805069
Energy: 0.45192430993607874
Energy: 0.43268430135943264
Energy: 0.4778284799389191
Energy: 0.45748292048110983
Energy: 0.45193509368188123
Energy: 0.390215344363117
Energy: 0.45782402296538705
Energy: 0.4948227182123211
Energy: 0.4210567002848738
Energy: 0.47996483217829133
Energy: 0.42652148600241324
Energy: 0.392008279563658
Energy: 0.4656461183951045
Energy: 0.4574260811686395
Energy: 0.39497388920840754
Energy: 0.4733632167620488
Energy: 0.45280209970215884
Energy: 0.560668131330758
Energy: 0.41396473803588374
Energy: 0.3894712802331021
Energy: 0.4775395869272377
Energy: 0.3870678953494938
Energy: 0.447367589117288
Energy: 0.4767799492411913
Energy: 0.3787850908849697
Energy: 0.4071327428186303
Energy: 0.4769033041796744
Energy: 0.37866301197286556
Energy: 0.41432931052790145
Energy: 0.4176534349037647
Energy: 0.4074079551399725
Energy: 0.39431623964873336
Energy: 0.4179656539019162
Energy: 0.4086562492877708
Energy: 0.40856152172222765
Energy: 0.4001674621182136
Energy: 0.4022727079632017
Energy: 0.40604817714874736
Energy: 0.3772340680461244
Energy: 0.40229164358637853
Energy: 0.3777004571500417
Energy: 0.3817343951627259
Energy: 0.4150280147096283
Energy: 0.4111228301339963
Energy: 0.3822345425988442
Energy: 0.41231442299190585
Energy: 0.41102327099358466
Energy: 0.3845785654627303
Energy: 0.37200228774779304
Energy: 0.3719427985203121
Energy: 0.37111846839757917
Energy: 0.4114876256585922
Energy: 0.37165665685063753
Energy: 0.38391909687915593
Energy: 0.36535569730869055
Energy: 0.37093049842923365
Energy: 0.38396583199019985
Energy: 0.3648811226272697
Energy: 0.36939270337334185
Energy: 0.3872708856654979
Energy: 0.3662951903576201
Energy: 0.3660316957707944
Energy: 0.3879988263745451
Energy: 0.36606369378259906
Energy: 0.36576474626630673
Energy: 0.39176500737191383
Energy: 0.36662284441986337
Energy: 0.36659070757595075
Energy: 0.366118474835484
Energy: 0.36729870961966643
Energy: 0.36673621387523914
Energy: 0.391182020989363
Energy: 0.38784649485500355
Energy: 0.3843096061622287
Energy: 0.3935801457585876
Energy: 0.3849939191027628
Energy: 0.3841379061752244
Energy: 0.38114490965825376
Energy: 0.37403820888663103
Energy: 0.3714062569603623
Energy: 0.37157571847436155
Energy: 0.36941533266438104
Energy: 0.37154450046994086
Energy: 0.41547635930311905
Energy: 0.37056519384113124
Energy: 0.3707956926795692
Energy: 0.41602667343324334
Energy: 0.3704452476672646
Energy: 0.3713200055544858
Energy: 0.41580361930319076
Energy: 0.37102700303474995
Energy: 0.39260314921292466
Energy: 0.4109755396895105
Energy: 0.371102632094688
Energy: 0.40855737373322226
Energy: 0.5303208699793116
Energy: 0.38862580567181965
Energy: 0.38905276247137666
Energy: 0.4084931053319567
Energy: 0.4150113515139546
Energy: 0.39299147993299643
Energy: 0.38819383911941713
Energy: 0.4772509431031369
Energy: 0.4083338536900468
Energy: 0.40194573317186677
Energy: 0.4776763679309486
Energy: 0.40843065916520305
Energy: 0.406004161797217
Energy: 0.4475150019521001
Energy: 0.4071457368756983
Energy: 0.39357627031275016
Energy: 0.4570622036302149
Energy: 0.4068334389265641
Energy: 0.4111995403404733
Energy: 0.4631181908150469
Energy: 0.4427076957522291
Energy: 0.4175557123270596
Energy: 0.47907705882309587
Energy: 0.43192210390652824
Energy: 0.5318449880608673
Energy: 0.4018707900573334
Energy: 0.448222165066131
Energy: 0.480431373288912
Energy: 0.4020100929429313
Energy: 0.454258037620235
Energy: 0.5595405254363681
Energy: 0.43225534632788615
Energy: 0.3933473394230735
Energy: 0.47798960372189475
Energy: 0.40657333857058614
Energy: 0.44992373636404526
Energy: 0.39268422993299734
Energy: 0.47186389978147886
Energy: 0.4716392144537541
Energy: 0.38899951900721375
Energy: 0.4732399263977805
Energy: 0.45262233386758954

minimum gb energy = 0.3648811226272697 eV
minimum distance =  2.67757920344176 Angstroms
sigma value = 57


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

Energy: 0.6885661804858907
Energy: 0.5050256131256772
Energy: 0.41116996198582256
Energy: 0.3606998293138885
Energy: 0.5112208254926631
Energy: 0.4174563114955298
Energy: 0.45658253662027976
Energy: 0.3733853732560327
Energy: 0.37532470828826364
Energy: 0.44919026483393465
Energy: 0.39074329579377254
Energy: 0.37051423549098095
Energy: 0.5294690546764188
Energy: 0.35614617851040115
Energy: 0.35649381528671764
Energy: 0.4640401749322154
Energy: 0.35601875895800505
Energy: 0.39236359342300364
Energy: 0.4561272633739848
Energy: 0.35579923595311413
Energy: 0.4059326571307511
Energy: 0.39329889660341644
Energy: 0.35638480232766123
Energy: 0.4106587272731186
Energy: 0.39443042075360196
Energy: 0.37597775071949285
Energy: 0.37539839615587783
Energy: 0.39499116761793895
Energy: 0.3908960808388433
Energy: 0.3709398548886215
Energy: 0.3689559761756927
Energy: 0.3746979228305004
Energy: 0.35523327805875027
Energy: 0.34517759763086836
Energy: 0.39920356851529054
Energy: 0.3556535546837679
Energy: 0.3674926667567684
Energy: 0.40368836698428534
Energy: 0.39931305108352144
Energy: 0.35003469360866785
Energy: 0.4015754760391615
Energy: 0.3487387767256813
Energy: 0.43141882350483096
Energy: 0.3444164015493121
Energy: 0.3448383344973705
Energy: 0.35116295654251967
Energy: 0.3392162563910057
Energy: 0.35362140261348696
Energy: 0.36912040072531155
Energy: 0.36379388752189074
Energy: 0.3625158877630067
Energy: 0.37023295228553044
Energy: 0.3714863422766039
Energy: 0.36741665410699464
Energy: 0.3671742745551637
Energy: 0.33945500867289186
Energy: 0.3371561098403464
Energy: 0.3672620680898262
Energy: 0.33975651378718835
Energy: 0.3371938377524114
Energy: 0.35639242460139064
Energy: 0.3538437219920095
Energy: 0.3396296450851706
Energy: 0.33874296953575433
Energy: 0.3529438664946863
Energy: 0.33613011423912
Energy: 0.3696295375879156
Energy: 0.3582522865017522
Energy: 0.35291858752429267
Energy: 0.35472101790055666
Energy: 0.35579535879486807
Energy: 0.33640390373700246
Energy: 0.3531160276466676
Energy: 0.37001558684628444
Energy: 0.33812455354006155
Energy: 0.3368914310594172
Energy: 0.37283855284317385
Energy: 0.33822103325656305
Energy: 0.35355395252744276
Energy: 0.3367006689818947
Energy: 0.34731380724701233
Energy: 0.35463686370025954
Energy: 0.35574001942897804
Energy: 0.35307727408742823
Energy: 0.35291220896842246
Energy: 0.33789633704861927
Energy: 0.33661275085656417
Energy: 0.3530399581639585
Energy: 0.339881573787348
Energy: 0.3360162572063321
Energy: 0.37602382194192735
Energy: 0.3672435868901163
Energy: 0.3394358039929553
Energy: 0.3396259416250184
Energy: 0.3739086178418265
Energy: 0.3391044865870928
Energy: 0.3542445925288951
Energy: 0.3738719787910898
Energy: 0.3671948253665037
Energy: 0.33806671556175566
Energy: 0.3714175949472116
Energy: 0.35145740543641185
Energy: 0.35486699393769616
Energy: 0.35257546258165656
Energy: 0.3527911531982491
Energy: 0.3556278472418493
Energy: 0.35217005072310076
Energy: 0.35121451326422853
Energy: 0.39944196476577243
Energy: 0.35096548236027414
Energy: 0.3899937137420588
Energy: 0.40048679853316266
Energy: 0.3537440998968833
Energy: 0.39922409756072114
Energy: 0.45286760604442566
Energy: 0.35515733350471373
Energy: 0.35613743474030146
Energy: 0.3911169007175581
Energy: 0.3531051471162992
Energy: 0.3743143422265552
Energy: 0.5018026044633435
Energy: 0.3925946882025424
Energy: 0.36928580761256885
Energy: 0.39358828124209616
Energy: 0.3920009391189892
Energy: 0.3740564265030717
Energy: 0.35350415187614415
Energy: 0.44236921195075846
Energy: 0.38970283698100017
Energy: 0.3485746970966508
Energy: 0.46541606948876024
Energy: 0.37385109725399
Energy: 0.3700912221452365
Energy: 0.42538597079051677
Energy: 0.4194046385217635
Energy: 0.36497527084842335
Energy: 0.4616939464761781
Energy: 0.4169106296006739
Energy: 0.49838843993807264
Energy: 0.39211710544587836
Energy: 0.37175809941391147
Energy: 0.41525580219069025
Energy: 0.389707304057275
Energy: 0.37604647640569644
Energy: 0.5378118847389562
Energy: 0.37082135382399917
Energy: 0.3777461372959906
Energy: 0.4396184629795799
Energy: 0.3710731667364743
Energy: 0.42792300661443045
Energy: 0.530394054854844
Energy: 0.4217783582549798
Energy: 0.42567592955204814
Energy: 0.4468073951878744
Energy: 0.43859978593251275
Energy: 0.3928357374146474
Energy: 0.35648471610494736
Energy: 0.43048608801959815
Energy: 0.41479883653338623
Energy: 0.3582478338289194
Energy: 0.4259920505996216
Energy: 0.3928635048603975

minimum gb energy = 0.3360162572063321 eV
minimum distance =  2.72340446336766 Angstroms
sigma value = 43


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

Energy: 0.306909383807473
Energy: 0.4101245027919696
Energy: 0.3592694803644314
Energy: 0.3060957967820063
Energy: 0.41485774304792195
Energy: 0.34095218413286293
Energy: 0.4261851096634679
Energy: 0.3112271896975687
Energy: 0.31051149933836164
Energy: 0.3744841966420381
Energy: 0.33904316784429955
Energy: 0.30977973262214764
Energy: 0.4567799450031465
Energy: 0.2961248693166908
Energy: 0.3045285131904013
Energy: 0.34737217637639933
Energy: 0.295048000044461
Energy: 0.30641351292642033
Energy: 0.4005494011442511
Energy: 0.30450161922852736
Energy: 0.30681756159266393
Energy: 0.34278191310654765
Energy: 0.308850458441172
Energy: 0.3529913411786819
Energy: 0.35543906207793347
Energy: 0.3152995792925747
Energy: 0.3060459891846648
Energy: 0.34568608065868683
Energy: 0.3125396018705417
Energy: 0.31072208799201134
Energy: 0.29698926289010613
Energy: 0.3107694594447808
Energy: 0.3002743754283195
Energy: 0.2845749512731658
Energy: 0.3558542663461024
Energy: 0.29217930091044714
Energy: 0.42129345686347663
Energy: 0.3558221985938074
Energy: 0.3560357365117969
Energy: 0.2919421546497778
Energy: 0.35831699569931164
Energy: 0.29098762110509463
Energy: 0.4175138058385818
Energy: 0.2831944321322344
Energy: 0.28742345680648396
Energy: 0.2899711113034265
Energy: 0.28325782683889145
Energy: 0.2872706511805656
Energy: 0.3288562061339758
Energy: 0.2867814618728462
Energy: 0.3158410308938604
Energy: 0.32972603332393857
Energy: 0.29506890958728876
Energy: 0.327758339708792
Energy: 0.32806543151202633
Energy: 0.2827314425443047
Energy: 0.2825738578085697
Energy: 0.32820023659919967
Energy: 0.2822547460837521
Energy: 0.2821508910108558
Energy: 0.294464020857543
Energy: 0.3107776720406519
Energy: 0.28171001623293707
Energy: 0.3011122640462938
Energy: 0.31084086403056554
Energy: 0.27899016167271373
Energy: 0.3300565006614668
Energy: 0.31079218945820103
Energy: 0.3107665610900135
Energy: 0.29086934358261535
Energy: 0.31465117300811707
Energy: 0.27894770645363004
Energy: 0.330187347590062
Energy: 0.30095805914334883
Energy: 0.3045955031350617
Energy: 0.3040813216577146
Energy: 0.3010024082605555
Energy: 0.3051543668775831
Energy: 0.30048421765716515
Energy: 0.2776919565472079
Energy: 0.30042146552538107
Energy: 0.301376382740391
Energy: 0.29604407427793933
Energy: 0.30054836856627953
Energy: 0.30057136359821846
Energy: 0.27563902362796405
Energy: 0.2752724830015255
Energy: 0.30054190595702407
Energy: 0.27557081941792494
Energy: 0.2777785262861995
Energy: 0.2965339581490203
Energy: 0.2958895280044554
Energy: 0.27416753036948066
Energy: 0.28827732770978653
Energy: 0.2958100845488751
Energy: 0.2750463604189198
Energy: 0.30231257788210114
Energy: 0.29583440327663624
Energy: 0.29644003379251554
Energy: 0.2901775662791119
Energy: 0.2958892982998165
Energy: 0.2763724591013953
Energy: 0.2960096114055738
Energy: 0.2996164759643224
Energy: 0.275914305822354
Energy: 0.29622532019145154
Energy: 0.29770689418520074
Energy: 0.27621113905922484
Energy: 0.2960765104006818
Energy: 0.29077719167843863
Energy: 0.2961097204458825
Energy: 0.29633948381516106
Energy: 0.3264839109956676
Energy: 0.2959494813841215
Energy: 0.2957981594426795
Energy: 0.2988156044253323
Energy: 0.27886215772415057
Energy: 0.298913285064907
Energy: 0.2984120225753886
Energy: 0.27919819974420285
Energy: 0.31237217334522405
Energy: 0.3005960274137455
Energy: 0.30121529345013404
Energy: 0.2988119426311532
Energy: 0.3006161170316116
Energy: 0.2794302615665327
Energy: 0.2982079145883075
Energy: 0.30063186938699255
Energy: 0.27745619195286436
Energy: 0.277007625904061
Energy: 0.3005334398850028
Energy: 0.27608872876268403
Energy: 0.3107285761862479
Energy: 0.27755344332196713
Energy: 0.2771591725394886
Energy: 0.3106912718897541
Energy: 0.27675160335238225
Energy: 0.2769385817833645
Energy: 0.3105422574630477
Energy: 0.28218704807528816
Energy: 0.3105365705155872
Energy: 0.3114868468466682
Energy: 0.29145935198731127
Energy: 0.31056519166647695
Energy: 0.40746925620553615
Energy: 0.2918680129983565
Energy: 0.297359516341421
Energy: 0.2965214483615842
Energy: 0.29215003973784154
Energy: 0.3132013819647912
Energy: 0.4072255800055735
Energy: 0.32790053015679704
Energy: 0.32807498875045804
Energy: 0.2816877218459889
Energy: 0.3279762441975325
Energy: 0.2812834155565608
Energy: 0.29580337228898673
Energy: 0.3279856370347865
Energy: 0.29064558296849935
Energy: 0.29424483928066364
Energy: 0.3278903051990141
Energy: 0.2853167278814864
Energy: 0.33756427262620287
Energy: 0.29258284075171
Energy: 0.2925806739559529
Energy: 0.33788366863245495
Energy: 0.29347941572834657
Energy: 0.29226850750938477
Energy: 0.3570692586644793
Energy: 0.29543425570897547
Energy: 0.34060805937577215
Energy: 0.3579053239025334
Energy: 0.2849002197288961
Energy: 0.35577187260936877
Energy: 0.4327738975513591
Energy: 0.289506162976782
Energy: 0.29521354951255024
Energy: 0.31478542001113835
Energy: 0.2898258358118919
Energy: 0.2952062000987408
Energy: 0.4321886297416174
Energy: 0.33956798201367544
Energy: 0.33808311441556826
Energy: 0.3396757040051577
Energy: 0.33963711546472003
Energy: 0.30969183650683957
Energy: 0.30138402279671755
Energy: 0.34834864904619145
Energy: 0.31820501091826253
Energy: 0.2941747406906027
Energy: 0.3759070005761639
Energy: 0.3006586892919583
Energy: 0.3664779484845265
Energy: 0.34389747916399216
Energy: 0.3377204962689301
Energy: 0.3440002938146543
Energy: 0.3412830073026885
Energy: 0.33820128858841175
Energy: 0.43291238609061006
Energy: 0.3187736741304023
Energy: 0.31979497821646585
Energy: 0.3405442117354906
Energy: 0.3484251510793099
Energy: 0.37455586335847335
Energy: 0.45743091506438244
Energy: 0.3067184721496605
Energy: 0.34518619445568194
Energy: 0.3523138533889804
Energy: 0.30630597967989925
Energy: 0.34498711869618953
Energy: 0.4393613406954498
Energy: 0.34418636529880386
Energy: 0.3378175941702101
Energy: 0.374186054344303
Energy: 0.3751751551285538
Energy: 0.3066863412602932

minimum gb energy = 0.27416753036948066 eV
minimum distance =  2.72287469963707 Angstroms
sigma value = 81


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

Energy: 0.012706661643233344
Energy: 0.012956473490376564
Energy: 0.012963472712891272
Energy: 0.014258085174983186
Energy: 0.014533091925027422
Energy: 0.013199777140731879
Energy: 0.3786781083570461
Energy: 0.013179603449947527
Energy: 0.01307268563358747
Energy: 0.03367100390528455
Energy: 0.014461026482684505
Energy: 0.013188514599368071
Energy: 0.03295790645815446
Energy: 0.012936678463492777
Energy: 0.013090829126088707
Energy: 0.032948980236073816
Energy: 0.012983901183001769
Energy: 0.033375717585616825
Energy: 0.014878997794638998
Energy: 0.012966513136525935
Energy: 0.013029788906958821
Energy: 0.012898161977519411
Energy: 0.013047354484163436
Energy: 0.03359971277333165
Energy: 0.03334129447772771
Energy: 0.03302707030956982
Energy: 0.03300105283445014
Energy: 0.033919131384083236
Energy: 0.03292285476785246
Energy: 0.03306326105426915
Energy: 0.013313860519215006
Energy: 0.013045703294251226
Energy: 0.012920647648181117
Energy: 0.014383776287261217
Energy: 0.013407580682332682
Energy: 0.012912344571276838
Energy: 0.0331497486536608
Energy: 0.01321649423451874
Energy: 0.013106433759566135
Energy: 0.03305995751098885
Energy: 0.01303424350953934
Energy: 0.013195884174292849
Energy: 0.032984492355500175
Energy: 0.013027110937108274
Energy: 0.012952743619042122
Energy: 0.03294753779452662
Energy: 0.01288558481242293
Energy: 0.034606354620543525
Energy: 0.01350901879690116
Energy: 0.013102337816408674
Energy: 0.03476337471084289
Energy: 0.014531203722183958
Energy: 0.013016547256205494
Energy: 0.034432340339731964
Energy: 0.013338313228940054
Energy: 0.03293343498650676
Energy: 0.03291640641633316
Energy: 0.013290569608188228
Energy: 0.03289015669391634
Energy: 0.03306103549666152

minimum gb energy = 0.012706661643233344 eV
minimum distance =  2.86667696975267 Angstroms
sigma value = 3


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

Energy: 0.34700565359018676
Energy: 0.33890702828753566
Energy: 0.3463053044311378
Energy: 0.3178301790763409
Energy: 0.33909137832374514
Energy: 0.31934617906615126
Energy: 0.3514395061978429
Energy: 0.340828678595868
Energy: 0.3454218321881204
Energy: 0.34156495785053287
Energy: 0.341369183381774
Energy: 0.345815921986205
Energy: 0.35085042619006773
Energy: 0.3265056182918871
Energy: 0.3268740077336478
Energy: 0.34016663085089704
Energy: 0.31937112686043057
Energy: 0.3367242961535276
Energy: 0.3324617905693445
Energy: 0.3268893829578936
Energy: 0.3269781213896303
Energy: 0.3294563172204834
Energy: 0.30089876893713585
Energy: 0.3398227060828367
Energy: 0.3007140549201892
Energy: 0.34601780514599056
Energy: 0.3453456427591487
Energy: 0.3009090749055404
Energy: 0.34081297230573965
Energy: 0.3454602286926671
Energy: 0.33027268556913564
Energy: 0.3449889262258297
Energy: 0.33415157308669086
Energy: 0.27594203047013444
Energy: 0.3453722473982475
Energy: 0.31682073157512064
Energy: 0.332571345231785
Energy: 0.30749025134247476
Energy: 0.34124718597705195
Energy: 0.33243553989700736
Energy: 0.31046171383712695
Energy: 0.3398373691337204
Energy: 0.3293748225187484
Energy: 0.32489115572824195
Energy: 0.3240522896794868
Energy: 0.3294492969283872
Energy: 0.26501870693988544
Energy: 0.31179009800762875
Energy: 0.3515340839986037
Energy: 0.3246046533879394
Energy: 0.3380499925626697
Energy: 0.34194316122776686
Energy: 0.28149621256972057
Energy: 0.3395362935226628
Energy: 0.316973908280009
Energy: 0.3068856622118129
Energy: 0.30707843171740684
Energy: 0.31672439608312986
Energy: 0.3102058047833612
Energy: 0.31740335546072956
Energy: 0.33239954622908113
Energy: 0.3286455475350308
Energy: 0.3297878328691082
Energy: 0.2715467663753957
Energy: 0.27522602200697854
Energy: 0.3131784442532718
Energy: 0.28627884491359773
Energy: 0.33296420794130616
Energy: 0.33327036804116866
Energy: 0.286064798264417
Energy: 0.28398607354002015
Energy: 0.2856544804872447
Energy: 0.28767373070156127
Energy: 0.3059888417579706
Energy: 0.31765535985229504
Energy: 0.28773394958253407
Energy: 0.2619400458209502
Energy: 0.30264798317068103
Energy: 0.33153048685107167
Energy: 0.299597007069598
Energy: 0.3185736880200968
Energy: 0.2888958905779376
Energy: 0.2726385148427863
Energy: 0.31854327814962047
Energy: 0.3287082491113709
Energy: 0.2718250951014317
Energy: 0.27159419078504243
Energy: 0.32827299387858455
Energy: 0.2751251373751786
Energy: 0.2716810483401068
Energy: 0.3278134695541251
Energy: 0.31053801208409676
Energy: 0.3103283065032833
Energy: 0.2663440200580775
Energy: 0.3249667232616647
Energy: 0.3104946890268862
Energy: 0.26431707999687487
Energy: 0.3106678521800165
Energy: 0.30947280735273897
Energy: 0.26434786875792404
Energy: 0.2739525198355336
Energy: 0.2639428952194222
Energy: 0.2648443301002975
Energy: 0.30676178069227084
Energy: 0.30715701036298465
Energy: 0.2649976477907405
Energy: 0.26614532148574505
Energy: 0.3075481952969413
Energy: 0.3225683668450748
Energy: 0.28854801488046616
Energy: 0.30620539552529613
Energy: 0.2660621333377642
Energy: 0.2647742124321911
Energy: 0.30652421344923314
Energy: 0.32557637189073035
Energy: 0.2640168453850705
Energy: 0.2638686771572185
Energy: 0.3259061284101276
Energy: 0.26830900557188125
Energy: 0.2640077272158366
Energy: 0.32556812637944504
Energy: 0.30865968831569346
Energy: 0.31044544695339704
Energy: 0.32499336794452915
Energy: 0.30993991784508756
Energy: 0.30992989567733276
Energy: 0.2744211917089226
Energy: 0.30871026962204495
Energy: 0.3092030585930925
Energy: 0.2726489728030604
Energy: 0.30925898867551005
Energy: 0.271757300734007
Energy: 0.2717731899701333
Energy: 0.287641795920925
Energy: 0.3061106409697695
Energy: 0.27180764872333213
Energy: 0.2883049229829727
Energy: 0.31715050775696707
Energy: 0.3303594415039985
Energy: 0.2872819025827521
Energy: 0.2867264087248126
Energy: 0.2661367533964207
Energy: 0.2868572913797769
Energy: 0.3103370040919816
Energy: 0.34019936566305886
Energy: 0.2860902724817731
Energy: 0.28585078646661966
Energy: 0.3394287727040752
Energy: 0.2904479102339945
Energy: 0.2861760616660149
Energy: 0.34064042955574475
Energy: 0.3203827740629748
Energy: 0.3205710382760008
Energy: 0.34030342024976845
Energy: 0.3058266501899112
Energy: 0.32990528660294266
Energy: 0.30924372026332114
Energy: 0.31984188399043234
Energy: 0.32020507827996864
Energy: 0.30932905257845544
Energy: 0.34309045523878234
Energy: 0.31776041607918676
Energy: 0.29216501647363746
Energy: 0.35405319112903916
Energy: 0.30243675484703403
Energy: 0.2923016327419395
Energy: 0.35604671773609897
Energy: 0.3442061828736454
Energy: 0.3341591043960185
Energy: 0.3300231987898007
Energy: 0.3267355661602502
Energy: 0.27423897856633545
Energy: 0.3302564364424104
Energy: 0.315491408385276
Energy: 0.308475847861973
Energy: 0.33990706553755373
Energy: 0.33856759325851055
Energy: 0.3083505994528021
Energy: 0.33069022333847387
Energy: 0.3380343912888324
Energy: 0.3345364037382096
Energy: 0.28712979382728204
Energy: 0.3269616367906887
Energy: 0.3342629133079242
Energy: 0.2663679899147866
Energy: 0.3270876220984671
Energy: 0.35023691146665564
Energy: 0.32821078344357724
Energy: 0.3464719803962249
Energy: 0.33914941187663367
Energy: 0.2878848489221683
Energy: 0.36523511134874126
Energy: 0.3066249256328841
Energy: 0.3294040039132789
Energy: 0.333606201251499
Energy: 0.30679881877013854
Energy: 0.3331014820054787
Energy: 0.3250276221336913

minimum gb energy = 0.2619400458209502 eV
minimum distance =  2.67667624847476 Angstroms
sigma value = 67


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

Energy: 0.41671684880737764
Energy: 0.41053701099021067
Energy: 0.4133829957156277
Energy: 0.3491234521354743
Energy: 0.4108131568197981
Energy: 0.4137162940838104
Energy: 0.42906517139389166
Energy: 0.4144846525383756
Energy: 0.4183206868577492
Energy: 0.41250196887045165
Energy: 0.4146523341527967
Energy: 0.41390236350944554
Energy: 0.42226440116215525
Energy: 0.3797997606442947
Energy: 0.4059175819006689
Energy: 0.41046355496155673
Energy: 0.3593597241345229
Energy: 0.40734961941523035
Energy: 0.39411865067270696
Energy: 0.39585182512548145
Energy: 0.4014502127559916
Energy: 0.3944122527978438
Energy: 0.397073907058711
Energy: 0.4086178988548235
Energy: 0.3887257297198088
Energy: 0.4172069603406792
Energy: 0.4152608394078708
Energy: 0.3887822032378817
Energy: 0.4110430953048472
Energy: 0.41327483707969176
Energy: 0.3992549912243745
Energy: 0.41102735639363497
Energy: 0.39948682000427427
Energy: 0.36242482104796325
Energy: 0.41074104847337634
Energy: 0.3990767870158354
Energy: 0.3991955020980965
Energy: 0.4032333270560377
Energy: 0.4037877639218723
Energy: 0.39893900347281713
Energy: 0.40372694045167906
Energy: 0.40023009363868367
Energy: 0.39436092607299333
Energy: 0.34907292535035084
Energy: 0.3934069721335853
Energy: 0.39477893132585534
Energy: 0.34619818012939463
Energy: 0.3967325385127153
Energy: 0.41362311396960005
Energy: 0.4102520072946805
Energy: 0.41024628072518404
Energy: 0.4007114684165149
Energy: 0.36510667334097036
Energy: 0.4121306827922889
Energy: 0.3834161471921593
Energy: 0.3675594683444514
Energy: 0.36534631031133186
Energy: 0.41887671214911354
Energy: 0.36600415981657314
Energy: 0.37756588436786354
Energy: 0.41164940419764345
Energy: 0.39538681897397576
Energy: 0.3952853508506854
Energy: 0.34858850132428765
Energy: 0.4048610335074701
Energy: 0.3958540457099236
Energy: 0.3521472942886593
Energy: 0.36851015012444893
Energy: 0.3931947023754815
Energy: 0.35219670763045513
Energy: 0.3666742409779206
Energy: 0.3480814173284006
Energy: 0.3477895948867552
Energy: 0.35255655702817607
Energy: 0.38821751174648855
Energy: 0.34777933616601686
Energy: 0.34919207415010717
Energy: 0.3480828032392643
Energy: 0.4044148763335911
Energy: 0.38970706630582863
Energy: 0.3885945993514573
Energy: 0.34835770698761437
Energy: 0.37921521560009896
Energy: 0.387790068123847
Energy: 0.4045433901623445
Energy: 0.35048278047884374
Energy: 0.348376107772573
Energy: 0.40460828482675903
Energy: 0.34890293132250033
Energy: 0.34891668750196786
Energy: 0.4042950961008767
Energy: 0.3965804272755515
Energy: 0.39468026458436795
Energy: 0.3657514151520307
Energy: 0.3829689062265868
Energy: 0.39313450006029504
Energy: 0.36708024026669184
Energy: 0.3463189288392762
Energy: 0.387122936684997
Energy: 0.3676728577942905
Energy: 0.342929146409535
Energy: 0.36551017917914125
Energy: 0.36456460976297755
Energy: 0.4116641147654749
Energy: 0.41260356908846785
Energy: 0.364398982237089
Energy: 0.3664766701906623
Energy: 0.3651264989899579
Energy: 0.4000166887618137
Energy: 0.4130454416292086
Energy: 0.39826289765336886
Energy: 0.35229432391034365
Energy: 0.4132144316390102
Energy: 0.39796546701047003
Energy: 0.40017728934299723
Energy: 0.40114718953038286
Energy: 0.402036915553845
Energy: 0.3990128464940107
Energy: 0.3954977370604394
Energy: 0.3953523467424922
Energy: 0.4000918129168777
Energy: 0.3804609239249813
Energy: 0.4077275004273546
Energy: 0.4001868776091378
Energy: 0.39276530698629486
Energy: 0.41634980013410633
Energy: 0.4215826833255075
Energy: 0.34900780663256653
Energy: 0.4069089422122452
Energy: 0.41005732151857627
Energy: 0.35039447814893243
Energy: 0.4146693267553965
Energy: 0.3981720975911817
Energy: 0.39832577321375595
Energy: 0.40271562923578275
Energy: 0.3987930027899264
Energy: 0.3962411103694097
Energy: 0.40054652196289436

minimum gb energy = 0.342929146409535 eV
minimum distance =  2.66653666974041 Angstroms
sigma value = 33


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

Energy: 0.48520832342685666
Energy: 0.48824101871681647
Energy: 0.4894651764937511
Energy: 0.4222862042708689
Energy: 0.48064205422790507
Energy: 0.46959548661071554
Energy: 0.48204291440138486
Energy: 0.4450116115695165
Energy: 0.4449012299199622
Energy: 0.44100316319728794
Energy: 0.4449585173010432
Energy: 0.4440271472793735
Energy: 0.48881451239647367
Energy: 0.4410085446061606
Energy: 0.4510337119914557
Energy: 0.47350574497671244
Energy: 0.4396212514563956
Energy: 0.4658850402268402
Energy: 0.44188068500078714
Energy: 0.44163504817845073
Energy: 0.45450788506946005
Energy: 0.441840462537314
Energy: 0.4518129068995442
Energy: 0.46491797952199887
Energy: 0.44125693612353795
Energy: 0.44675996035130805
Energy: 0.44627204707643237
Energy: 0.44157885054431734
Energy: 0.48098920963601927
Energy: 0.44660673671964
Energy: 0.46364307352535145
Energy: 0.40970680395810216
Energy: 0.47871920294375186
Energy: 0.4090155954786215
Energy: 0.4093868655247531
Energy: 0.4367996934179847
Energy: 0.44118584945464273
Energy: 0.4461857039819568
Energy: 0.44698750270189397
Energy: 0.4413660639519792
Energy: 0.44525957564707475
Energy: 0.44482921319615093
Energy: 0.44216601044071707
Energy: 0.40918153215699254
Energy: 0.40991486415230577
Energy: 0.4420487141447809
Energy: 0.4123386129821862
Energy: 0.4442294013480714
Energy: 0.46273462164917273
Energy: 0.4415994170804313
Energy: 0.44314223497279875
Energy: 0.41414142988013053
Energy: 0.40930861945760155
Energy: 0.4562773339318086
Energy: 0.463799680778091
Energy: 0.41048630233275396
Energy: 0.4103382984597707
Energy: 0.4639279265619705
Energy: 0.4104536201368089
Energy: 0.4096300640414745
Energy: 0.46377297714487786
Energy: 0.41073018367168085
Energy: 0.44564153622671415
Energy: 0.4114357310811377
Energy: 0.4378770330530895
Energy: 0.40988477165591786
Energy: 0.4092901272968614
Energy: 0.40913449599558366
Energy: 0.4098406551266613
Energy: 0.40937409813979775
Energy: 0.4198831703978377
Energy: 0.4102454701083848
Energy: 0.4102054739286657
Energy: 0.4457631225712947
Energy: 0.4279672263059365
Energy: 0.41031425317428427
Energy: 0.41539986320399774
Energy: 0.4098379895671944
Energy: 0.400849526186415
Energy: 0.4450557136509706
Energy: 0.44227892103228256
Energy: 0.4010219392181993
Energy: 0.46433928274684805
Energy: 0.39858261345793566
Energy: 0.39872662979137696
Energy: 0.44462914529991504
Energy: 0.4457919644870096
Energy: 0.4024195056201017
Energy: 0.44243903557685804
Energy: 0.44540603133963713
Energy: 0.441865674321586
Energy: 0.44773316459074064
Energy: 0.46545875711667956
Energy: 0.44299154754874737
Energy: 0.41608310669327947
Energy: 0.4470444887049191
Energy: 0.4888680275631665
Energy: 0.41585605259086206
Energy: 0.41582380530034113
Energy: 0.4735409776264952
Energy: 0.4184954911332277
Energy: 0.4663506865893014
Energy: 0.49273955081245346
Energy: 0.4426240024409216
Energy: 0.44499506789789495
Energy: 0.44017085906424164
Energy: 0.44180002131974483
Energy: 0.4748809570716049
Energy: 0.4587537901581626
Energy: 0.47462842837299846
Energy: 0.47225011909064835
Energy: 0.41176839124591
Energy: 0.4746842062924122
Energy: 0.4589072629322582
Energy: 0.4585747617894957
Energy: 0.4443399538554177
Energy: 0.44658782196638946
Energy: 0.4592085040676201
Energy: 0.44454001179425917
Energy: 0.4103592442034193
Energy: 0.49207204905259366
Energy: 0.46293673849626593
Energy: 0.46466290005352484
Energy: 0.47418466822396627
Energy: 0.4480655431853832
Energy: 0.4795495558755829
Energy: 0.4772274828113467
Energy: 0.4408293636614463
Energy: 0.45107500634481024
Energy: 0.4778980033314829
Energy: 0.43911977770882715
Energy: 0.4646225325250723
Energy: 0.4416453424563027
Energy: 0.4106024181144679
Energy: 0.4433858392652041
Energy: 0.44198985306724137
Energy: 0.44491271782938785
Energy: 0.44399410317294746
Energy: 0.46337905706205934
Energy: 0.41012965457895256
Energy: 0.4762904019376886
Energy: 0.40631791011651774
Energy: 0.40987303813141635
Energy: 0.4388321482795428
Energy: 0.44105474814022794
Energy: 0.44606657534231187
Energy: 0.44653965694815834
Energy: 0.44122016826529953
Energy: 0.44603332826558795
Energy: 0.4446612063539306
Energy: 0.4416590269425267
Energy: 0.4089942267838953
Energy: 0.41000564822977187
Energy: 0.44165023303864587
Energy: 0.4117176987145792
Energy: 0.4442569478107347
Energy: 0.4622852201348439
Energy: 0.4094695440567193
Energy: 0.4429785273997871
Energy: 0.4147750142982298
Energy: 0.41806352328143476
Energy: 0.456821804848419
Energy: 0.4631160660761585
Energy: 0.4104389881497423
Energy: 0.41036585513864254
Energy: 0.46472115922555085
Energy: 0.4107471170472049
Energy: 0.4097142780369856
Energy: 0.4630962806521921
Energy: 0.43857050338606657
Energy: 0.4109620813054118
Energy: 0.41234142133487856
Energy: 0.4376591487475597
Energy: 0.40980792751448275
Energy: 0.40958331599443126
Energy: 0.4094229345484653
Energy: 0.4094408385830543
Energy: 0.409538060406737
Energy: 0.4161945917180429
Energy: 0.4099342070551454
Energy: 0.4117542096434146
Energy: 0.44558500040201854
Energy: 0.41006859117486677
Energy: 0.41022028072722105
Energy: 0.4141258844964067
Energy: 0.409855659967876
Energy: 0.40052824943305776
Energy: 0.4452607972763726
Energy: 0.44754527562232904
Energy: 0.4006922707494415
Energy: 0.4653617996111108
Energy: 0.39873479352946406
Energy: 0.39854582638654873
Energy: 0.4451275311382475
Energy: 0.44582206765552845
Energy: 0.46516708201175033
Energy: 0.44293100488011206
Energy: 0.4301954168681386
Energy: 0.4424529537179436
Energy: 0.45207986730002414
Energy: 0.44398415780007094
Energy: 0.4440640279352085
Energy: 0.41649956495686546
Energy: 0.4467534512760183
Energy: 0.48936491709654034
Energy: 0.41564981943383666
Energy: 0.4159266815981511
Energy: 0.47519709260078064
Energy: 0.3990157513888976
Energy: 0.46667881764663105
Energy: 0.4922615060863314
Energy: 0.44466567530874174
Energy: 0.475722276763499
Energy: 0.4436862665242256
Energy: 0.44309942082861703
Energy: 0.4439762146782929
Energy: 0.46157147759461603
Energy: 0.47499663840643624
Energy: 0.47424847514711055
Energy: 0.4146332134549997
Energy: 0.47531899797015964
Energy: 0.45856007097356427

minimum gb energy = 0.39854582638654873 eV
minimum distance =  2.69870055954197 Angstroms
sigma value = 41


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

Energy: 0.6726134247713728
Energy: 0.5280538794458397
Energy: 0.48676448131409794
Energy: 0.48771629209588996
Energy: 0.5286841257707654
Energy: 0.4859565662354922
Energy: 0.5708148871090482
Energy: 0.5114888077666259
Energy: 0.4975481804438417
Energy: 0.5089211745056329
Energy: 0.5103263734188628
Energy: 0.49786749819488824
Energy: 0.5707598913566779
Energy: 0.48640400515087684
Energy: 0.48522846295863004
Energy: 0.509642071276075
Energy: 0.4876234565524136
Energy: 0.48477066259566237
Energy: 0.5123549702642675
Energy: 0.48654649388729454
Energy: 0.4853361129864424
Energy: 0.5122197099419116
Energy: 0.48757319757273965
Energy: 0.4882180487112594
Energy: 0.501087125398302
Energy: 0.49646160604007916
Energy: 0.4872453928478937
Energy: 0.5012602509661215
Energy: 0.5113365922104763
Energy: 0.48696609436046645
Energy: 0.512431845261112
Energy: 0.49682754428489756
Energy: 0.48676766107240166
Energy: 0.4886264176447414
Energy: 0.5163473638596147
Energy: 0.48668247274581833
Energy: 0.5003020157344216
Energy: 0.49743152781721267
Energy: 0.48711291530538897
Energy: 0.5003599866647699
Energy: 0.48806388317444754
Energy: 0.4885985385265877
Energy: 0.5033472466582176
Energy: 0.4882608586320274
Energy: 0.4867445976256459
Energy: 0.5040734846335513
Energy: 0.4893412514781052
Energy: 0.48847360896090225
Energy: 0.5344888254154596
Energy: 0.488045237011141
Energy: 0.4867543374397929
Energy: 0.47747168904857373
Energy: 0.4971961911274363
Energy: 0.4870077260356388
Energy: 0.5148298758833928
Energy: 0.5044565930281908
Energy: 0.48836494027947724
Energy: 0.48903368280297344
Energy: 0.5015801131218205
Energy: 0.48611443998755527
Energy: 0.5090321109751377
Energy: 0.496827053902366
Energy: 0.488848429727881
Energy: 0.48750268133870506
Energy: 0.4767502975209027
Energy: 0.4889040556031244
Energy: 0.5851732217830783
Energy: 0.4765427713398892
Energy: 0.4768788547399065
Energy: 0.5858142230670571
Energy: 0.47697736944910807
Energy: 0.47761383723814255
Energy: 0.5757181074890296
Energy: 0.48955090261878204
Energy: 0.4956004725206853
Energy: 0.5095440145036866
Energy: 0.502619328634993
Energy: 0.49737850149376645
Energy: 0.5474092625037846
Energy: 0.5020913711373669
Energy: 0.47716756204463345
Energy: 0.4784382582976464
Energy: 0.5103685131928928
Energy: 0.47719066729820114

minimum gb energy = 0.4765427713398892 eV
minimum distance =  2.68173050788924 Angstroms
sigma value = 11


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

Energy: 0.5878001699245147
Energy: 0.6097869745951828
Energy: 0.6384548274164038
Energy: 0.5871344263281632
Energy: 0.629026153709204
Energy: 0.5750604588086765
Energy: 0.6627064490287136
Energy: 0.5667621395641632
Energy: 0.5774801682553318
Energy: 0.5821502212863736
Energy: 0.5667627880977467
Energy: 0.5755629423133041
Energy: 0.6287922832538506
Energy: 0.5729630441644283
Energy: 0.5704055694061493
Energy: 0.57367248870221
Energy: 0.5676445986921798
Energy: 0.5723630919570528
Energy: 0.5822522431331526
Energy: 0.571471685990343
Energy: 0.572662808886131
Energy: 0.5664785716439297
Energy: 0.5690676511716788
Energy: 0.5740238328030391
Energy: 0.5852228200708044
Energy: 0.5672788527801274
Energy: 0.5763460675577967
Energy: 0.5812046480972218
Energy: 0.5667494991992698
Energy: 0.5759330658807281
Energy: 0.5809468444393978
Energy: 0.5672294091943958
Energy: 0.5733341631997364
Energy: 0.5752385353757031
Energy: 0.5755870201758986
Energy: 0.5717626664100762
Energy: 0.5804385490724343
Energy: 0.5718329191938116
Energy: 0.5726478348739718
Energy: 0.580599894447594
Energy: 0.5715630569896719
Energy: 0.5739005031060531
Energy: 0.5779468165155491
Energy: 0.577043972723271
Energy: 0.5770742138867827
Energy: 0.5667205161111188
Energy: 0.5741604878327917
Energy: 0.5765101080011142
Energy: 0.5631151023489194
Energy: 0.5753253214470354
Energy: 0.5740659309100308
Energy: 0.5679984506385781
Energy: 0.5755272688999528
Energy: 0.5745169067265982
Energy: 0.574120424942787
Energy: 0.5750911462513014
Energy: 0.5726143365887331
Energy: 0.5733719617432111
Energy: 0.575805691394624
Energy: 0.5744556973943716
Energy: 0.5782609897481042
Energy: 0.5762706550076239
Energy: 0.5758807570602927
Energy: 0.5667121153551051
Energy: 0.583688740412177
Energy: 0.5765723196620224
Energy: 0.5685921083257436
Energy: 0.5754062937117569
Energy: 0.5768072022792449
Energy: 0.5688128481900423
Energy: 0.5680277531988065
Energy: 0.5730908704339304
Energy: 0.5663127691243942
Energy: 0.5725382513753653
Energy: 0.571906224438593
Energy: 0.5661998152584392
Energy: 0.5738762800903096
Energy: 0.5731278228714582
Energy: 0.5691473228079382
Energy: 0.5753781448651253
Energy: 0.5742929629011807
Energy: 0.5730585497697446
Energy: 0.5907637668357703
Energy: 0.5745515034477017
Energy: 0.5665360297855767
Energy: 0.573090531338175
Energy: 0.5718529105991964
Energy: 0.5667154455248489
Energy: 0.5742387975188314
Energy: 0.571749906498497
Energy: 0.5624579161502081
Energy: 0.5733881346954157
Energy: 0.5720573242513578
Energy: 0.563235886271794
Energy: 0.5754013762983525
Energy: 0.573029090954203
Energy: 0.5624179196715563
Energy: 0.573446948944298
Energy: 0.5734579177840154
Energy: 0.5625708643180791
Energy: 0.5711883456174554
Energy: 0.5672057179773723
Energy: 0.5951988903374346
Energy: 0.5935799549458045
Energy: 0.5934864494508938
Energy: 0.5814680385361612
Energy: 0.5990347543836735
Energy: 0.5709140470426837
Energy: 0.5723809586604268
Energy: 0.5696726717507095
Energy: 0.5726482868126744
Energy: 0.5724740891863311
Energy: 0.5690241674621326
Energy: 0.5723425366584138
Energy: 0.5817963620105101
Energy: 0.5750131756707071
Energy: 0.5727596803392543
Energy: 0.5724191075033924
Energy: 0.5631947642218814
Energy: 0.5685914558263144
Energy: 0.612539835602728
Energy: 0.5751647357266538
Energy: 0.5683175920324887
Energy: 0.5705501020521231
Energy: 0.5728143364219199
Energy: 0.5740008498177889
Energy: 0.5862813774148077
Energy: 0.5729544056828981
Energy: 0.5753916080949542
Energy: 0.5725699838860651
Energy: 0.5705999518701799
Energy: 0.5718320829193795
Energy: 0.5721771676795097
Energy: 0.5740716335304124
Energy: 0.5731409498795127
Energy: 0.5668290695346091
Energy: 0.5730263403194708
Energy: 0.5746249939812414
Energy: 0.6123925655584458
Energy: 0.5670762742333917
Energy: 0.5673413027130045
Energy: 0.5685600180923704
Energy: 0.5692858449134761
Energy: 0.5723965697444567
Energy: 0.6149052807308723
Energy: 0.5739683164167181
Energy: 0.5756169685546245
Energy: 0.5994250917543185
Energy: 0.5752942447644597
Energy: 0.5678928720615352
Energy: 0.6085700499799053
Energy: 0.5688160771464632
Energy: 0.572814768636944
Energy: 0.5815686127703144
Energy: 0.5674238966031182
Energy: 0.572334482404651
Energy: 0.6065108720252069
Energy: 0.5623319596663344
Energy: 0.5756528704923145
Energy: 0.5760328586324999
Energy: 0.5637942975445779
Energy: 0.5719462234235783
Energy: 0.6060079612807682
Energy: 0.5748826727828324
Energy: 0.5724288356666533
Energy: 0.5740480185716178
Energy: 0.5691803849066361
Energy: 0.57184201460521
Energy: 0.6102762143780064
Energy: 0.56589013037854
Energy: 0.5718225716296579
Energy: 0.5736770037552948
Energy: 0.5726846583765485
Energy: 0.5703478441716756
Energy: 0.6622114332356299
Energy: 0.5697348711917829
Energy: 0.5832149279673482
Energy: 0.5735623310248549
Energy: 0.5663325425712907
Energy: 0.5721121467157936
Energy: 0.5822499756601317
Energy: 0.5697407213590192
Energy: 0.5769611166563842
Energy: 0.5632271784839996
Energy: 0.5688693966610754
Energy: 0.5735512817860319

minimum gb energy = 0.5623319596663344 eV
minimum distance =  2.67287432236042 Angstroms
sigma value = 57


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

Energy: 0.783260030942739
Energy: 0.5834950788455145
Energy: 0.5595182908640114
Energy: 0.5792761902526408
Energy: 0.5831172456367176
Energy: 0.582848003095652
Energy: 0.6086291695254759
Energy: 0.5765471912883333
Energy: 0.5725816555222387
Energy: 0.5761598364232472
Energy: 0.5764144414829052
Energy: 0.5721560690829497
Energy: 0.5720423995060984
Energy: 0.5832777946701929
Energy: 0.5822673320374013
Energy: 0.6213082164941801
Energy: 0.57038187440306
Energy: 0.5764513443888769
Energy: 0.5721426621188146
Energy: 0.5762812730434999
Energy: 0.5723781927973538
Energy: 0.572891299925004
Energy: 0.5707290804275652
Energy: 0.5758819304545907
Energy: 0.5719912242060461
Energy: 0.5754300351356307
Energy: 0.575739123554271
Energy: 0.5737760368813929
Energy: 0.5746879874846256
Energy: 0.5718603377107515
Energy: 0.5724345900587428
Energy: 0.5763481694610895
Energy: 0.5763549077999838
Energy: 0.5740376665147386
Energy: 0.5735916531269877
Energy: 0.572612381833085
Energy: 0.5718739823626022
Energy: 0.5841165567965152
Energy: 0.585731410493437
Energy: 0.5733990481682254
Energy: 0.5822287027388883
Energy: 0.5929242680749014
Energy: 0.6274248437550514
Energy: 0.576132191337924
Energy: 0.5757128199129485
Energy: 0.5758851286787545
Energy: 0.5752316239081626
Energy: 0.5718777068235043
Energy: 0.5592821914383198
Energy: 0.575518751912637
Energy: 0.583647947800384
Energy: 0.562436229548833
Energy: 0.5738719876484519
Energy: 0.5600517867532494
Energy: 0.5587765540653807
Energy: 0.5754343304200278
Energy: 0.5833139758269489
Energy: 0.5621801324817467
Energy: 0.5741108746950943
Energy: 0.5602356384968971
Energy: 0.6270444315761159
Energy: 0.576616008326725
Energy: 0.5775567001566942
Energy: 0.5759839156297784
Energy: 0.5752137191181043
Energy: 0.5715377691497586
Energy: 0.5729046529991454
Energy: 0.585291183663777
Energy: 0.5846893668998162
Energy: 0.5733233207073006
Energy: 0.570623456441361
Energy: 0.5765311491809662
Energy: 0.5711046345160321
Energy: 0.5764094261950153
Energy: 0.571856337046346
Energy: 0.5723295279264656
Energy: 0.5768153952755468
Energy: 0.5719723218287562
Energy: 0.5725843832349011
Energy: 0.5752163420204033
Energy: 0.5770963898450959
Energy: 0.5760818854967673
Energy: 0.5755265504652115
Energy: 0.576579420998984
Energy: 0.5838157265813617
Energy: 0.5816228537126997
Energy: 0.5721752201244201
Energy: 0.5748429097437611
Energy: 0.5783375144172631
Energy: 0.5721048268952026
Energy: 0.6196211193282486
Energy: 0.5821858084037871
Energy: 0.5811075698025597
Energy: 0.5736291391421114
Energy: 0.5792518179594998
Energy: 0.5725918233404039
Energy: 0.5593664384332492
Energy: 0.5768282267062856
Energy: 0.572814522185852
Energy: 0.5595056232929665
Energy: 0.5750770812028126
Energy: 0.5730406163382895

minimum gb energy = 0.5587765540653807 eV
minimum distance =  2.6741317608856 Angstroms
sigma value = 9


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

Energy: 0.669708184447534
Energy: 0.6373959357378927
Energy: 0.608478917472003
Energy: 0.6164244327859356
Energy: 0.6247591962320028
Energy: 0.6077604248748103
Energy: 0.6167081645826351
Energy: 0.609613998578469
Energy: 0.6076378067781718
Energy: 0.6105894241797988
Energy: 0.6198774313665844
Energy: 0.6096932698264075
Energy: 0.615024708439561
Energy: 0.6134144589366282
Energy: 0.6120384240312734
Energy: 0.6029700601322677
Energy: 0.615200117494695
Energy: 0.6093675648246757
Energy: 0.6066559047762073
Energy: 0.6127082707578324
Energy: 0.610092145236846
Energy: 0.6085121120480824
Energy: 0.6070851215007707
Energy: 0.6108930585782855
Energy: 0.6012065184095774
Energy: 0.595225288153969
Energy: 0.5940493450992718
Energy: 0.5985565177800127
Energy: 0.5943066339400812
Energy: 0.592218829401246
Energy: 0.6021280282040394
Energy: 0.6048014186429775
Energy: 0.6034676361202689
Energy: 0.6032846858952416
Energy: 0.6074336799900689
Energy: 0.6033818284677207
Energy: 0.6045222926739904
Energy: 0.6027357841669008
Energy: 0.6108741274704442
Energy: 0.5942454598807211
Energy: 0.6060627944244876
Energy: 0.6161727410604589
Energy: 0.6248294048651104
Energy: 0.6028420147718525
Energy: 0.6050251201151305
Energy: 0.608050678746325
Energy: 0.6022921249980755
Energy: 0.6051249983788837
Energy: 0.6336672859802839
Energy: 0.5964183939468498
Energy: 0.5924563637748439
Energy: 0.6097990901869061
Energy: 0.6042628256595562
Energy: 0.6093518427859395
Energy: 0.6215664644803148
Energy: 0.5937190076494975
Energy: 0.5926337355221784
Energy: 0.610983882221458
Energy: 0.602821201020722
Energy: 0.601801033439935
Energy: 0.6249989891558113
Energy: 0.6074170471697673
Energy: 0.600783006776611
Energy: 0.6040592570415471
Energy: 0.6027119454861634
Energy: 0.6000929664866695
Energy: 0.6257419243006017
Energy: 0.6058112652932657
Energy: 0.6111205458291082
Energy: 0.6187053722495386
Energy: 0.6064063812875926
Energy: 0.6095464801319387
Energy: 0.6159537974665933
Energy: 0.6070920775838065
Energy: 0.6079078035034592
Energy: 0.6104034030279039
Energy: 0.6033497510594179
Energy: 0.602109229337775
Energy: 0.6288249693899934
Energy: 0.6105541954468497
Energy: 0.6110277669353401
Energy: 0.6065581423613206
Energy: 0.6095696543593774
Energy: 0.6103447202166506
Energy: 0.6273336815092435
Energy: 0.6013843277701448
Energy: 0.6054542901721155
Energy: 0.6177801127123924
Energy: 0.6020638426113433
Energy: 0.5931078595915631
Energy: 0.6157430220879103
Energy: 0.6105978277095611
Energy: 0.5941536335455511
Energy: 0.6159745901555593
Energy: 0.6161397961990309
Energy: 0.5991530839906345
Energy: 0.6090091437982178
Energy: 0.6109714555453162
Energy: 0.6110484975413837
Energy: 0.6121885044904005
Energy: 0.6145454619686858
Energy: 0.6111573793721617
Energy: 0.6831868735976776
Energy: 0.5950399333046961
Energy: 0.593947815666837
Energy: 0.6117937025497063
Energy: 0.6178911134233
Energy: 0.5934032250696275
Energy: 0.6168325662001498
Energy: 0.6137383024642072
Energy: 0.6113178566012301
Energy: 0.6172588728863252
Energy: 0.6207103503639976
Energy: 0.6089530378924185
Energy: 0.61680555806454
Energy: 0.6130278791967887
Energy: 0.6113965284697443
Energy: 0.5934541242102733
Energy: 0.6156985956645767
Energy: 0.6089802137594073
Energy: 0.6195734943132205
Energy: 0.6203867683223653
Energy: 0.5933600185866681
Energy: 0.6017677745873367
Energy: 0.6181021339061606
Energy: 0.6114113248768132

minimum gb energy = 0.592218829401246 eV
minimum distance =  2.64183624081706 Angstroms
sigma value = 27


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

Energy: 0.8077093716971467
Energy: 0.582186416518085
Energy: 0.6111034960858274
Energy: 0.5870030487632365
Energy: 0.6572802448080995
Energy: 0.592099228363184
Energy: 0.6528574046226643
Energy: 0.5934748555569846
Energy: 0.6061696771467213
Energy: 0.6113357447819846
Energy: 0.5990952076872981
Energy: 0.5844055709838752
Energy: 0.6026942228287353
Energy: 0.5659229273557788
Energy: 0.5660389982392783
Energy: 0.5946139321112787
Energy: 0.6037959947479865
Energy: 0.5886704942863898
Energy: 0.6255580328555292
Energy: 0.5658654761856016
Energy: 0.5650099456780586
Energy: 0.5873638000011723
Energy: 0.6053349657531659
Energy: 0.5834110881476593
Energy: 0.6055235370897726
Energy: 0.5846278405118094
Energy: 0.5845492514172834
Energy: 0.6061657216845788
Energy: 0.6372030497706066
Energy: 0.5848032922410267
Energy: 0.6290659370459772
Energy: 0.5840591719067293
Energy: 0.5844720619878665
Energy: 0.6103238460187591
Energy: 0.6071189263184527
Energy: 0.5846293628902806
Energy: 0.5983044334053401
Energy: 0.582644355269005
Energy: 0.5825203546926703
Energy: 0.5850972788179938
Energy: 0.5887584996385657
Energy: 0.5833175316436886
Energy: 0.6319661730224074
Energy: 0.5967093514802967
Energy: 0.6213691335017101
Energy: 0.5880041772903856
Energy: 0.6020521880245007
Energy: 0.6210242517324421
Energy: 0.6913269567492873
Energy: 0.5674634016946732
Energy: 0.567153070786642
Energy: 0.5885312950031539
Energy: 0.6062952777470779
Energy: 0.583809281166332
Energy: 0.6159959339324084
Energy: 0.569710939784288
Energy: 0.5664942138745829
Energy: 0.5881308552303436
Energy: 0.5713070338105555
Energy: 0.5660293057839081
Energy: 0.6348393660968122
Energy: 0.5931048981046533
Energy: 0.5872904148441084
Energy: 0.6165250605612407
Energy: 0.6021724776431824
Energy: 0.5867003817012032
Energy: 0.5709736483777239
Energy: 0.5651239596350359
Energy: 0.5684277075479012
Energy: 0.5713432971311736
Energy: 0.5648733777231524
Energy: 0.5672896525600066
Energy: 0.5791837467750857
Energy: 0.5601472081708606
Energy: 0.5681290280355998
Energy: 0.5804746448193682
Energy: 0.5682758915927465
Energy: 0.5692532595364052
Energy: 0.5795950174789342
Energy: 0.5647928079664261
Energy: 0.5647091544533531
Energy: 0.5799630847314877
Energy: 0.5646888135461127
Energy: 0.5649596971713511
Energy: 0.5707400974071103
Energy: 0.5681766735041192
Energy: 0.5658955115261253
Energy: 0.5712458420028852
Energy: 0.5658963070938967
Energy: 0.5654390335431259
Energy: 0.6107039510301385
Energy: 0.5656706172117782
Energy: 0.5645552818766141
Energy: 0.5923845781229292
Energy: 0.566647943160043
Energy: 0.5648529479418412
Energy: 0.6051288192127904
Energy: 0.5807115432433584
Energy: 0.5810221351617404
Energy: 0.6111646579095191
Energy: 0.5832523217833259
Energy: 0.5813130275554994
Energy: 0.6328462160918696
Energy: 0.6036009591059099
Energy: 0.584268366309819
Energy: 0.5939704968824004
Energy: 0.6060434503271815
Energy: 0.5845929680112447
Energy: 0.6254574663318038
Energy: 0.5932039465306849
Energy: 0.5918699349146124
Energy: 0.6261503850891007
Energy: 0.58848235221884
Energy: 0.5911237584586997
Energy: 0.6011624931982318
Energy: 0.593280511104558
Energy: 0.5918856529940629
Energy: 0.5965819098881122
Energy: 0.601969317735962
Energy: 0.5910100040116177
Energy: 0.6826915385211401
Energy: 0.5671567059719469
Energy: 0.5837135471705357
Energy: 0.5865207347335323
Energy: 0.6062195960189499
Energy: 0.5843030931863094
Energy: 0.603388783784888
Energy: 0.6262141504465522
Energy: 0.6151491424027924
Energy: 0.6047940531783944
Energy: 0.6285959303782847
Energy: 0.6049988424255494
Energy: 0.6202340026408191
Energy: 0.5652513483536417
Energy: 0.5846788829968124
Energy: 0.6218376485380925
Energy: 0.5903002337860607
Energy: 0.5847605336962075
Energy: 0.5997512238665321
Energy: 0.6049121288751216
Energy: 0.5650998945464946
Energy: 0.5908659668730418
Energy: 0.6066455683635574
Energy: 0.5829094856302101
Energy: 0.6357415554318758
Energy: 0.6326039398524294
Energy: 0.6277066710411114
Energy: 0.6018137158142377
Energy: 0.6444883178079982
Energy: 0.5967823181356812

minimum gb energy = 0.5601472081708606 eV
minimum distance =  2.64261123583762 Angstroms
sigma value = 19


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

Energy: 0.6111491787747805
Energy: 0.5860280485530964
Energy: 0.5942709253255211
Energy: 0.5859261909704296
Energy: 0.6017338623612639
Energy: 0.5942163244907268
Energy: 0.5987625322651174
Energy: 0.5841333825112801
Energy: 0.5827308407276645
Energy: 0.5823994064364083
Energy: 0.582206276560208
Energy: 0.5831559306689411
Energy: 0.5966820941920373
Energy: 0.5825194847387065
Energy: 0.5786371986606371
Energy: 0.5902816963962936
Energy: 0.5797482818257812
Energy: 0.5787888635725235
Energy: 0.5950541764157684
Energy: 0.5827798131676971
Energy: 0.5842139670876102
Energy: 0.5814182571332848
Energy: 0.5827670073681521
Energy: 0.584417995916758
Energy: 0.5975448511433468
Energy: 0.5841722260181483
Energy: 0.5818642660474324
Energy: 0.5971667068088754
Energy: 0.5790453993974082
Energy: 0.5802680071233068
Energy: 0.5977831787697299
Energy: 0.584196865715837
Energy: 0.583966403184832
Energy: 0.5934175114969524
Energy: 0.5930218977130822
Energy: 0.5843806371732847
Energy: 0.6031689751681352
Energy: 0.5793939291871324
Energy: 0.5782210537691558
Energy: 0.5855733160335967
Energy: 0.5821475401154237
Energy: 0.5765334159379832
Energy: 0.5929681557499115
Energy: 0.5804084172261049
Energy: 0.5826638728418004
Energy: 0.5822894362376307
Energy: 0.5800327630828414
Energy: 0.5835313265949368
Energy: 0.5874891700562463
Energy: 0.5791600773596652
Energy: 0.5825309226755071
Energy: 0.5859366287098882
Energy: 0.5795660696094409
Energy: 0.5823773369436015
Energy: 0.5923593842444982
Energy: 0.5810551766149874
Energy: 0.5798949476412218
Energy: 0.5859780900328841
Energy: 0.5826884655812782
Energy: 0.5801222058937633
Energy: 0.5971854411162795
Energy: 0.5727168084140717
Energy: 0.5725743763395568
Energy: 0.5964063881878848
Energy: 0.5738239796628661
Energy: 0.5721991927027014
Energy: 0.59485842789302
Energy: 0.5802265885457332
Energy: 0.5814651939242013
Energy: 0.5746253893833123
Energy: 0.5776696963157931
Energy: 0.5730474908435459
Energy: 0.6035441480857893
Energy: 0.572376851196682
Energy: 0.57613228657107
Energy: 0.5831646897720387
Energy: 0.5739982987318053
Energy: 0.577517259562462
Energy: 0.6113213003068175
Energy: 0.5852930441004813
Energy: 0.58497894140264
Energy: 0.5721789499595499
Energy: 0.5868045983189946
Energy: 0.5817486288320817
Energy: 0.594694195463599
Energy: 0.5725553988947998
Energy: 0.5751809658612115
Energy: 0.5696027015524452
Energy: 0.5750152128736573
Energy: 0.5743177890331082
Energy: 0.60739351247249
Energy: 0.5750356393560836
Energy: 0.5748332457211668
Energy: 0.5732484272198829
Energy: 0.5742851802061681
Energy: 0.5747595634735849
Energy: 0.5914551017679927
Energy: 0.5794154256268009
Energy: 0.5834380581327492
Energy: 0.5744945594152332
Energy: 0.5833286347627225
Energy: 0.5830029307631148
Energy: 0.604809728491707
Energy: 0.5720245252377284
Energy: 0.5722433607371225
Energy: 0.5708574681489742
Energy: 0.5715568745367434
Energy: 0.5735786152630833
Energy: 0.6005120395187074
Energy: 0.5731421568986377
Energy: 0.5737168379442739
Energy: 0.5890941304821654
Energy: 0.5860008131195034
Energy: 0.582659859568008
Energy: 0.5849937296267992
Energy: 0.5709663106030861
Energy: 0.572398075786952
Energy: 0.5717284037846619
Energy: 0.5739100727400428
Energy: 0.5822923152047461
Energy: 0.5720714342706171
Energy: 0.5720527638530214
Energy: 0.5726751967145656
Energy: 0.5751132945863089
Energy: 0.571777385309022
Energy: 0.5721749388987014
Energy: 0.5715473188095592
Energy: 0.5733276978755542
Energy: 0.5731314592293764
Energy: 0.5740447030593645
Energy: 0.5734301308287711
Energy: 0.5731071552158785
Energy: 0.5867197773634163
Energy: 0.5879283336849583
Energy: 0.5876950874800038
Energy: 0.5854545111517209
Energy: 0.5865602841946899
Energy: 0.5714518485402276
Energy: 0.6020822930577531
Energy: 0.5712810829883045
Energy: 0.5726683664450354
Energy: 0.591910231288257
Energy: 0.5688577797056782
Energy: 0.5734422592674526
Energy: 0.6030784876057699
Energy: 0.5740921121109771
Energy: 0.574285053884019
Energy: 0.577027320335691
Energy: 0.5689386616060977
Energy: 0.5739541751181177
Energy: 0.5951320635326376
Energy: 0.5779299986347639
Energy: 0.5784169254793767
Energy: 0.5851246633563876
Energy: 0.5815612972993807
Energy: 0.5830917190134175
Energy: 0.5969007192400202
Energy: 0.5826240605294307
Energy: 0.5809430678047331
Energy: 0.5864799400552354
Energy: 0.5854782608695884
Energy: 0.5805341568994784
Energy: 0.5969721348362432
Energy: 0.5803954871816793
Energy: 0.5830137658102083
Energy: 0.5778816524872307
Energy: 0.5848460624113576
Energy: 0.5828876652048548
Energy: 0.6018340663502394
Energy: 0.6032641752488223
Energy: 0.6044237067346755
Energy: 0.5682373473433945
Energy: 0.6015980085851591
Energy: 0.5775326380820663

minimum gb energy = 0.5682373473433945 eV
minimum distance =  2.64707722074228 Angstroms
sigma value = 101


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

Energy: 0.8759965613822104
Energy: 0.5596201983499515
Energy: 0.5581514450154678
Energy: 0.5497553359830559
Energy: 0.5544809089183521
Energy: 0.5474636338461435
Energy: 0.6281938545153745
Energy: 0.554527865399486
Energy: 0.5567707082097421
Energy: 0.5534480657172263
Energy: 0.5545736894603882
Energy: 0.5567684083091016
Energy: 0.5815151832925002
Energy: 0.5535747588304217
Energy: 0.5536354189615516
Energy: 0.5747333703811215
Energy: 0.553537877807123
Energy: 0.5589222186301481
Energy: 0.5746869887454131
Energy: 0.5564578691424645
Energy: 0.5579083174718309
Energy: 0.5570937737827375
Energy: 0.556288297627329
Energy: 0.5575901226411968
Energy: 0.5656150143459332
Energy: 0.5573407323508054
Energy: 0.5583081560098759
Energy: 0.5648895945354674
Energy: 0.5770621602235292
Energy: 0.5636806427637379
Energy: 0.5678058181386472
Energy: 0.5561122069318223
Energy: 0.5564681051020725
Energy: 0.5678647543413909
Energy: 0.5564105868881086
Energy: 0.5566965141974664
Energy: 0.5739503725868863
Energy: 0.5513062488092416
Energy: 0.5520530312838925
Energy: 0.5683671142195909
Energy: 0.5515408255891141
Energy: 0.5570751641728698
Energy: 0.5704172564529457
Energy: 0.5543142633206802
Energy: 0.556662664919695
Energy: 0.5662797023690844
Energy: 0.5597247610650136
Energy: 0.5560588135798493
Energy: 0.5531336751247864
Energy: 0.559313579834898
Energy: 0.5549923772189932
Energy: 0.5511746386224876
Energy: 0.5553473652746379
Energy: 0.5532500782020712
Energy: 0.5594481240632119
Energy: 0.5612481221777534
Energy: 0.5597296517712136
Energy: 0.5550218067995459
Energy: 0.5631879292063884
Energy: 0.5594497245465135
Energy: 0.581112438201206
Energy: 0.5459228369515006
Energy: 0.5564728872331297
Energy: 0.573096750122405
Energy: 0.5452993817476472
Energy: 0.5544713424573686
Energy: 0.5817287423447064
Energy: 0.5600126942261453
Energy: 0.5587501624557086
Energy: 0.5586029447602227
Energy: 0.5539614175212805
Energy: 0.5589841533600358
Energy: 0.5662332820748456
Energy: 0.5548187349382082
Energy: 0.5558939203701143
Energy: 0.5488302548499615
Energy: 0.5555162137425815
Energy: 0.5540711651090818
Energy: 0.5683958458088678
Energy: 0.5611944478688553
Energy: 0.5595649725313229
Energy: 0.5499053504066297
Energy: 0.5621175068978125
Energy: 0.557888328393282
Energy: 0.5822839374176627
Energy: 0.555123338904403
Energy: 0.5552366923410818
Energy: 0.5593830130463193
Energy: 0.5532254255848555
Energy: 0.5566716581819499
Energy: 0.5811636155332954
Energy: 0.5539792209901482
Energy: 0.5573156577650068
Energy: 0.5584979119466966
Energy: 0.5517025092810814
Energy: 0.5572079056048729
Energy: 0.5642244304740277
Energy: 0.574290328766003
Energy: 0.5594253382861875
Energy: 0.5367765414443056
Energy: 0.5538442536805649
Energy: 0.5455599661760451
Energy: 0.6095040091564787
Energy: 0.5596969923446996
Energy: 0.5551433013185398
Energy: 0.560896352615625
Energy: 0.5548671202185559
Energy: 0.5584285294159627
Energy: 0.5813007700830287
Energy: 0.5544526124825888
Energy: 0.554130285340509
Energy: 0.5556168333219561
Energy: 0.5530317140379836
Energy: 0.5545539081812909
Energy: 0.5732143653834623
Energy: 0.5549778858564037
Energy: 0.5555213716423092
Energy: 0.5546243703615761
Energy: 0.5530013091000563
Energy: 0.556020069019346
Energy: 0.5663794945122338
Energy: 0.5550083159812852
Energy: 0.5585584370027135
Energy: 0.5643968075308327
Energy: 0.5592940542219387
Energy: 0.559277447676442
Energy: 0.5643048209135471
Energy: 0.5571586838639239
Energy: 0.5575640369403604
Energy: 0.5514552511985772
Energy: 0.5547435412254083
Energy: 0.5572476669338963
Energy: 0.5678270596748204
Energy: 0.5522873337954507
Energy: 0.5523240019253056
Energy: 0.5648725680313397
Energy: 0.5490307391380504
Energy: 0.5528951944047628
Energy: 0.5526120455670167
Energy: 0.5548546217671605
Energy: 0.5554379212395597
Energy: 0.5675479124985777
Energy: 0.5531399277479765
Energy: 0.5604873632455865
Energy: 0.5581868451977336
Energy: 0.5579028952471193
Energy: 0.556664394403152
Energy: 0.5520123269167352
Energy: 0.5555084085668922
Energy: 0.5553622016483649
Energy: 0.5537754696268156
Energy: 0.5603913427946525
Energy: 0.5582883633291947
Energy: 0.5512831583851524
Energy: 0.5626193628806413
Energy: 0.5576072130295022
Energy: 0.5760658058127742
Energy: 0.5461409387987552
Energy: 0.5467182498302701
Energy: 0.5544869178886699
Energy: 0.543187203439201
Energy: 0.5479866491762433
Energy: 0.5815599532955599
Energy: 0.5448877873281783
Energy: 0.5522980427812912
Energy: 0.5596570176428024
Energy: 0.5390621965750473
Energy: 0.5581312346068933
Energy: 0.5683392161661992
Energy: 0.5597881481361354
Energy: 0.559026641831125
Energy: 0.5497301261779682
Energy: 0.5594201297966575
Energy: 0.5567214648179145
Energy: 0.5669986007516254
Energy: 0.5584266931660752
Energy: 0.5569412356600829
Energy: 0.5491631198924136
Energy: 0.5536740428751608
Energy: 0.5562896507756488
Energy: 0.5808351444087445
Energy: 0.5559187536529299
Energy: 0.5566571864966673
Energy: 0.5592514329102658
Energy: 0.5508959312857162
Energy: 0.557169506632894
Energy: 0.581665052178559
Energy: 0.554025534766269
Energy: 0.5553968275648357
Energy: 0.5552598296973197
Energy: 0.5515155342791687
Energy: 0.5564768105607947
Energy: 0.5631626730259881
Energy: 0.556848159042128
Energy: 0.5547705929014094
Energy: 0.5373974701333138
Energy: 0.5512713869432396
Energy: 0.558741985576051

minimum gb energy = 0.5367765414443056 eV
minimum distance =  2.66028013403789 Angstroms
sigma value = 33


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

Energy: 0.009716971054334009
Energy: 0.589539891283117
Energy: 0.010291690497589745
Energy: 0.011001217712545213
Energy: 0.5936205848883923
Energy: 0.010170358710092232
Energy: 0.2762097814062368
Energy: 0.07097162722073234
Energy: 0.07036097761156115
Energy: 0.07174787501818514
Energy: 0.07180107842898709
Energy: 0.07016810073996245
Energy: 0.804347005745578
Energy: 0.5904868249569325
Energy: 0.5901725949163171
Energy: 0.5918828212300293
Energy: 0.5934913061431744
Energy: 0.5925423258669773
Energy: 0.010285359219103896
Energy: 0.07097162722073234
Energy: 0.07036097761156115
Energy: 0.0717478750185124
Energy: 0.0718010784286598
Energy: 0.07016810073996245

minimum gb energy = 0.009716971054334009 eV
minimum distance =  2.85684083278316 Angstroms
sigma value = 1