Model name: model_name=EAM_Dynamo_Marinica_2007_Fe__MO_466808877130_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.855279721319676
cohesive_energy=4.12272209665705
mass=55.845
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=[1.0124362433208418e-19, 1.88137193424084e-19, 2.67981665979474e-19, 3.2596924489383594e-19, 3.7394482202233197e-19, 4.1669089461745196e-19, 4.537380249254339e-19, 4.85052567236964e-19, 5.11683947247312e-19, 5.352615785932559e-19, 5.567611868449019e-19, 5.76067415284602e-19, 5.92816569816438e-19, 6.0685644366018e-19, 6.18235102114848e-19, 6.2750850047244e-19, 6.35195743962372e-19, 6.416877636833399e-19, 6.472697470761959e-19, 6.520394269156139e-19, 6.558317790082919e-19, 6.585090161637059e-19, 6.60015062199666e-19, 6.6048129560016e-19, 6.60015062199666e-19, 6.585795119356019e-19, 6.561169664491439e-19, 6.52571349558102e-19, 6.47740787006592e-19, 6.4105009738300795e-19, 6.317542685525399e-19, 6.1896889901322e-19, 6.020467094049119e-19, 5.80465390144932e-19, 5.53582468403046e-19, 5.2064331898464e-19, 4.806978511457519e-19, 4.3140688700074194e-19, 3.6729739116786598e-19, 2.8068532451046e-19, 1.6113090408138e-19, -6.3007839179337595e-21, -2.51794875446172e-19, -6.3942068374623e-19, -1.1690345897046359e-18, -1.88587405058238e-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: 0.012743079976029113
Energy: 0.013008782481744087
Energy: 0.21537838334499568
Energy: 0.21625916257910355
Energy: 0.21564828926386256
Energy: 0.012939273383809171
Energy: 0.013008786540914348
Energy: 1.0569108513787264
Energy: 0.2161853713481642
Energy: 0.21548571652865164
Energy: 0.21563898303307893
Energy: 0.2157161657407912
Energy: 0.21537838334452092
Energy: 0.21618537135503443
Energy: 1.055945607420908
Energy: 0.012904060658030295
Energy: 0.2158150785694656
Energy: 1.0590906319958966
Energy: 0.21625916257614322
Energy: 0.21548565571010694
Energy: 0.012904060657052826
Energy: 0.012893904080899953
Energy: 0.21562021693848302
Energy: 0.2153957407627623
Energy: 0.2156482892633878
Energy: 0.21563898303997703
Energy: 0.21581507856899082
Energy: 0.21562021695861883
Energy: 1.0515146869777774
Energy: 0.21570600099563708
Energy: 0.012939273382831703
Energy: 0.21571616573981373
Energy: 1.0590906319300433
Energy: 0.21539574075932716
Energy: 0.21570600099661455
Energy: 0.01286232666124638

minimum gb energy = 0.012743079976029113 eV
minimum distance =  2.47134898924021 Angstroms
sigma value = 1


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

Energy: 1.2722719125725097
Energy: 1.3797418939168813
Energy: 1.3591604810387063
Energy: 1.4265732562604183
Energy: 1.3592344266943979
Energy: 1.3802241628189773
Energy: 1.5087815334354924
Energy: 1.403754739057186
Energy: 1.323824693565706
Energy: 1.3706865593730195
Energy: 1.3307382321950632
Energy: 1.4505295915627974
Energy: 1.2628998924002275
Energy: 1.32165690525593
Energy: 1.4087385755507345
Energy: 1.379601246030586
Energy: 1.3245172968072236
Energy: 1.3261508960051815
Energy: 1.3882447582642434
Energy: 1.317947556154443
Energy: 1.4071968123598322
Energy: 1.3981574958945608
Energy: 1.319994145371824
Energy: 1.3247030977524672
Energy: 1.3845609138826367
Energy: 1.329002992636008
Energy: 1.3280168353168413
Energy: 1.3721714613559124
Energy: 1.409553957024118
Energy: 1.3848889077508493
Energy: 1.2590282651791393
Energy: 1.4025314363493568
Energy: 1.4009639434222567
Energy: 1.410372381798618
Energy: 1.3997981244151545
Energy: 1.4013422222040781
Energy: 1.4018136866276316
Energy: 1.4012496393809006
Energy: 1.4000657203395404
Energy: 1.475296120020563
Energy: 1.399851733739753
Energy: 1.4002045032478747
Energy: 1.3802646842133142
Energy: 1.29096176532323
Energy: 1.2704823051235463
Energy: 1.376116980041453
Energy: 1.3817773806118512
Energy: 1.2974854456481169
Energy: 1.2429947725692778
Energy: 1.4002104396559063
Energy: 1.4036930371195684
Energy: 1.370376178996284
Energy: 1.4013679317435888
Energy: 1.400982612948026
Energy: 1.2420775834005053
Energy: 1.3993500904658398
Energy: 1.4006513866331756
Energy: 1.387596513286677
Energy: 1.4002068655267697
Energy: 1.4178422163869444
Energy: 1.4847928484563493
Energy: 1.2921982252985902
Energy: 1.3287242009276818
Energy: 1.364135639190059
Energy: 1.3296566469636204
Energy: 1.2926735381322112
Energy: 1.3659860371924653
Energy: 1.3180509434029761
Energy: 1.3751429782986806
Energy: 1.4229539773525306
Energy: 1.3178146674008022
Energy: 1.367909403633271
Energy: 1.38361640780833
Energy: 1.320428691174419
Energy: 1.3787906910220296
Energy: 1.5152395345131942
Energy: 1.3196060321030223
Energy: 1.3228144346390829
Energy: 1.2604658316523465
Energy: 1.4426987371862723
Energy: 1.3286569874600582
Energy: 1.2595565827784165
Energy: 1.3316124006274717
Energy: 1.327930522272385
Energy: 1.2586462475079498
Energy: 1.3216235592776664
Energy: 1.3240952822901952
Energy: 1.3913239289587536
Energy: 1.3185639961438331
Energy: 1.3999705194018357
Energy: 1.25967326050854
Energy: 1.3214122036244274
Energy: 1.3240854797985926
Energy: 1.380421924204225
Energy: 1.3284531194664737
Energy: 1.444323534723305
Energy: 1.2618259358000468
Energy: 1.3281486425807159
Energy: 1.383223144442198
Energy: 1.3804853163585278
Energy: 1.4044113948752917
Energy: 1.3252422834194686
Energy: 1.3728020231737823
Energy: 1.4043630015666146
Energy: 1.401432949688478
Energy: 1.40278992145053
Energy: 1.4021707600464175
Energy: 1.4016780195260459
Energy: 1.3700453549123568
Energy: 1.4015093910860101
Energy: 1.490212245285826
Energy: 1.3915612260788268
Energy: 1.4014947748553364
Energy: 1.4018864129497202
Energy: 1.3699465425462496
Energy: 1.3993590711438018
Energy: 1.394283694259037
Energy: 1.3825295798172248
Energy: 1.4012124591934374
Energy: 1.493519503713649
Energy: 1.37153010341245
Energy: 1.4029631220322738
Energy: 1.405464960583743
Energy: 1.4057999059073187
Energy: 1.4042621977341898
Energy: 1.4049900182825716
Energy: 1.2656530468208345
Energy: 1.4051137595476928
Energy: 1.4027835572713978
Energy: 1.2451959764444633
Energy: 1.401863914269368
Energy: 1.3229912501578365
Energy: 1.4974094983637263
Energy: 1.4033970829341398
Energy: 1.3262306494802234
Energy: 1.3801183351101023
Energy: 1.3258449019471117
Energy: 1.4449029773764357

minimum gb energy = 1.2420775834005053 eV
minimum distance =  2.21331316082008 Angstroms
sigma value = 33


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

Energy: 1.458232683772306
Energy: 1.3990712555798201
Energy: 1.3505698803845894
Energy: 1.4143048542644336
Energy: 1.3531410109053716
Energy: 1.4605843860210597
Energy: 1.6236830264303022
Energy: 1.6259987659995458
Energy: 1.3490820954979827
Energy: 1.3835158934750145
Energy: 1.349026046790328
Energy: 1.42967920005381
Energy: 1.5264184336992328
Energy: 1.4294436679060258
Energy: 1.4290065867886592
Energy: 1.4024064152489455
Energy: 1.4288881283929387
Energy: 1.4300331467888532
Energy: 1.502211072474609
Energy: 1.4282516542007608
Energy: 1.4282818208981556
Energy: 1.5616620101433198
Energy: 1.4278088971137246
Energy: 1.4471733987519548
Energy: 1.5272478980175148
Energy: 1.4365273958327152
Energy: 1.4742335206453816
Energy: 1.5809790821166265
Energy: 1.4707223117273656
Energy: 1.4542513507373969
Energy: 1.3791255527343886
Energy: 1.4760047936553558
Energy: 1.4739377599802823
Energy: 1.3869367236682861
Energy: 1.4737345569039884
Energy: 1.470703491870822
Energy: 1.3839733126920695
Energy: 1.471971501478666
Energy: 1.471799773617559
Energy: 1.5916613256548762
Energy: 1.4730464304553266
Energy: 1.4718782570903879
Energy: 1.4468712768841951
Energy: 1.3493788636827349
Energy: 1.347247963871844
Energy: 1.397636666608071
Energy: 1.472733735998113
Energy: 1.350831874707655
Energy: 1.3662917548192612
Energy: 1.4275370930495184
Energy: 1.450286559608702
Energy: 1.5188499645750837
Energy: 1.429458282014404
Energy: 1.4816636749122851
Energy: 1.5571168950114416
Energy: 1.4272235191270861
Energy: 1.4289153618488992
Energy: 1.5425908985958325
Energy: 1.427492610677875
Energy: 1.4603788846017034
Energy: 1.4788216772861609
Energy: 1.4799419850567996
Energy: 1.444098247792708
Energy: 1.5493245111642377
Energy: 1.4351335195795063
Energy: 1.3492055842230049
Energy: 1.3840098203651412
Energy: 1.3498927066771373
Energy: 1.3541423162398318
Energy: 1.3389689757609469
Energy: 1.3497028928697312
Energy: 1.3476722486512742
Energy: 1.3538418621094994
Energy: 1.3479633071957737
Energy: 1.3512169935682667
Energy: 1.3072602487423282
Energy: 1.348383883262656
Energy: 1.3484487975639974
Energy: 1.338690948695153
Energy: 1.4253911085594486
Energy: 1.4351753930761875
Energy: 1.5238559694944178
Energy: 1.43498887301902
Energy: 1.4316844940717306
Energy: 1.5258166613096724
Energy: 1.466260024813325
Energy: 1.466957617923282
Energy: 1.5419471196748329
Energy: 1.4662201077307189
Energy: 1.467126184941515
Energy: 1.4046256956340335
Energy: 1.4660650718571133
Energy: 1.5018133643326594
Energy: 1.6037337330695693
Energy: 1.4676278184740865
Energy: 1.544529479600796
Energy: 1.4255814297825298
Energy: 1.4273643993424736
Energy: 1.4888607834692558
Energy: 1.5233855537699852
Energy: 1.5571605359572098
Energy: 1.4316381680923165
Energy: 1.3005967907536697
Energy: 1.4670419600449431
Energy: 1.4679894650970668
Energy: 1.6038849028900448
Energy: 1.4672871365474796
Energy: 1.4679518229070043
Energy: 1.4559443580027447
Energy: 1.4674103021389495
Energy: 1.4678384984441881
Energy: 1.565657915690667
Energy: 1.4668636216192132
Energy: 1.4671319573802575
Energy: 1.3671564353230516
Energy: 1.3497987950758055
Energy: 1.4397551249256408
Energy: 1.5418378508801467
Energy: 1.438288709307992
Energy: 1.4459453732321297
Energy: 1.362050507412742
Energy: 1.3485945311637586
Energy: 1.3906276228757652
Energy: 1.6118215655397405
Energy: 1.3484921478241074
Energy: 1.3609603592217683
Energy: 1.3827308861375187
Energy: 1.3469651385598889
Energy: 1.4775263272135455
Energy: 1.3658087441716098
Energy: 1.347842079836728
Energy: 1.349410924488925
Energy: 1.5710844889812536
Energy: 1.433609935411196
Energy: 1.431253587390637
Energy: 1.5381753299721472
Energy: 1.4334498800885658
Energy: 1.465719091954445
Energy: 1.4284164299489364
Energy: 1.4288586095147393
Energy: 1.4315547337409804
Energy: 1.5189723424007275
Energy: 1.4284927241100716
Energy: 1.4671968628998402
Energy: 1.566982674928972
Energy: 1.4777826110680203
Energy: 1.4336075908525572
Energy: 1.5114996258720828
Energy: 1.4329899964789712
Energy: 1.4673971865510191
Energy: 1.3977741108211819
Energy: 1.4722246616006898
Energy: 1.4728452851247464
Energy: 1.3830738001363514
Energy: 1.4716618069559477
Energy: 1.3482390270442994
Energy: 1.459181297677693
Energy: 1.4710053319780936
Energy: 1.4713035902597813
Energy: 1.56081834911493
Energy: 1.4706677332694649
Energy: 1.4718123554784202
Energy: 1.384101351965007
Energy: 1.472253607805174
Energy: 1.3524322620957814
Energy: 1.397964215589243
Energy: 1.4705972478249334
Energy: 1.4094213682325978
Energy: 1.5226757981747876
Energy: 1.4299615858423131
Energy: 1.4996507731302189
Energy: 1.5221573083502005
Energy: 1.4318825780824471
Energy: 1.4599141230551331
Energy: 1.5316653518250132
Energy: 1.4323501883309921
Energy: 1.4599030181245765
Energy: 1.5019428481402848
Energy: 1.4299727887194185
Energy: 1.4314958401258397
Energy: 1.5260199907251888
Energy: 1.4323256118513805
Energy: 1.460107807667455
Energy: 1.4914931151703383
Energy: 1.4344713197442112
Energy: 1.4324111655298952
Energy: 1.473616516478462
Energy: 1.349605322421943
Energy: 1.3477290007164437
Energy: 1.392906162149442
Energy: 1.3473920475085261
Energy: 1.631842053073377
Energy: 1.4355643713196096
Energy: 1.3523121486638974
Energy: 1.3479141469317362
Energy: 1.3538820149969348
Energy: 1.3479269150670876
Energy: 1.4282633870191745
Energy: 1.539132504467197
Energy: 1.4375421126733097
Energy: 1.37066109779514
Energy: 1.4102625762252925
Energy: 1.3526215662309102
Energy: 1.427459802110539
Energy: 1.5554497106129148
Energy: 1.4661230775422582
Energy: 1.4661708309914352
Energy: 1.3838983717956193
Energy: 1.466972657529514
Energy: 1.4659879206453301
Energy: 1.524373375554885
Energy: 1.4661003210194552
Energy: 1.4656388755556957
Energy: 1.41017841171387
Energy: 1.4666181738119248
Energy: 1.4979280084338125
Energy: 1.5739314807061529
Energy: 1.4921700261307322
Energy: 1.433392722327328
Energy: 1.4083100347644621
Energy: 1.4243871428878563
Energy: 1.488190703252477
Energy: 1.5314173025061117
Energy: 1.4663223311836098
Energy: 1.4664479443556975
Energy: 1.3004569531388865
Energy: 1.4660192868456365
Energy: 1.500963001459351
Energy: 1.5466588349390213
Energy: 1.465933281347581
Energy: 1.467869644225388
Energy: 1.2983279726474772
Energy: 1.466361494314728
Energy: 1.466616153399541
Energy: 1.5424598650655397
Energy: 1.437533772266206
Energy: 1.4282810475362906
Energy: 1.3935707812822735
Energy: 1.349992346304696
Energy: 1.4478708097083406
Energy: 1.30382192255786
Energy: 1.3556652331799466
Energy: 1.348075377397018
Energy: 1.3560297774811165
Energy: 1.3530239096999102
Energy: 1.46002512668542

minimum gb energy = 1.2983279726474772 eV
minimum distance =  2.20800140551192 Angstroms
sigma value = 51


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

Energy: 2.4920855773741475
Energy: 1.4838476738894255
Energy: 1.4892994894434428
Energy: 1.6063684058938221
Energy: 1.4227443944552358
Energy: 1.4846274665781243
Energy: 1.3378570856721737
Energy: 1.5048015705952211
Energy: 1.4188870210838558
Energy: 1.55075229341253
Energy: 1.419179335998415
Energy: 1.420985535005351
Energy: 1.5302606242378929
Energy: 1.420775355921341
Energy: 1.505367179248745
Energy: 1.5052560963798745
Energy: 1.41887862137335
Energy: 1.4175455059817839
Energy: 1.5098178982958175
Energy: 1.4186655048383514
Energy: 1.418689910906384
Energy: 1.5304916121624184
Energy: 1.4188077508349843
Energy: 1.4213468788808699
Energy: 1.5112628348446548
Energy: 1.424181471509783
Energy: 1.4272132077331012
Energy: 1.5253540303584694
Energy: 1.5084749059314677
Energy: 1.4256465875310613
Energy: 1.5569386065116553
Energy: 1.501809113517096
Energy: 1.5023318425266998
Energy: 1.5170325956744206
Energy: 1.5014852433472923
Energy: 1.5132771729927263
Energy: 1.5317332732945383
Energy: 1.5037828201949415
Energy: 1.5019784712758637
Energy: 1.6757092254514478
Energy: 1.5024071003644044
Energy: 1.502455125412916
Energy: 1.6537840260192629
Energy: 1.5444088891427923
Energy: 1.4183274004977493
Energy: 1.516631621760162
Energy: 1.5009752432967445
Energy: 1.542458445479684
Energy: 1.3085616007085037
Energy: 1.4220084879794501
Energy: 1.418020731894847
Energy: 1.5038225161844336
Energy: 1.4189891721666634
Energy: 1.48309893883823
Energy: 1.3027672664902379
Energy: 1.418457601853615
Energy: 1.418262358073878
Energy: 1.5171074540186935
Energy: 1.4190706158794277
Energy: 1.4842746603973584
Energy: 1.5303347473239912
Energy: 1.4273166811893767
Energy: 1.5422685522477946
Energy: 1.5304446147044195
Energy: 1.5413088224427567
Energy: 1.4262445291593682
Energy: 1.5318268815052187
Energy: 1.4188440501602821
Energy: 1.4197883257568082
Energy: 1.5227899536471983
Energy: 1.4184307710014392
Energy: 1.4175273216684308
Energy: 1.5014022709318386
Energy: 1.4175999187855919
Energy: 1.4196984526035668
Energy: 1.5298330993918197
Energy: 1.4209211390291383
Energy: 1.4175029948835
Energy: 1.5225462334384756
Energy: 1.4257718568315603
Energy: 1.5417223354849394
Energy: 1.6444466310289132
Energy: 1.5422312766493482
Energy: 1.4260735048412054
Energy: 1.5608402993649446
Energy: 1.499517956990457
Energy: 1.4985441357936904
Energy: 1.7194640650711803
Energy: 1.4999667809718953
Energy: 1.4987960182650848
Energy: 1.5270745887566857
Energy: 1.5042303687195675
Energy: 1.498716691875032
Energy: 1.6970867637819023
Energy: 1.5005456616523802
Energy: 1.500164581357545
Energy: 1.6433390409513358
Energy: 1.5427806540028883
Energy: 1.4257535257892278
Energy: 1.6765048297304412
Energy: 1.5422587308678977
Energy: 1.5412059237928022
Energy: 1.3060241308964764
Energy: 1.417860946994862
Energy: 1.4181260788996277
Energy: 1.4959397070936433
Energy: 1.4186729084573342
Energy: 1.488958834048265

minimum gb energy = 1.3027672664902379 eV
minimum distance =  2.21679665153436 Angstroms
sigma value = 19


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

Energy: 1.4699631640341164
Energy: 1.5261130497077948
Energy: 1.4821723369507032
Energy: 1.554442448215105
Energy: 1.4553851227998684
Energy: 1.526572914885749
Energy: 1.5484449544888226
Energy: 1.6693556413704604
Energy: 1.4545180768112556
Energy: 1.446329269922721
Energy: 1.5180107808192225
Energy: 1.5535346531462761
Energy: 1.519171020084992
Energy: 1.5405085070220104
Energy: 1.5385634523292888
Energy: 1.526277982512245
Energy: 1.5392665540345112
Energy: 1.5392409308634416
Energy: 1.6851934044076942
Energy: 1.539210597435142
Energy: 1.5386081832934804
Energy: 1.650946022411168
Energy: 1.5388098070874974
Energy: 1.5390868262581072
Energy: 1.688662873606822
Energy: 1.5475780012819327
Energy: 1.528617282632756
Energy: 1.4465389780010312
Energy: 1.669544280586982
Energy: 1.6202390912128686
Energy: 1.6863424006104042
Energy: 1.540403279920112
Energy: 1.5760549547032128
Energy: 1.4495127830755734
Energy: 1.5408085377468224
Energy: 1.5451164621193914
Energy: 1.6937797268418877
Energy: 1.5856872844642722
Energy: 1.5539624863797428
Energy: 1.5539940164232116
Energy: 1.5415107603548557
Energy: 1.5462253271269757
Energy: 1.545729883375442
Energy: 1.5389966982314458
Energy: 1.521250472948068
Energy: 1.4513494264190399
Energy: 1.6708491361892974
Energy: 1.5404223802984593
Energy: 1.6226100204725689
Energy: 1.520941960286001
Energy: 1.4539612434056015
Energy: 1.4457275624583577
Energy: 1.4542151060478172
Energy: 1.5481569889890243
Energy: 1.552578113950621
Energy: 1.453645017416272
Energy: 1.454081849529388
Energy: 1.471693334344142
Energy: 1.455019006550769
Energy: 1.5373491648333224
Energy: 1.47678648455172
Energy: 1.5482458319392594
Energy: 1.51802929253668
Energy: 1.4698113097407208
Energy: 1.519183380596477
Energy: 1.5390081551632961
Energy: 1.6299486434678763
Energy: 1.555780656965468
Energy: 1.5577047253755478
Energy: 1.6779876746578524
Energy: 1.558546626034888
Energy: 1.5683938729695643
Energy: 1.7896024747758843
Energy: 1.561512001364107
Energy: 1.5598379175420454
Energy: 1.6610734379551721
Energy: 1.5629119767126878
Energy: 1.6276396756041787
Energy: 1.5610025826725042
Energy: 1.5841312513878911
Energy: 1.559500403537603
Energy: 1.597341086881586
Energy: 1.539279956090665
Energy: 1.5484747744209704
Energy: 1.4693717905693529
Energy: 1.458598601304966
Energy: 1.5757072045354759
Energy: 1.378406905236247
Energy: 1.5188548393937766
Energy: 1.473953427870024
Energy: 1.4470268818853003
Energy: 1.4555649885006312
Energy: 1.5049057335303822
Energy: 1.3788714934711575
Energy: 1.4534703735460675
Energy: 1.454119077171705
Energy: 1.5408640474504038
Energy: 1.5227329617030076
Energy: 1.5396025018263737
Energy: 1.5366560337335047
Energy: 1.5456412631592258
Energy: 1.5208271650233764
Energy: 1.5755417860977328
Energy: 1.5388697662938522
Energy: 1.5390289566869517
Energy: 1.6302643578677958
Energy: 1.5385370560503748
Energy: 1.541733896246316
Energy: 1.574602923568376
Energy: 1.538781207734244
Energy: 1.5411896849717328
Energy: 1.6387428407984557
Energy: 1.5404866953809653
Energy: 1.5399110067862292
Energy: 1.5008802162102466
Energy: 1.5280497161148647
Energy: 1.5478680136967036
Energy: 1.5370108453518125
Energy: 1.5469033007511852
Energy: 1.5016865834977002
Energy: 1.5061237100205505
Energy: 1.5395678175019911
Energy: 1.5942577869772736
Energy: 1.6765716611396366
Energy: 1.5385953334445188
Energy: 1.5760754896744695
Energy: 1.3779457531560673
Energy: 1.538492468236469
Energy: 1.5401036855778123
Energy: 1.630631408165999
Energy: 1.5387420729029262
Energy: 1.5516894916582744
Energy: 1.45428284778426
Energy: 1.5194388325796857
Energy: 1.5429998640512972
Energy: 1.5359002806313575
Energy: 1.5456713104590079
Energy: 1.518660290823777
Energy: 1.4494151131979187
Energy: 1.453543599577059
Energy: 1.5369791016392325
Energy: 1.5957996696426848
Energy: 1.453761875878213
Energy: 1.453913309697729
Energy: 1.469779909184724
Energy: 1.454272516470149
Energy: 1.5175976814107497
Energy: 1.5960483418097513
Energy: 1.4536208799370276
Energy: 1.453729038356022
Energy: 1.4799583176406335
Energy: 1.7378800586945018
Energy: 1.5393876093772132
Energy: 1.5381842690861847
Energy: 1.5398303115743166
Energy: 1.5164325063048532
Energy: 1.5983125724544456
Energy: 1.5561571005990802
Energy: 1.5564592601463068
Energy: 1.6612621314910518
Energy: 1.5615912036159332
Energy: 1.5560106251070571
Energy: 1.6302373177283478
Energy: 1.5557717098479058
Energy: 1.5579116170111562
Energy: 1.791725592539189
Energy: 1.5558433449683047
Energy: 1.571171619909732
Energy: 1.5439906273362891
Energy: 1.5471839622400954
Energy: 1.5177425677650496
Energy: 1.4791737688502262
Energy: 1.5286225448050101
Energy: 1.560799949913708
Energy: 1.37639881968096
Energy: 1.5185326864273838
Energy: 1.453463262095293
Energy: 1.4680254839390232
Energy: 1.4540488392979554
Energy: 1.5051899452067636

minimum gb energy = 1.37639881968096 eV
minimum distance =  2.20649682878781 Angstroms
sigma value = 27


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

Energy: 1.815978960146688
Energy: 1.4673153699822474
Energy: 1.5278609056985262
Energy: 1.3084605717536246
Energy: 1.5236118434639994
Energy: 1.468929468825256
Energy: 1.2935690386409586
Energy: 1.6093315846323437
Energy: 1.305464364689451
Energy: 1.3036554109880825
Energy: 1.4213384478601128
Energy: 1.4356338210872037
Energy: 1.3085814120850583
Energy: 1.4223031917436142
Energy: 1.4270097986951684
Energy: 1.3033480662350136
Energy: 1.4210516853118742
Energy: 1.3092531937023708
Energy: 1.5033185473309323
Energy: 1.4201698113474455
Energy: 1.420730192842187
Energy: 1.4268823884093673
Energy: 1.4215448182896877
Energy: 1.4202996573709814
Energy: 1.3046995621747257
Energy: 1.4284322410885166
Energy: 1.4224682536587017
Energy: 1.3053870508416687
Energy: 1.4683182107649841
Energy: 1.431244941466635
Energy: 1.3617613486267346
Energy: 1.420020962201703
Energy: 1.4636120945791202
Energy: 1.3077081808190785
Energy: 1.4644859203255307
Energy: 1.5452670674768487
Energy: 1.3113240844213807
Energy: 1.5254422472745637
Energy: 1.467404522634372
Energy: 1.8399195783521696
Energy: 1.4329193880102302
Energy: 1.6244424347639204
Energy: 1.3036233443422658
Energy: 1.4284898578144116
Energy: 1.4346607697199625
Energy: 1.3067680852075458
Energy: 1.4661121968161606
Energy: 1.3055671519884986
Energy: 1.3030132158841434
Energy: 1.4218299126330172
Energy: 1.4207477183251427
Energy: 1.305257961149626
Energy: 1.4226956976241638
Energy: 1.4662036020158038
Energy: 1.5210534944333478
Energy: 1.4231752725217803
Energy: 1.421416200232541
Energy: 1.5427963293332616
Energy: 1.4207132148544341
Energy: 1.4217136777712163
Energy: 1.3055042504071257
Energy: 1.4697029321957886
Energy: 1.4369315810293546
Energy: 1.3044998624511115
Energy: 1.4231067775978425
Energy: 1.3076302743205404
Energy: 1.307476363837035
Energy: 1.463531490296949
Energy: 1.422421389031453
Energy: 1.3612966290575383
Energy: 1.4237206002061737
Energy: 1.4385921137098454

minimum gb energy = 1.2935690386409586 eV
minimum distance =  2.22702277014328 Angstroms
sigma value = 9


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

Energy: 1.6391451160350115
Energy: 1.5134270056271009
Energy: 1.5596764757133328
Energy: 1.5213137330300723
Energy: 1.444336959663054
Energy: 1.566868639134414
Energy: 1.5082043299473158
Energy: 1.573361390166697
Energy: 1.4484179047108603
Energy: 1.5128547450765022
Energy: 1.434110645356165
Energy: 1.5118938161577338
Energy: 1.5795388666637205
Energy: 1.5907717424723697
Energy: 1.626511610083418
Energy: 1.5102883554591742
Energy: 1.597367339530638
Energy: 1.4561184994381384
Energy: 1.364549969499327
Energy: 1.620767270212274
Energy: 1.6272218053968879
Energy: 1.4566868024590878
Energy: 1.594597333895705
Energy: 1.6640047419924269
Energy: 1.5209640741850121
Energy: 1.628669975365866
Energy: 1.5573565778780007
Energy: 1.5775016997457436
Energy: 1.5908929778198504
Energy: 1.5455827418064345
Energy: 1.5067029009683974
Energy: 1.428057291148639
Energy: 1.5999595934244482
Energy: 1.5715258945426405
Energy: 1.4390543560634148
Energy: 1.4428648364022965
Energy: 1.4255804474597369
Energy: 1.4633457744236131
Energy: 1.5362343955025732
Energy: 1.577166833587888
Energy: 1.4420157110825984
Energy: 1.4551897884928253
Energy: 1.4080520543903592
Energy: 1.4370055307590728
Energy: 1.6650030210423614
Energy: 1.5029378913544622
Energy: 1.4319518228477535
Energy: 1.420804985351067
Energy: 1.4510685961485137
Energy: 1.5935416390507977
Energy: 1.709075360539307
Energy: 1.5653271607908037
Energy: 1.5734315440809816
Energy: 1.4168303689061366
Energy: 1.427776524978021
Energy: 1.5906477963959036
Energy: 1.5693416092642276
Energy: 1.5024462647454457
Energy: 1.5656147153286022
Energy: 1.6502372161676635
Energy: 1.5004926071239004
Energy: 1.611105782844778
Energy: 1.569381228289359
Energy: 1.6159306404719043
Energy: 1.5870768374768667
Energy: 1.4709793527427946
Energy: 1.5159140020957484
Energy: 1.5626011879327661
Energy: 1.5214456199915143
Energy: 1.5772861491918932
Energy: 1.5268221331932628
Energy: 1.509304253893301
Energy: 1.4751724013631242
Energy: 1.533057525182698
Energy: 1.5356872446214032
Energy: 1.4818476527677826
Energy: 1.5389133356759486
Energy: 1.567755232691483
Energy: 1.525314745584388
Energy: 1.5371479769353165
Energy: 1.5046250942362924
Energy: 1.5029741597925996
Energy: 1.525810736548138
Energy: 1.6061896056737477
Energy: 1.500046471503976
Energy: 1.5650090916406934
Energy: 1.4801690436349044
Energy: 1.492029128013386
Energy: 1.5276806855134946
Energy: 1.600079611558193
Energy: 1.666623580790141
Energy: 1.5283348970763884
Energy: 1.5518070321961908
Energy: 1.5009059491847088
Energy: 1.5279335532007412
Energy: 1.5497955802201369
Energy: 1.5024162551302962
Energy: 1.5200833122002426
Energy: 1.5746259426840037
Energy: 1.5602749946513452
Energy: 1.5314929386125034
Energy: 1.5464118010416634
Energy: 1.4940283507884318
Energy: 1.566316927831638
Energy: 1.5352575009927663
Energy: 1.566622345879936
Energy: 1.5717738682330389
Energy: 1.51289232739915
Energy: 1.4586117080132042
Energy: 1.5676453321554062
Energy: 1.565634278960124
Energy: 1.43065470123908
Energy: 1.5663050335523174
Energy: 1.6282787562437036
Energy: 1.4946250797864271
Energy: 1.5652077929069808
Energy: 1.5747072953430856
Energy: 1.6006606594890653
Energy: 1.5819878930611915
Energy: 1.6230601360647705
Energy: 1.4145745969219696
Energy: 1.4074508269664991
Energy: 1.5209693040643983
Energy: 1.5638007574920583
Energy: 1.657756796730247
Energy: 1.4281294257472739
Energy: 1.4060797105493914
Energy: 1.440873493750063
Energy: 1.491344578500579
Energy: 1.364690686801718
Energy: 1.4434549658772287
Energy: 1.4061926851469897
Energy: 1.5045981343296164
Energy: 1.4329921541444717
Energy: 1.592441829497115
Energy: 1.5416631772438758
Energy: 1.4293882400555513
Energy: 1.4332785780389443
Energy: 1.5400027894892117
Energy: 1.5973114636424959
Energy: 1.5832511907466313
Energy: 1.5614899857956366
Energy: 1.6135006578796987
Energy: 1.4281053323632549
Energy: 1.4597118317649997
Energy: 1.5924708200953166
Energy: 1.6253576795678277
Energy: 1.4428195515709417
Energy: 1.600035589733462
Energy: 1.6222998510672273
Energy: 1.5140514846620785
Energy: 1.5982732362528773
Energy: 1.6216211452235654
Energy: 1.3836086351089427
Energy: 1.5917866434379062
Energy: 1.554033782325836
Energy: 1.5692711072370962
Energy: 1.6022717747318762
Energy: 1.448812094815972
Energy: 1.497806461933051
Energy: 1.4716333179596814
Energy: 1.5112840835472858
Energy: 1.6166165228193852
Energy: 1.4342610302243113
Energy: 1.4467764165892263
Energy: 1.4675421816650396
Energy: 1.4329414900981357
Energy: 1.5244956092152728
Energy: 1.5302320556387743
Energy: 1.4505116369715334
Energy: 1.4358432966401695
Energy: 1.4091358747340352
Energy: 1.4328692978310034
Energy: 1.5615989438999578
Energy: 1.5710338181206394
Energy: 1.5708195421314317
Energy: 1.445749781832561
Energy: 1.4267151729767018
Energy: 1.6861407568644289
Energy: 1.5007239257935931
Energy: 1.6506841028617583
Energy: 1.5901825157865865
Energy: 1.5996125201625921
Energy: 1.4915464674510108
Energy: 1.5683873270897686
Energy: 1.57058334157671
Energy: 1.6639204338295852
Energy: 1.5724686359010425
Energy: 1.6071238741619858
Energy: 1.4527517638180223
Energy: 1.5771090005359678
Energy: 1.6014149277215652
Energy: 1.5872300860876585
Energy: 1.5241595092627498
Energy: 1.6154603007607076
Energy: 1.5029647338593315
Energy: 1.5712675784307941
Energy: 1.508888680191541
Energy: 1.5338640153782155
Energy: 1.524163293586119
Energy: 1.5191640048861996
Energy: 1.459738158559504
Energy: 1.5227687501059008
Energy: 1.5706210449557918
Energy: 1.505433467769307
Energy: 1.5206373064521366
Energy: 1.5299342214049099
Energy: 1.5797968370680269
Energy: 1.5473483996665887
Energy: 1.5367225885374942
Energy: 1.4644232285361172
Energy: 1.5602054200776092
Energy: 1.5439388355287187
Energy: 1.497887739049408
Energy: 1.566963607631193
Energy: 1.4747289785141509
Energy: 1.5069013496674333
Energy: 1.5311375435145307
Energy: 1.5367546388612296
Energy: 1.5001510728920988
Energy: 1.5529069197784564
Energy: 1.5438495883671275
Energy: 1.513402120293171
Energy: 1.5228155157660817
Energy: 1.5709685998602838
Energy: 1.4999876123588667
Energy: 1.539767704010528
Energy: 1.5720367407763398
Energy: 1.586939160789452
Energy: 1.5321688168563872
Energy: 1.5723751695610382
Energy: 1.506259087655633
Energy: 1.5684549651211173
Energy: 1.5135791653328512
Energy: 1.5035868461853914
Energy: 1.5774774862345653
Energy: 1.660570093232277
Energy: 1.4488661903256348
Energy: 1.5664741361705912
Energy: 1.5669847362281168
Energy: 1.6044251965823593
Energy: 1.5732477468338868
Energy: 1.6237939376803394
Energy: 1.5128137954997845
Energy: 1.5665687835482895
Energy: 1.5770888029370707
Energy: 1.569822384318855
Energy: 1.579290722810992
Energy: 1.4231962846219632
Energy: 1.410803241368027
Energy: 1.6461542003048109
Energy: 1.503650905433742
Energy: 1.5166225700285672
Energy: 1.434087620809539
Energy: 1.449717104709461
Energy: 1.399413186107393
Energy: 1.434797704770602
Energy: 1.5182649957565177

minimum gb energy = 1.364549969499327 eV
minimum distance =  2.19380401828556 Angstroms
sigma value = 57


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

Energy: 2.728739288443032
Energy: 1.54067145401853
Energy: 1.2845012359671848
Energy: 1.2817346555719764
Energy: 1.4098108929349267
Energy: 1.5275731303586626
Energy: 1.2472460818888138
Energy: 1.5687137104167903
Energy: 1.4034857394929214
Energy: 1.2482525720249238
Energy: 1.428279707473727
Energy: 1.5348101018620528
Energy: 1.2505895850779591
Energy: 1.5295021612697106
Energy: 1.5367488694660985
Energy: 1.2535687325967027
Energy: 1.5337202802829661
Energy: 1.4069702026532689
Energy: 1.3585458427037036
Energy: 1.5384602957197473
Energy: 1.5371474813180572
Energy: 1.4795810375437959
Energy: 1.5318235188556428
Energy: 1.2414543846435209
Energy: 1.2413242064872678
Energy: 1.4869677876320662
Energy: 1.5547203672794319
Energy: 1.2484038742114005
Energy: 1.5307281206593326
Energy: 1.4710168370768066
Energy: 1.2451673109915113
Energy: 1.4235266118107222
Energy: 1.5491460191580828
Energy: 1.2540540360530266
Energy: 1.4134136027469475
Energy: 1.400840840910915
Energy: 1.280024747663444
Energy: 1.404741145232762
Energy: 1.4053696162144431
Energy: 1.4939778655123348
Energy: 1.408433220839752
Energy: 1.4085584023879902
Energy: 1.3160324144490592
Energy: 1.4004156110056598
Energy: 1.5504572017239757
Energy: 1.2661561015129568
Energy: 1.438955990084017
Energy: 1.3992816299196686
Energy: 1.2833669488535413
Energy: 1.285991290593447
Energy: 1.5509669443130785
Energy: 1.2497593477259006
Energy: 1.5422183700729464
Energy: 1.2874584022163114
Energy: 1.285973856670995
Energy: 1.3999926838069765
Energy: 1.5172696387147557
Energy: 1.528624698504682
Energy: 1.4033214804189114
Energy: 1.2867481723817273
Energy: 1.244994449530556
Energy: 1.4068670593043968
Energy: 1.5356198762140627
Energy: 1.2414776990984149
Energy: 1.400655277865631
Energy: 1.4206266601651245
Energy: 1.265102058674161
Energy: 1.5451198040179621
Energy: 1.529717548387219
Energy: 1.2470931212132685
Energy: 1.5333516677172832
Energy: 1.401878434932337
Energy: 1.248701125362066
Energy: 1.5309125667949453
Energy: 1.4571183314054093
Energy: 1.2479208364204784
Energy: 1.5470954239054562
Energy: 1.5322495250474977
Energy: 1.2473713714858672
Energy: 1.551760106117069
Energy: 1.4979058898722861
Energy: 1.240283910259971
Energy: 1.53279989707783
Energy: 1.5540836675827874
Energy: 1.2473630745858433
Energy: 1.5447543172486737
Energy: 1.4105391967935923
Energy: 1.2459366953551188
Energy: 1.4037537827033337
Energy: 1.5338849002153154
Energy: 1.2437948209281235
Energy: 1.4126825670198178
Energy: 1.407098351724581
Energy: 1.2471872957914252
Energy: 1.4174697173347857
Energy: 1.484380960739224
Energy: 1.2412828136287901
Energy: 1.4054367969104617
Energy: 1.4035704753954468
Energy: 1.3114752718091331
Energy: 1.4027762713521787
Energy: 1.5544292542620308
Energy: 1.2472031356450968
Energy: 1.5332354466693479
Energy: 1.4008286287690817
Energy: 1.2797385983947436
Energy: 1.4079536820639473
Energy: 1.5263461695993294
Energy: 1.240439871348117
Energy: 1.5558249303371832
Energy: 1.4009651389480378
Energy: 1.3155274952107763
Energy: 1.4045333843889334
Energy: 1.571597376162375

minimum gb energy = 1.240283910259971 eV
minimum distance =  2.20210166035004 Angstroms
sigma value = 11


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

Energy: 1.6375203984058382
Energy: 1.4446014633097377
Energy: 1.3542875122217723
Energy: 1.317238023049027
Energy: 1.4764057220680658
Energy: 1.43386109044456
Energy: 1.411109733927634
Energy: 1.4382159571609179
Energy: 1.3230587932084095
Energy: 1.2004298186735165
Energy: 1.3372423035823857
Energy: 1.5091409807046825
Energy: 1.488506127268911
Energy: 1.5032094138499783
Energy: 1.4315342624088534
Energy: 1.4355981935869604
Energy: 1.4325523330541412
Energy: 1.4663189710583615
Energy: 1.3079561824404395
Energy: 1.4869239651111654
Energy: 1.3767472183763265
Energy: 1.4310751854491452
Energy: 1.4586789519499683
Energy: 1.4764943555991614
Energy: 1.331223035751104
Energy: 1.4700683781209727
Energy: 1.4606903600494612
Energy: 1.440737625025
Energy: 1.456615093163085
Energy: 1.483560953349607
Energy: 1.40872892504669
Energy: 1.4705177822184847
Energy: 1.516702456272686
Energy: 1.4143563335590779
Energy: 1.4976636219295898
Energy: 1.471621290660565
Energy: 1.506490739501746
Energy: 1.3753581386505813
Energy: 1.5030261747468927
Energy: 1.5053916873308633
Energy: 1.4732470960936697
Energy: 1.339068041696917
Energy: 1.3590563470418076
Energy: 1.460357171193858
Energy: 1.5073076031592065
Energy: 1.4237619092673304
Energy: 1.4801722018873136
Energy: 1.374379181977575
Energy: 1.4992425399766134
Energy: 1.3072940721940758
Energy: 1.4997103471910942
Energy: 1.4781454285841495
Energy: 1.4747250528485665
Energy: 1.3144924891194125
Energy: 1.4078712391543446
Energy: 1.3237892633403505
Energy: 1.3706749519181665
Energy: 1.464706060271819
Energy: 1.3486543136845153
Energy: 1.3065614192784467
Energy: 1.3465255629812385
Energy: 1.303456931108378
Energy: 1.3245343873885802
Energy: 1.4893762193374611
Energy: 1.2971551322600134
Energy: 1.3133797809808991
Energy: 1.3492243887765631
Energy: 1.3135582620640385
Energy: 1.4851839297218228
Energy: 1.4997555180525133
Energy: 1.4214815097345423
Energy: 1.3150356862982275
Energy: 1.325948966434749
Energy: 1.4189951113914494
Energy: 1.4831086245597451
Energy: 1.490703480705349
Energy: 1.4528775934110585
Energy: 1.2945925840323365
Energy: 1.2659940634098852
Energy: 1.4263420072609247
Energy: 1.4610972843179517
Energy: 1.5774685985887869
Energy: 1.4526257281297454
Energy: 1.2209661227214126
Energy: 1.3108219020441019
Energy: 1.4623103429724424
Energy: 1.4596327572847914
Energy: 1.4782421240323347
Energy: 1.472882968310016
Energy: 1.3804107543902513
Energy: 1.3615003774117829
Energy: 1.4393011706397405
Energy: 1.4831088664032972
Energy: 1.6383591759463778
Energy: 1.4540715906159862
Energy: 1.4484320666250272
Energy: 1.3457219118688224
Energy: 1.4390462085568454
Energy: 1.4906943773134484
Energy: 1.4928426241028159
Energy: 1.4642949706381505
Energy: 1.4904900308807743
Energy: 1.412434754500961
Energy: 1.4416129458042874
Energy: 1.459088252651316
Energy: 1.5130480430531996
Energy: 1.4509894531275465
Energy: 1.456084873824719
Energy: 1.4948721424324807
Energy: 1.4567500446955806
Energy: 1.468031944120849
Energy: 1.5515623572681088
Energy: 1.4648998099919246
Energy: 1.4709414236297502
Energy: 1.5827488362863091
Energy: 1.4593816064908658
Energy: 1.3844867086783879
Energy: 1.261274071409224
Energy: 1.4633016452580903
Energy: 1.4700139451753538
Energy: 1.4150598203173015
Energy: 1.4819689569895877
Energy: 1.3775001733626324
Energy: 1.3238486703587151
Energy: 1.4573570953043884
Energy: 1.4524102067645162
Energy: 1.5633937589701496
Energy: 1.5128588859341146
Energy: 1.3400233142038027
Energy: 1.2325513151668843
Energy: 1.412085370899181
Energy: 1.509832525475191
Energy: 1.349826920585032
Energy: 1.3693409782325277
Energy: 1.3384446584938967
Energy: 1.2470669207675924
Energy: 1.3656716718104809
Energy: 1.4482007110081936
Energy: 1.373335065771932
Energy: 1.3415767526263975
Energy: 1.3038615702274956
Energy: 1.2214788965856478
Energy: 1.328117029193216
Energy: 1.4950251545145297
Energy: 1.4827965503081406
Energy: 1.4338039667949378
Energy: 1.2558227466282932
Energy: 1.2212410398215734
Energy: 1.415452857384822
Energy: 1.481546207709332
Energy: 1.4347864479399053
Energy: 1.3247586720514397
Energy: 1.2260700868159504
Energy: 1.2160070291676475
Energy: 1.3531191487356609
Energy: 1.3990175368769415

minimum gb energy = 1.2004298186735165 eV
minimum distance =  2.18579824041716 Angstroms
sigma value = 41


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

Energy: 2.15055370700149
Energy: 1.0872017953027289
Energy: 1.0843080223738315
Energy: 1.19558390093902
Energy: 1.0873678219983764
Energy: 1.359431478814935
Energy: 1.4249385688772707
Energy: 1.3549952885043843
Energy: 1.0985622997179676
Energy: 1.2683173229393188
Energy: 1.2010922187453155
Energy: 1.3613424471665074
Energy: 1.099994081160959
Energy: 1.3519742762808757
Energy: 1.3277828832152865
Energy: 1.24774565424864
Energy: 1.3167371124713305
Energy: 1.3508551709390522
Energy: 2.007001267000352
Energy: 1.3211640856615114
Energy: 1.3295171281702542
Energy: 1.2409852637986447
Energy: 1.3173216999912343
Energy: 1.348002831346217
Energy: 1.2652096898323761
Energy: 1.3244330550280092
Energy: 1.3159266763507367
Energy: 1.3799393783565936
Energy: 1.3215348661865778
Energy: 1.3532903266031842
Energy: 1.4309373058070671
Energy: 1.3514639450260877
Energy: 1.3621963378553976
Energy: 1.3861514407621998
Energy: 1.3642146372821913
Energy: 1.3560163982290756
Energy: 1.441452734140215
Energy: 1.361712776583308
Energy: 1.353636219267207
Energy: 1.3596995190780483
Energy: 1.3578766674581138
Energy: 1.3749307255451497
Energy: 1.421158706773302
Energy: 1.3654047628357584
Energy: 1.3809506667271148
Energy: 1.3869923986229884
Energy: 1.370454864722447
Energy: 1.379463926640792
Energy: 1.4278285957291337
Energy: 1.3732793982917966
Energy: 1.3577265529813896
Energy: 1.354430781221378
Energy: 1.3604516780307212
Energy: 1.3190099302732912
Energy: 1.258026215272635
Energy: 1.315770665550806
Energy: 1.315527554846525
Energy: 1.356447852768409
Energy: 1.3185437238625242
Energy: 1.2393171797434106
Energy: 1.324725527148525
Energy: 1.318485930046096
Energy: 1.3162220186016975
Energy: 1.3874287979162843
Energy: 1.325675891229991
Energy: 1.241134330279302
Energy: 1.269912113896733
Energy: 1.2402660997084862
Energy: 1.365490110387958
Energy: 1.352934671915761
Energy: 1.3301313521666862
Energy: 1.2425976212843606
Energy: 1.2545827578652804
Energy: 1.1838311395128684
Energy: 1.2380828805593476
Energy: 1.349686777392928
Energy: 1.1876487186713065
Energy: 1.0911722409054392
Energy: 1.0799681757506803
Energy: 1.1879175108109843
Energy: 1.3177921964673895
Energy: 1.335098159629636
Energy: 1.1921883333024965
Energy: 1.0902990212132821
Energy: 1.0914913661479204
Energy: 1.1914308529394266
Energy: 1.3556496556855195
Energy: 1.3561312051527517
Energy: 1.1877135495588675
Energy: 1.1893239852564614
Energy: 1.0865810151623627
Energy: 1.184525829309226
Energy: 1.3361795456067684
Energy: 1.3772522314214817
Energy: 1.3387894988880285
Energy: 1.0883005882516943
Energy: 1.0796102329302233
Energy: 1.0833039951870211
Energy: 1.2927532540638715
Energy: 1.3521734137173431
Energy: 1.1831890847293198
Energy: 1.087562145725403
Energy: 1.2563088756512812
Energy: 1.1835600993760578
Energy: 1.3384738300500365
Energy: 1.3515298305119323
Energy: 1.1901618696313347
Energy: 1.0837148849815315
Energy: 1.3076759292538152
Energy: 1.3158713858831554
Energy: 1.3532996673028705
Energy: 1.3526913144995674
Energy: 1.3559631261168024
Energy: 1.2445116971959445
Energy: 1.3130063425553078
Energy: 1.3188429696168387
Energy: 1.3168801346623917
Energy: 1.3613328610839859
Energy: 1.3189953073472114
Energy: 1.2435079186668057
Energy: 1.2585054871491057
Energy: 1.317755647127822
Energy: 1.3540113684468125
Energy: 1.3517123465289673
Energy: 1.315315107282199
Energy: 1.2388254978570445
Energy: 1.2817480190486104
Energy: 1.348302067226901
Energy: 1.359722813721658
Energy: 1.356771318209527
Energy: 1.3720620127210807
Energy: 1.3162475114433185
Energy: 1.2688709519799126
Energy: 1.3568061736237327
Energy: 1.3801898882541137
Energy: 1.4500735721216866
Energy: 1.3600740050295825
Energy: 1.352180913945831
Energy: 1.258839280033951
Energy: 1.363425361150231
Energy: 1.3548340444472524
Energy: 1.3802731498801728
Energy: 1.361266768645376
Energy: 1.3603244354736417
Energy: 1.4413926326194029
Energy: 1.35255083584852
Energy: 1.3745532596763044
Energy: 1.4069311778716926
Energy: 1.3664084751910879
Energy: 1.3515694541484429
Energy: 1.7143744177298799
Energy: 1.317485308363136
Energy: 1.31655708851806
Energy: 1.3834905863236127
Energy: 1.3183376171723746
Energy: 1.3234688475580034
Energy: 1.4205164947759434
Energy: 1.3225832596216465
Energy: 1.2408710412836839
Energy: 1.2437197850099393
Energy: 1.3190593962978006
Energy: 1.323999685154473
Energy: 1.4398677815275227
Energy: 1.3296000769159968
Energy: 1.2358415322069662
Energy: 1.2499617960457594
Energy: 1.3217783005024262
Energy: 1.37818274691349
Energy: 1.4210311286724377
Energy: 1.2358979968091823
Energy: 1.1940312770165995
Energy: 1.2576691725211757
Energy: 1.200270748641596
Energy: 1.3563978317926104
Energy: 1.4338123385131378
Energy: 1.183069177611997
Energy: 1.0846604974185168
Energy: 1.0830101455532986
Energy: 1.0815883603022445
Energy: 1.320398504521229
Energy: 1.4284962353313049
Energy: 1.2106108876121624
Energy: 1.1854259574442598
Energy: 1.0933567184158486
Energy: 1.192072943843057
Energy: 1.3603376020393891
Energy: 1.4407058447769838
Energy: 1.3320555163995125
Energy: 1.085054424991061
Energy: 1.0879690561620659
Energy: 1.1887015560137393
Energy: 1.352676293132869
Energy: 2.0117704730815285
Energy: 1.1904640556753863
Energy: 1.0911330033514566
Energy: 1.0919484668165915
Energy: 1.182511870572983
Energy: 1.2750103326897984

minimum gb energy = 1.0796102329302233 eV
minimum distance =  2.18917974802905 Angstroms
sigma value = 33


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

Energy: 2.188323689678477
Energy: 0.948962816915796
Energy: 0.9574170449517987
Energy: 1.084012416176364
Energy: 0.9974475378586914
Energy: 1.127827591519919
Energy: 2.0467150627629067
Energy: 1.1086674917364097
Energy: 0.9610688236381106
Energy: 1.0786682799775642
Energy: 0.953895430615441
Energy: 1.1785715261098455
Energy: 1.938434951436879
Energy: 1.1626732435956515
Energy: 1.0616253589855456
Energy: 1.061198043165111
Energy: 1.1396511588996296
Energy: 1.1970575377128396
Energy: 2.0918169062504575
Energy: 1.1539940936090427
Energy: 1.05902323659567
Energy: 1.058971422225831
Energy: 1.063015037025416
Energy: 1.2275383839653664
Energy: 2.072950654068933
Energy: 1.1533724992981227
Energy: 1.1440474624992207
Energy: 1.1750454421505812
Energy: 1.1494963742636304
Energy: 1.2344120139414896
Energy: 1.9370487826652274
Energy: 1.2188391433023058
Energy: 1.1788314394690376
Energy: 1.236231753855894
Energy: 1.1737958783856008
Energy: 1.1968753447877731
Energy: 2.0237934289939936
Energy: 1.1929072739914555
Energy: 1.179526771180197
Energy: 1.1938066949413468
Energy: 1.1816402641052366
Energy: 1.1975514926214146
Energy: 1.7177998219526587
Energy: 1.1948901430256742
Energy: 1.1818118663603083
Energy: 1.1912241066431217
Energy: 1.178606072431154
Energy: 1.1946675604748307
Energy: 2.142319356549884
Energy: 1.2173068813391454
Energy: 1.1816787612905997
Energy: 1.187439498422574
Energy: 1.2093854043100454
Energy: 1.203690657127486
Energy: 1.825448539378575
Energy: 1.1879072146868137
Energy: 1.198798157576338
Energy: 1.1835006972766366
Energy: 1.18618496972555
Energy: 1.1846807811670215
Energy: 1.7077196123422098
Energy: 1.19146436270354
Energy: 1.188731631927299
Energy: 1.2125920743782743
Energy: 1.1892883583451326
Energy: 1.1857046806453984
Energy: 1.676083914782209
Energy: 1.186442698879711
Energy: 1.2059478157093912
Energy: 1.1877783668725803
Energy: 1.18661299535098
Energy: 1.187867378484777
Energy: 1.56985845772968
Energy: 1.172172584865564
Energy: 1.190836569145296
Energy: 1.2190772947840498
Energy: 1.1818234177524392
Energy: 1.1724276745846727
Energy: 1.4464014935208964
Energy: 1.1688139968867353
Energy: 1.1738068576573588
Energy: 1.1822604002457018
Energy: 1.1770124216581497
Energy: 1.1859156118488123
Energy: 1.3855613893007166
Energy: 1.1714994379047974
Energy: 1.1968002426601172
Energy: 1.2025687032055352
Energy: 1.1955138618507224
Energy: 1.1979924066466658
Energy: 1.3820478917685681
Energy: 1.1896522708395185
Energy: 1.1720058624289649
Energy: 1.1915760707302416
Energy: 1.1735490497447747
Energy: 1.1508530035107871
Energy: 1.375826787152587
Energy: 1.0287178993390373
Energy: 1.1669999849457693
Energy: 1.1596038569542686
Energy: 1.1587608276680186
Energy: 1.024526179637798
Energy: 1.1429120752521877
Energy: 1.122487488388582
Energy: 1.1543593809657828
Energy: 1.209864341638988
Energy: 1.154457378472324
Energy: 1.0334560118268665
Energy: 1.1333715438280512
Energy: 1.040936809823163
Energy: 1.1774028810363435
Energy: 1.1783359183117577
Energy: 1.1683198557477144
Energy: 1.0326867308372762
Energy: 1.0615560249790648
Energy: 1.004843593155896
Energy: 1.0161307972176596
Energy: 1.1587491966680918
Energy: 1.024060233192223
Energy: 1.016302650446864
Energy: 1.0219521690096136
Energy: 1.0193570292977758
Energy: 1.1287329256178065
Energy: 1.1679206306648195
Energy: 1.0279282393695774
Energy: 1.0131153768186907
Energy: 1.0314469146577951
Energy: 1.012915773538133
Energy: 1.1966951950110074
Energy: 1.1966696515579105
Energy: 1.1555441031024583
Energy: 1.0032927680522725
Energy: 1.0153961308403527
Energy: 1.0063991644149395
Energy: 1.1462764078352758
Energy: 1.1715164825824798
Energy: 1.1399497020568619
Energy: 0.945236113931348
Energy: 1.0078905009900705
Energy: 0.9490124991809216
Energy: 1.1724983244541565
Energy: 1.1727521097291127
Energy: 0.9477428808955707
Energy: 0.9521800455861089
Energy: 1.1266981717632842
Energy: 1.1158896532347442
Energy: 1.1482861872623955
Energy: 1.2078912162001973
Energy: 0.9496132286282599
Energy: 1.1170533272904581
Energy: 1.1866431727550812
Energy: 1.1025255868578503
Energy: 1.1490433880268245
Energy: 1.1733990582164266
Energy: 1.15992302823907
Energy: 1.1072011571236189
Energy: 1.190778038364141
Energy: 1.1130263136345402
Energy: 1.1265865947844245
Energy: 1.199657904116018
Energy: 1.132977934554686
Energy: 1.1103463981613346
Energy: 1.2967258418480772
Energy: 1.1149474989684487
Energy: 1.1665068979690847
Energy: 1.1894805446453753
Energy: 1.1346084204120137
Energy: 1.1071301178254358
Energy: 1.449981088975023
Energy: 1.1493162348239507
Energy: 1.1992934656129481
Energy: 1.179132870926243
Energy: 1.1852864137001051
Energy: 1.145576824766485
Energy: 1.5281378674621806
Energy: 1.1840116413267072
Energy: 1.2121353825883867
Energy: 1.1955178424176651
Energy: 1.2143013592886445
Energy: 1.144595237987791
Energy: 1.5088839016325672
Energy: 1.1495354465278964
Energy: 1.1893174903374757
Energy: 1.182622032615904
Energy: 1.1850052103865403
Energy: 1.15913816753205
Energy: 1.7503762609632925
Energy: 1.1744236727427217
Energy: 1.2053081249824333
Energy: 1.1998762832637844
Energy: 1.1885317637268742
Energy: 1.198254714977454
Energy: 1.798490946976478
Energy: 1.1921047518293626
Energy: 1.185746416629338
Energy: 1.1862653872388702
Energy: 1.1877040238821193
Energy: 1.1985202989380759
Energy: 1.7856968553724932
Energy: 1.1930808540005322
Energy: 1.1988430069910412
Energy: 1.202885742402
Energy: 1.1844191773237898
Energy: 1.20490171749591
Energy: 1.8342385222912303
Energy: 1.1911183917355666
Energy: 1.1913470175668752
Energy: 1.1975847116894203
Energy: 1.1861383789304278
Energy: 1.1866800284182073
Energy: 1.9376344655408677
Energy: 1.206670669420525
Energy: 1.1812038488301784
Energy: 1.1844955818043468
Energy: 1.1779043867890149
Energy: 1.2096795333252572
Energy: 1.2886325682837136
Energy: 1.175972075917324
Energy: 1.176186031211045
Energy: 1.1852482894991023
Energy: 1.1758871983655441
Energy: 1.1991508719508293
Energy: 2.1714417919737103
Energy: 1.2113587379514514
Energy: 1.195344590551688
Energy: 1.1779618077322773
Energy: 1.1931401565758437
Energy: 1.2088415640093324
Energy: 2.0260754124408313
Energy: 1.196327374688302
Energy: 1.1849591055411848
Energy: 1.197568902706137
Energy: 1.179266919849253
Energy: 1.181316354711813
Energy: 2.2388452785211004
Energy: 1.1656945467210449
Energy: 1.1703718967104806
Energy: 1.1633502871628492
Energy: 1.1312980830280306
Energy: 1.1610902153341118
Energy: 2.238208926028372
Energy: 1.197556520078643
Energy: 1.0741018430584315
Energy: 1.0593590177225283
Energy: 1.0632591678090784
Energy: 1.1629834241289216
Energy: 2.0244859960581976
Energy: 1.1819762455049545
Energy: 1.07439693598419
Energy: 1.0564966415478891
Energy: 1.0566564763741557
Energy: 1.1723511661403487
Energy: 1.96783385774251
Energy: 0.9499583880507219
Energy: 1.0049196382376937
Energy: 1.068009752784668
Energy: 0.9485539703101519
Energy: 1.1586917264289325
Energy: 2.2916702821242607
Energy: 0.9575787279932181
Energy: 0.9853141361985953
Energy: 0.9478935144823156
Energy: 0.9512645293909815
Energy: 1.1700694599762607
Energy: 1.939518167359438
Energy: 1.1660915889393775
Energy: 0.9500552241590082
Energy: 0.9587068462526027
Energy: 0.9456276012278406
Energy: 1.1597530009607355
Energy: 2.026141282639846
Energy: 1.16144389321114
Energy: 0.9559091019894228
Energy: 0.9554611020804094
Energy: 0.9547798418415951
Energy: 1.1810708138743837
Energy: 2.259395255148638
Energy: 0.9536319548474368
Energy: 0.9847902785667242
Energy: 0.947179314631219
Energy: 0.9669197742617116
Energy: 1.112509562743427

minimum gb energy = 0.945236113931348 eV
minimum distance =  2.21196286329238 Angstroms
sigma value = 67


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

Energy: 0.39786947825486724
Energy: 0.29821580323202185
Energy: 0.44758471571348746
Energy: 0.4459090480693038
Energy: 0.43312750579854264
Energy: 0.2981880794552992
Energy: 0.2823192193453787
Energy: 0.44249849928674095
Energy: 0.43121102707971687
Energy: 0.43096278769519014
Energy: 0.44490238770558105
Energy: 0.44207315768023336
Energy: 1.6904125032953525
Energy: 0.42747652209244164
Energy: 0.42907024123325105
Energy: 0.42848737700719725
Energy: 0.42840008375733263
Energy: 0.42741256044015025
Energy: 0.2830748872955899
Energy: 0.42642500938534417
Energy: 0.42790107595141563
Energy: 0.42944861357166636
Energy: 0.42748662910034385
Energy: 0.28239558997225345
Energy: 0.28238022683417896
Energy: 0.42543315819041
Energy: 0.42750977248850514
Energy: 0.4276806440342243
Energy: 0.4267171331267976
Energy: 0.28238316064768126
Energy: 1.6910678878096432
Energy: 0.42671297539422365
Energy: 0.4282773968145646
Energy: 0.4433183870221798
Energy: 0.4282639810593698
Energy: 0.4270019128815749
Energy: 0.28233389199391346
Energy: 0.44347651840390745
Energy: 0.43008280042229474
Energy: 0.42967554928468443
Energy: 0.4306299356907399
Energy: 0.4431784906839467

minimum gb energy = 0.2823192193453787 eV
minimum distance =  2.39631621231961 Angstroms
sigma value = 3


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

Energy: 2.357039655972338
Energy: 0.8976456959975598
Energy: 0.9109614988999828
Energy: 1.091517743978644
Energy: 1.024244505199659
Energy: 1.1928454179123462
Energy: 1.9014957831380606
Energy: 1.1429271959394336
Energy: 0.918815280129173
Energy: 0.8962784610446641
Energy: 0.8985635166055717
Energy: 1.1445601608762477
Energy: 1.8250071921911337
Energy: 0.8977226022923336
Energy: 0.8999485108033136
Energy: 0.9138701496899702
Energy: 0.8998676996377513
Energy: 0.9104942237320517
Energy: 1.8701663735900593
Energy: 0.9041949390007604
Energy: 0.9254754131489312
Energy: 0.8938237497579026
Energy: 0.8933744898586079
Energy: 1.044588428788961
Energy: 1.8701905810001367
Energy: 0.8916099905022343
Energy: 1.0080922702022967
Energy: 1.0038862951809164
Energy: 1.0103811799535496
Energy: 1.0388839024238252
Energy: 1.8789947429817357
Energy: 0.908614032025614
Energy: 0.8943141043545589
Energy: 1.0179663219389417
Energy: 0.8982830270281942
Energy: 1.1342433582869926
Energy: 1.8829987678193698
Energy: 1.1357853813938834
Energy: 1.0344296129735644
Energy: 1.0276221865776458
Energy: 1.0488596845697962
Energy: 1.0267113996894746
Energy: 1.8695311587707966
Energy: 1.132712192373512
Energy: 1.1491294792155244
Energy: 0.9011023814940365
Energy: 1.1458673226755525
Energy: 1.1656364397791297
Energy: 1.8439436171340584
Energy: 1.0374940238000219
Energy: 1.1391516240175275
Energy: 1.1433369436499432
Energy: 1.0285280660198854
Energy: 1.039408355095685
Energy: 1.879453006853477
Energy: 1.1597775849212137
Energy: 1.134819342351616
Energy: 1.1367034023506388
Energy: 1.1367195765668672
Energy: 1.174626675743833
Energy: 2.032251798968818
Energy: 1.184763768602274
Energy: 1.159652828334289
Energy: 1.2069058789736464
Energy: 1.15628552732258
Energy: 1.1697775117438458
Energy: 2.05165774408556
Energy: 1.1540362096435293
Energy: 1.156485168661935
Energy: 1.1679539754080805
Energy: 1.1530608340224806
Energy: 1.1701935462611006
Energy: 1.8245986904955376
Energy: 1.1875219251259104
Energy: 1.1556265311272746
Energy: 1.1554821508230047
Energy: 1.1541620196251565
Energy: 1.1696485531946663
Energy: 1.510759078439662
Energy: 1.1643266131907795
Energy: 1.1883970543399
Energy: 1.1884129560176466
Energy: 1.165267215640353
Energy: 1.1683770120931034
Energy: 1.6688413143500165
Energy: 1.1590554296364988
Energy: 1.179689931872242
Energy: 1.230991815979931
Energy: 1.1640292924651854
Energy: 1.185469224599865
Energy: 1.7148589158827159
Energy: 1.1798123167272982
Energy: 1.1708701921534719
Energy: 1.1674436475277001
Energy: 1.1663489262126687
Energy: 1.1790678352329897
Energy: 1.67168654439838
Energy: 1.1751937162740467
Energy: 1.1760726076291397
Energy: 1.175630780302708
Energy: 1.159699966142435
Energy: 1.1806672928603337
Energy: 1.7509709469441235
Energy: 1.1548421825100361
Energy: 1.1581328431477702
Energy: 1.2109658208887908
Energy: 1.177793528397803
Energy: 1.1589532756326482
Energy: 1.6753773936423213
Energy: 1.1541188079632962
Energy: 1.1754999324808406
Energy: 1.1647344889896125
Energy: 1.1675663893326063
Energy: 1.1579086273605292
Energy: 1.3450993614026416
Energy: 1.1529959723034844
Energy: 1.1535643809183997
Energy: 1.1655112420785376
Energy: 1.1638658373275295
Energy: 1.1778570979369807
Energy: 1.3329625498137319
Energy: 1.1374364260742424
Energy: 1.1714719445792454
Energy: 1.2045953612932414
Energy: 1.1740234661176847
Energy: 1.1318693673196494
Energy: 1.3557799912904214
Energy: 1.139331776983715
Energy: 1.143806633990052
Energy: 1.1984695963403535
Energy: 1.1468984138629323
Energy: 1.1359234955687327
Energy: 1.055668363738819
Energy: 1.1416305912479814
Energy: 1.1592607437230324
Energy: 1.172737391090577
Energy: 1.1503559335781195
Energy: 1.0402147032987537
Energy: 1.0479920797541915
Energy: 1.0537798825978244
Energy: 1.028664020793733
Energy: 1.1649296164402336
Energy: 1.031191352709095
Energy: 1.0319858781152838
Energy: 1.043093224235874
Energy: 0.9084962365178788
Energy: 0.8975933661752646
Energy: 1.1547577095716721
Energy: 0.9054658938651868
Energy: 0.9128437771900696
Energy: 1.0466109211202281
Energy: 0.8944396408587898
Energy: 0.9010568293576632
Energy: 1.1597408333737897
Energy: 0.9005436230680326
Energy: 1.0076904702815332
Energy: 0.892360467987074
Energy: 0.9103878480349836
Energy: 0.9044919180715154
Energy: 1.1607028864071682
Energy: 0.8967483569229924
Energy: 0.8931110928064567
Energy: 0.8991337589600746
Energy: 0.9069863903719763
Energy: 0.9067604325942605
Energy: 1.191963394846673
Energy: 0.9018712683617736
Energy: 0.899454992986107
Energy: 0.9032780268081145
Energy: 0.9196614572067716
Energy: 1.1415063334016773
Energy: 1.1574032301003583
Energy: 0.9068106271128096
Energy: 0.9082722329304802
Energy: 0.9079380691160314
Energy: 1.0071516293307996
Energy: 1.1475425480454218
Energy: 1.158091779614821
Energy: 0.8921024422964317
Energy: 1.011583192211395
Energy: 1.0542223984795143
Energy: 0.8990787794601424
Energy: 1.1559208183611802
Energy: 1.164232910993956
Energy: 0.9164990748021827
Energy: 0.9048419555206401
Energy: 1.0379504740998513
Energy: 0.8934507623857911
Energy: 1.0559001225247975
Energy: 1.1651080173904957
Energy: 1.0383358299096712
Energy: 1.0090886762813627
Energy: 1.0353365754653876
Energy: 1.0356763900057386
Energy: 1.0304704744059041
Energy: 1.1645803539864987
Energy: 1.028800074534535
Energy: 1.0386034368096508
Energy: 1.3366299783815794
Energy: 1.132263727060906
Energy: 1.025076601894196
Energy: 1.1546745804928573
Energy: 1.0293911114454122
Energy: 1.1343018738404795
Energy: 1.3499425689728235
Energy: 1.1371743662144578
Energy: 1.1338408638612176
Energy: 1.2020282058918694
Energy: 1.13865543597971
Energy: 1.0278960050301387
Energy: 1.3571603196233883
Energy: 1.1633927351228774
Energy: 1.1683872684996002
Energy: 1.1558786573951454
Energy: 1.1524017942749072
Energy: 1.170765689559511
Energy: 1.5027449367574568
Energy: 1.161675108845778
Energy: 1.1660913653896758
Energy: 1.1660462500168125
Energy: 1.156808531735377
Energy: 1.1771805304071248
Energy: 1.4911746441279798
Energy: 1.1603775372238334
Energy: 1.2109245768779215
Energy: 1.1857715057043654
Energy: 1.1548721505112525
Energy: 1.1690426580823383
Energy: 1.6596456384639993
Energy: 1.1539482654043554
Energy: 1.1661370073822388
Energy: 1.1770246256962626
Energy: 1.1672561356829552
Energy: 1.1623408008765888
Energy: 1.6906768185058707
Energy: 1.168225169033469
Energy: 1.163235590873682
Energy: 1.1881246871496467
Energy: 1.1602906147429852
Energy: 1.19911540260173
Energy: 1.8584231328807095
Energy: 1.1702752694824023
Energy: 1.156895104666826
Energy: 1.1580916062019724
Energy: 1.1620547710800129
Energy: 1.1849945549310679
Energy: 1.8593333060829242
Energy: 1.1672504023234214
Energy: 1.1739782499534104
Energy: 1.1976635434561285
Energy: 1.1608137380283645
Energy: 1.183412190992279
Energy: 1.8612252421873339
Energy: 1.1696867732342164
Energy: 1.154993050180456
Energy: 1.1630521555714783
Energy: 1.1528381221159263
Energy: 1.2038577153619399
Energy: 1.8452465629261627
Energy: 1.1616896988650112
Energy: 1.1581476561613615
Energy: 1.1792300266845632
Energy: 1.1587566117993802
Energy: 1.1825432881289748
Energy: 1.9603534686229145
Energy: 1.1690633272055933
Energy: 1.1674414274990017
Energy: 1.0616793038696084
Energy: 1.1671413074380452
Energy: 1.1741280745512315
Energy: 1.8926362580846663
Energy: 1.1839833904702302
Energy: 1.161949181600428
Energy: 1.0550310018957347
Energy: 1.1637770991518224
Energy: 1.1570260791102638
Energy: 1.82525752660402
Energy: 1.1497291255783582
Energy: 1.135957958226347
Energy: 1.1435434256914372
Energy: 1.1384161010059395
Energy: 1.17527583382315
Energy: 1.8963775934073626
Energy: 1.0285079055736808
Energy: 1.1349144675368887
Energy: 1.1385240429051215
Energy: 1.138667415264199
Energy: 1.153564339588278
Energy: 2.2304475965269854
Energy: 1.1507758804849777
Energy: 1.0275927306516648
Energy: 1.0479911948142757
Energy: 1.0507632480383011
Energy: 1.1469659579998908
Energy: 1.8250153917681597
Energy: 0.892302043144884
Energy: 0.9026788718621082
Energy: 1.0049930940423233
Energy: 0.8957752644481434
Energy: 1.0407603344517071
Energy: 2.313662074141343
Energy: 1.0292764763654139
Energy: 0.9100851019722241
Energy: 1.0069921167512477
Energy: 0.8934923187632784
Energy: 1.032605704257297

minimum gb energy = 0.8916099905022343 eV
minimum distance =  2.23275889681873 Angstroms
sigma value = 81


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

Energy: 2.4953906467298563
Energy: 1.3111876365241182
Energy: 1.030151331288258
Energy: 1.0386340464028767
Energy: 1.181913024201019
Energy: 1.3397957762685455
Energy: 1.8160728676930702
Energy: 1.321166185646721
Energy: 1.0218232771380786
Energy: 1.011244596153821
Energy: 1.0199682789255156
Energy: 1.3236340152827173
Energy: 1.623263781997701
Energy: 1.304010835199074
Energy: 1.0227995858318215
Energy: 1.0355130963368484
Energy: 1.0251416077286197
Energy: 1.3295490754680506
Energy: 1.4336391339499694
Energy: 1.1629681829624399
Energy: 1.0174946686924953
Energy: 1.0240187685264086
Energy: 1.1638470741206952
Energy: 1.3182402018013686
Energy: 1.4316824746912755
Energy: 1.0103388650948044
Energy: 1.1642582654056037
Energy: 1.163736494139274
Energy: 1.1658582200525165
Energy: 1.3195053925182536
Energy: 1.4297682846345972
Energy: 1.3007897929447036
Energy: 1.1632576429537518
Energy: 1.1772006969108988
Energy: 1.1631705806659078
Energy: 1.3679567878184005
Energy: 1.626618996929526
Energy: 1.3231139019038953
Energy: 1.1871715763256134
Energy: 1.0069097868936125
Energy: 1.1905335916594544
Energy: 1.3210631733274796
Energy: 2.2164386287752254
Energy: 1.321295333042872
Energy: 1.2012443223883895
Energy: 1.198742166310961
Energy: 1.3201639587752296
Energy: 1.3463997720075465
Energy: 1.6253836471994747
Energy: 1.323571101487592
Energy: 1.3265705251608741
Energy: 1.2975552559645307
Energy: 1.3217713036654943
Energy: 1.3225943948556032
Energy: 1.6227922946591242
Energy: 1.3398214640910087
Energy: 1.3208683049438767
Energy: 1.3249216561639725
Energy: 1.3230312909398318
Energy: 1.336417100580162
Energy: 1.6069503288053368
Energy: 1.335285908049182
Energy: 1.3511261690009195
Energy: 1.2034996435503695
Energy: 1.3393575591663343
Energy: 1.334118665396406
Energy: 1.4349439143009914
Energy: 1.3415284545443646
Energy: 1.346288810377687
Energy: 1.3338510735550781
Energy: 1.3378835342300648
Energy: 1.3338886819400255
Energy: 1.6223771793655783
Energy: 1.342099788605947
Energy: 1.3408546460137654
Energy: 1.3324571459030594
Energy: 1.3397067188059189
Energy: 1.3691480401233607
Energy: 1.6249403688606865
Energy: 1.3203162326256257
Energy: 1.3503803388779936
Energy: 1.3597295709175086
Energy: 1.3404878292056164
Energy: 1.3214391121832945
Energy: 1.4189580985066566
Energy: 1.3286973483548927
Energy: 1.3384538598016298
Energy: 1.381677160140429
Energy: 1.3252281827362813
Energy: 1.3203244536719563
Energy: 1.2238747474694553
Energy: 1.3252215381308055
Energy: 1.3286781282704205
Energy: 1.3320736857727609
Energy: 1.3192971976572232
Energy: 1.3361614628860738
Energy: 1.2173780351775567
Energy: 1.182944820594703
Energy: 1.321736092351548
Energy: 1.3320020565210564
Energy: 1.3223254780464977
Energy: 1.0113994815892111
Energy: 1.2314819358683504
Energy: 1.1658911402170307
Energy: 1.32984157181284
Energy: 1.3397447692229516
Energy: 1.2992809766386315
Energy: 1.0138632695517495
Energy: 1.2108820186437925
Energy: 1.1640577442540105
Energy: 1.296801640952905
Energy: 1.3325642838629792
Energy: 1.1646550223308054
Energy: 1.1651043250199689
Energy: 1.012140053402136
Energy: 1.0141546634648317
Energy: 1.29401166110298
Energy: 1.3376571862513522
Energy: 1.1641681231653982
Energy: 1.0118123231831269
Energy: 1.0327942594148505
Energy: 1.0243402866338078
Energy: 1.3314718345612508
Energy: 1.3762948319529584
Energy: 1.1640031349028992
Energy: 1.0224608449827641
Energy: 1.0220018020549142
Energy: 1.0100066388322155
Energy: 1.3199325715578654
Energy: 1.3348283966558812
Energy: 1.1649893189056593
Energy: 1.020923688166932
Energy: 1.0291619307695252
Energy: 1.1844844906423428
Energy: 1.3387773846785471
Energy: 1.342649410723828
Energy: 1.180506145319222
Energy: 1.0299848023003142
Energy: 1.2296955697630374
Energy: 1.1630497563698026
Energy: 1.3240982161511383
Energy: 1.3362249874659502
Energy: 1.0119741176338437
Energy: 1.0147947815498808
Energy: 1.220955798063977
Energy: 1.163665907422306
Energy: 1.339882568131097
Energy: 1.3521282395244252
Energy: 1.1976477220656243
Energy: 1.1662841850570382
Energy: 1.2135866479119133
Energy: 1.1831398921573932
Energy: 1.3251327005034093
Energy: 1.3387129443658177
Energy: 1.3193476426703852
Energy: 1.1850318849473722
Energy: 1.4248695831007652
Energy: 1.3217296459239893
Energy: 1.3225433277419314
Energy: 1.3388787965086597
Energy: 1.3208694100878375
Energy: 1.3214530887983802
Energy: 1.3953014167770654
Energy: 1.3265141092644566
Energy: 1.3376875738486769
Energy: 1.4204856689840646
Energy: 1.3304862883862552
Energy: 1.3211808783564423
Energy: 1.6296910563709444
Energy: 1.3407147897528882
Energy: 1.337925576284187
Energy: 1.3437041611149168
Energy: 1.339676636653593
Energy: 1.2099940904621236
Energy: 1.431812177715424
Energy: 1.3515124259878841
Energy: 1.3421719043849372
Energy: 1.1833947260032363
Energy: 1.3344365905564404
Energy: 1.342485388612354
Energy: 1.8973131706906288
Energy: 1.3365581035984417
Energy: 1.3509963942640781
Energy: 1.2175332827855954
Energy: 1.3372328107230955
Energy: 1.3324686299862785
Energy: 1.4267293367325737
Energy: 1.341141969039858
Energy: 1.3593291000408174
Energy: 1.189454782492143
Energy: 1.3416291675969698
Energy: 1.336472469412801
Energy: 1.4300588075712861
Energy: 1.3226524407821074
Energy: 1.3212896372528604
Energy: 1.3236109089927088
Energy: 1.3268121516925704
Energy: 1.352564943217832
Energy: 1.437051848417841
Energy: 1.3236885051723208
Energy: 1.3207058069497453
Energy: 1.3243697780294486
Energy: 1.3221377528165563
Energy: 1.3388831166928932
Energy: 1.808262283263507
Energy: 1.3187179170206493
Energy: 1.1859905313507337
Energy: 1.0093247989398506
Energy: 1.3204423576745734
Energy: 1.3351364233431189
Energy: 1.6231175238656916
Energy: 1.3375275072200772
Energy: 1.16569243147651
Energy: 1.1650695395294242
Energy: 1.0098364839911602
Energy: 1.3353177761554926
Energy: 1.6245554391360035
Energy: 1.3217843768674333
Energy: 1.1639258958033523
Energy: 1.164594902822341
Energy: 1.163763485266988
Energy: 1.3411138864290417
Energy: 1.970732715149757
Energy: 1.1582959438217981
Energy: 1.164151567546705
Energy: 1.0293079158147886
Energy: 1.1643598423145998
Energy: 1.3295095893648625

minimum gb energy = 1.0069097868936125 eV
minimum distance =  2.24505337854128 Angstroms
sigma value = 43


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

Energy: 2.265402478462557
Energy: 1.45500924220622
Energy: 1.0827646989514341
Energy: 1.108655137458201
Energy: 1.2700529331783705
Energy: 1.4854406998981933
Energy: 1.5698485827882778
Energy: 1.3064114762942614
Energy: 1.101742090212515
Energy: 1.1027058239434935
Energy: 1.1037628908265644
Energy: 1.464852354604174
Energy: 1.5853418098127046
Energy: 1.2908398959914293
Energy: 1.1200954485912065
Energy: 1.120684705255179
Energy: 1.1204218607999676
Energy: 1.4667994391625634
Energy: 1.583371559183931
Energy: 1.282040282142764
Energy: 1.0956557090810402
Energy: 1.1061369558708696
Energy: 1.283127289635682
Energy: 1.4692485819112184
Energy: 1.5967250045418753
Energy: 1.2825455439350504
Energy: 1.2826773929005009
Energy: 1.2900357607590827
Energy: 1.2825677762498646
Energy: 1.4678878183953359
Energy: 1.5856121499330198
Energy: 1.2821586989165423
Energy: 1.29456319085064
Energy: 1.291189752716209
Energy: 1.2821537689491291
Energy: 1.5096589897443284
Energy: 1.602259163412952
Energy: 1.469956718271213
Energy: 1.0874734695108308
Energy: 1.2718440488198186
Energy: 1.300425286062635
Energy: 1.4650002224898149
Energy: 1.921647859331926
Energy: 1.465126510798564
Energy: 1.3247234825031198
Energy: 1.1214871893682241
Energy: 1.4657223801303882
Energy: 1.4759662484768836
Energy: 1.60308172891978
Energy: 1.470154989808936
Energy: 1.4688722033587094
Energy: 1.4376306942058457
Energy: 1.4681886993360147
Energy: 1.4800148860120277
Energy: 1.5850636070328437
Energy: 1.4945833014356646
Energy: 1.4625227558617215
Energy: 1.4652510749287204
Energy: 1.463232588855748
Energy: 1.4818280873518512
Energy: 1.9351882186966545
Energy: 1.4660440285695275
Energy: 1.4873188453531923
Energy: 1.4923093030712686
Energy: 1.4658666027394414
Energy: 1.4609676457035992
Energy: 1.3775488172732293
Energy: 1.4632474634379586
Energy: 1.4647598609566153
Energy: 1.4677741819478223
Energy: 1.4649246237119522
Energy: 1.4682193995771975
Energy: 1.32615148106647
Energy: 1.3044042691911508
Energy: 1.471838700181657
Energy: 1.4672516366531907
Energy: 1.4634953550878473
Energy: 1.2951605141246907
Energy: 1.3283478959886696
Energy: 1.270402234234316
Energy: 1.4889454158352255
Energy: 1.5174954837438068
Energy: 1.4741879694446398
Energy: 1.274014754583838
Energy: 1.3553803479987825
Energy: 1.2932211273486922
Energy: 1.4614927102463104
Energy: 1.4841921706304932
Energy: 1.3065042215208729
Energy: 1.289556952182007
Energy: 1.0821973922390475
Energy: 1.086092363249389
Energy: 1.4659585776634194
Energy: 1.4628741316952674
Energy: 1.2734870244563377
Energy: 1.0824021798853785
Energy: 1.1049129315233308
Energy: 1.1016175150552687
Energy: 1.4588389819411585
Energy: 1.4852227775153537
Energy: 1.2914556015377987
Energy: 1.1019539004699255
Energy: 1.121215278595435
Energy: 1.1203634265603593
Energy: 1.4422902744126713
Energy: 1.5184352051437147
Energy: 1.2830732705975931
Energy: 1.1212652049913998
Energy: 1.1030721544967976
Energy: 1.0965036232434506
Energy: 1.2820630180730692
Energy: 1.4670503558444288
Energy: 1.2821427222448099
Energy: 1.1049948748401912
Energy: 1.119221578460586
Energy: 1.2826746782248266
Energy: 1.2820703198530243
Energy: 1.4688110262767353
Energy: 1.2823987839285864
Energy: 1.2833679379146001
Energy: 1.3642233538584778
Energy: 1.2896913113250255
Energy: 1.4669877815603993
Energy: 1.3049767794802458
Energy: 1.2893155960968636
Energy: 1.2887278147694194
Energy: 1.3245420970194925
Energy: 1.2932919396033244
Energy: 1.4693618535520931
Energy: 1.5202275868693143
Energy: 1.4666350653371405
Energy: 1.085984850893481
Energy: 1.3582705701873359
Energy: 1.4753942168096588
Energy: 1.48013377524348
Energy: 1.2977020076279768
Energy: 1.471121877857931
Energy: 1.0887521668225197
Energy: 1.5675745221597444
Energy: 1.4683385583483508
Energy: 1.4650230185914759
Energy: 1.3281902296832133
Energy: 1.4655867065799144
Energy: 1.4616538275455837
Energy: 1.5854253099986049
Energy: 1.4607876063117042
Energy: 1.4846482726883625
Energy: 1.4659183368647561
Energy: 1.4737132161913364
Energy: 1.4648606943486686
Energy: 1.5846698845610545
Energy: 1.4908080504810337
Energy: 1.4643955883560897
Energy: 1.4634078856892052
Energy: 1.4652218240917148
Energy: 1.485475956476223
Energy: 1.5686633666790057
Energy: 1.4652309198415463
Energy: 1.4662771719738446
Energy: 1.4632642074320177
Energy: 1.4624710732504627
Energy: 1.4648492478778703
Energy: 2.2669414807253077
Energy: 1.4627202051809682
Energy: 1.304338695637561
Energy: 1.3314289012015252
Energy: 1.464786105429274
Energy: 1.4653324396966647
Energy: 1.5983640008992008
Energy: 1.4722115506310074
Energy: 1.2716285907632963
Energy: 1.2710427197902099
Energy: 1.2985130717566407
Energy: 1.4889616617402077
Energy: 1.5980467484704626
Energy: 1.4503627425692298
Energy: 1.294526538673329
Energy: 1.2948215047193476
Energy: 1.2893512119330628
Energy: 1.4793652305978582
Energy: 1.5686919841202664
Energy: 1.2709990388762509
Energy: 1.087013805198914
Energy: 1.0985117928534966
Energy: 1.271007123957763
Energy: 1.4656200983571535

minimum gb energy = 1.0821973922390475 eV
minimum distance =  2.25116095973728 Angstroms
sigma value = 57


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

Energy: 1.87463107979184
Energy: 1.6577210258071553
Energy: 1.1904680037752877
Energy: 1.1921708392309174
Energy: 1.1909346220848889
Energy: 1.6532227256166536
Energy: 1.5129624353500861
Energy: 1.4634140729107141
Energy: 1.2191686541842839
Energy: 1.1906377836586186
Energy: 1.2109504394118875
Energy: 1.6782615858380125
Energy: 1.5112559456865127
Energy: 1.4818942948554703
Energy: 1.2273323340199542
Energy: 1.2297477360731632
Energy: 1.2281266790637764
Energy: 1.6750168808432742
Energy: 1.5087531303402353
Energy: 1.4420295574809598
Energy: 1.1892772337855693
Energy: 1.1898698705178088
Energy: 1.1925888799614321
Energy: 1.6584903529445651
Energy: 1.5071286095777607
Energy: 1.450197305253666
Energy: 1.4293280331727058
Energy: 1.211700204686945
Energy: 1.4324956553262134
Energy: 1.650512372169325
Energy: 1.509802539587046
Energy: 1.4627375492364676
Energy: 1.4598135588615933
Energy: 1.4504222054899951
Energy: 1.4706385430011206
Energy: 1.666485872513457
Energy: 1.5089685641932835
Energy: 1.6671431780923518
Energy: 1.452177209042287
Energy: 1.4277574129512416
Energy: 1.450292637862469
Energy: 1.6510611274825329
Energy: 1.5380779617351292
Energy: 1.6534223659019742
Energy: 1.658241888155266
Energy: 1.1892142504390766
Energy: 1.6585083342271476
Energy: 1.665095439594975
Energy: 1.5134476270084132
Energy: 1.657909602326671
Energy: 1.6442964988284736
Energy: 1.6426263450812868
Energy: 1.6656380990931092
Energy: 1.4591004100554845
Energy: 1.192237875265575
Energy: 1.4496246251497134
Energy: 1.6555660792719862
Energy: 1.6415307090336875
Energy: 1.6464867196815078
Energy: 1.1942871028068225
Energy: 1.533038939569298
Energy: 1.4596599437423885
Energy: 1.6682640352036806
Energy: 1.1925339666151011
Energy: 1.6443091409727322
Energy: 1.4582645818922664
Energy: 1.187994216997628
Energy: 1.428009602801176
Energy: 1.4448620628052617
Energy: 1.6382076074616225
Energy: 1.444229621372123
Energy: 1.4279852523816114
Energy: 1.189884300723702
Energy: 1.1925926712643717
Energy: 1.660733681937049
Energy: 1.6594221960841007
Energy: 1.4282458844748205
Energy: 1.1899826596394663
Energy: 1.1915685318591291
Energy: 1.227804142588061
Energy: 1.6502956372404851
Energy: 1.4647949725581826
Energy: 1.2275201681595154
Energy: 1.2137284420119443
Energy: 1.2148954262395706
Energy: 1.2134728528719503
Energy: 1.4771929763077087
Energy: 1.4633776328506054
Energy: 1.4659467031289284
Energy: 1.212549185511165
Energy: 1.1905999436622579
Energy: 1.4405245901558323
Energy: 1.6496292245429296
Energy: 1.4523054583629689
Energy: 1.4319910982940132
Energy: 1.1931909571666757
Energy: 1.1902913643819202
Energy: 1.458023167395125
Energy: 1.4618037739628107
Energy: 1.4276340225703592
Energy: 1.463944755867552
Energy: 1.456476305400283
Energy: 1.1903748485711507
Energy: 1.4605333055708858
Energy: 1.6722378767628294
Energy: 1.2030381888986699
Energy: 1.4565117433770585
Energy: 1.430534438931194
Energy: 1.509591679220294
Energy: 1.4513198523133883
Energy: 1.6572739831488286
Energy: 1.6562012269442645
Energy: 1.6464347189220356
Energy: 1.193205409113247
Energy: 1.5091259635754872
Energy: 1.653261447830507
Energy: 1.6552768999795144
Energy: 1.6626707276213675
Energy: 1.647052404633495
Energy: 1.6589793624813152
Energy: 1.868418786379364
Energy: 1.6553501173099008
Energy: 1.451167419918921
Energy: 1.188703578414007
Energy: 1.6575896152484697
Energy: 1.6403508108756246
Energy: 1.511494330484226
Energy: 1.6652238504853383
Energy: 1.4269971257546934
Energy: 1.4278185542943742
Energy: 1.4580802331213791
Energy: 1.451760719431899
Energy: 1.839807258443731
Energy: 1.6479637685382378
Energy: 1.4686004009055844
Energy: 1.4513183202242361
Energy: 1.4660793682185005
Energy: 1.7017894126547912
Energy: 1.8318868156731325
Energy: 1.4414637949762312
Energy: 1.195699867903034
Energy: 1.1901493595081742
Energy: 1.4290134691768586
Energy: 1.6593709318998204

minimum gb energy = 1.187994216997628 eV
minimum distance =  2.26872458865366 Angstroms
sigma value = 17


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

Energy: 2.6331708997524186
Energy: 1.833677942784818
Energy: 1.3257135238228035
Energy: 1.3249931263820094
Energy: 1.5975837017891137
Energy: 1.828523772407309
Energy: 1.3200636974657562
Energy: 1.6578008739527454
Energy: 1.325031359528015
Energy: 1.325020937267982
Energy: 1.3265103967583656
Energy: 1.8340195224044138
Energy: 1.334769514788317
Energy: 1.64800663905893
Energy: 1.3520131761092864
Energy: 1.3301248369537773
Energy: 1.3249357357832132
Energy: 1.8323402297717275
Energy: 1.38051081490194
Energy: 1.5955137811558278
Energy: 1.325295304746811
Energy: 1.324960296993087
Energy: 1.3256609444303984
Energy: 1.6094391296090267
Energy: 1.3302196037951037
Energy: 1.6345883922654207
Energy: 1.6028889299584463
Energy: 1.3361615959282183
Energy: 1.6002529080987224
Energy: 1.6398662769618613
Energy: 1.3311612921302325
Energy: 1.452282879024873
Energy: 1.6345615115461434
Energy: 1.363006085962798
Energy: 1.6392232557813216
Energy: 1.5988116548247306
Energy: 1.3319001308943013
Energy: 1.596063422170429
Energy: 1.5956433946508788
Energy: 1.340764462736346
Energy: 1.5961225525908291
Energy: 1.6095118701922013
Energy: 1.3904799818683682
Energy: 1.6402344558003266
Energy: 1.8323941189177744
Energy: 1.3314360444790347
Energy: 1.6365924461941137
Energy: 1.5980258647893266
Energy: 1.3322937320442143
Energy: 1.5964101218779156
Energy: 1.8274196957133266
Energy: 1.825950844609834
Energy: 1.5977127724326425
Energy: 1.3390366541945717
Energy: 1.3250939574955176
Energy: 1.3267467150311807
Energy: 1.6383930735111127
Energy: 1.6025966471251218
Energy: 1.5965187400787815
Energy: 1.3242125048197961
Energy: 1.3257756002578374
Energy: 1.3265645671782933
Energy: 1.8352519423251252
Energy: 1.3325644286665872
Energy: 1.3646387523324084
Energy: 1.3266206671063567
Energy: 1.325686112816603
Energy: 1.3279181049924913
Energy: 1.6363920324360308
Energy: 1.3305368631451384
Energy: 1.602387829094149
Energy: 1.3243465516397555
Energy: 1.3344847429089208
Energy: 1.5960755535044182
Energy: 1.60497343997658
Energy: 1.6228933764854996
Energy: 1.5952712774212265
Energy: 1.597386718404902
Energy: 1.3606611526703056
Energy: 1.6355537914201226
Energy: 1.6392732817723892
Energy: 1.3324065627179298
Energy: 1.6359505942507422
Energy: 1.3619310368919173
Energy: 1.3321680224043986
Energy: 1.598718924459859
Energy: 1.5985762462150834
Energy: 1.332342054620122
Energy: 1.6349219536164952
Energy: 1.5980324661585208
Energy: 1.331817765470004
Energy: 1.835444056517816
Energy: 1.6362703595543782
Energy: 1.6410192751271406
Energy: 1.6379390545847807
Energy: 1.3304723965208498
Energy: 1.3181011955658297
Energy: 1.646432179674296
Energy: 1.6010728491554649
Energy: 1.3325681191654486
Energy: 1.5948030415535517
Energy: 1.8260914986026964

minimum gb energy = 1.3181011955658297 eV
minimum distance =  2.21686165524227 Angstroms
sigma value = 17


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

Energy: 1.9217678729092622
Energy: 1.4126247097954114
Energy: 1.5291322751840932
Energy: 1.6423126474730017
Energy: 1.5293654089194024
Energy: 2.0748804853699596
Energy: 1.4518138604549067
Energy: 1.617887356019531
Energy: 1.426317711168945
Energy: 1.4279212774632888
Energy: 1.4287367229736316
Energy: 1.8763910401862254
Energy: 1.5129355691245727
Energy: 1.474995690242585
Energy: 1.4378405274981907
Energy: 1.4290166407307727
Energy: 1.42705817808706
Energy: 1.4123424960399797
Energy: 2.046110864573711
Energy: 1.8218280791409251
Energy: 1.42870043112918
Energy: 1.4381442167232754
Energy: 1.6056918142381529
Energy: 1.8114685690347003
Energy: 1.507814989473546
Energy: 1.9164602270268054
Energy: 1.6686050977506761
Energy: 1.5188272702753087
Energy: 1.8118150513732487
Energy: 1.6710921336807336
Energy: 1.4425665039965339
Energy: 1.4331565952196303
Energy: 1.9125620673462898
Energy: 1.4019718671103585
Energy: 1.835958119701482
Energy: 1.4283954523896791
Energy: 1.4280969639982757
Energy: 1.432565562152548
Energy: 1.6713909287599702
Energy: 1.5045897102874424
Energy: 1.6039813962196021
Energy: 1.4261915182856968
Energy: 1.4216674276080457
Energy: 1.4201770856646574
Energy: 1.6024132849396424
Energy: 1.4288751644533058
Energy: 1.4286968451424846
Energy: 1.4250628426119494
Energy: 1.4298395944640845
Energy: 1.4318457385565835
Energy: 1.553817743149196
Energy: 1.6017070900898045
Energy: 1.4352467113565492
Energy: 1.4304349536583345
Energy: 1.5731576371927762
Energy: 1.427832874729965
Energy: 1.6333803355568295
Energy: 1.575015041081719
Energy: 1.4261128635806641
Energy: 1.4264345125860693
Energy: 1.6627337125188801
Energy: 1.601342234687449
Energy: 1.401736583679205
Energy: 1.5099293611193076
Energy: 1.61940293099152
Energy: 1.4234214249441357
Energy: 1.5694698676991974
Energy: 1.4307137397023095
Energy: 1.5456388528242142
Energy: 1.3969743033033373
Energy: 1.8380471419704312
Energy: 1.4319330439196243
Energy: 1.4741617174804718
Energy: 1.8445752656575427
Energy: 1.545620736690562
Energy: 1.3972465748354421
Energy: 1.830931026099828
Energy: 1.4357828203680345
Energy: 2.2536656552686427
Energy: 1.39999902126075
Energy: 1.5090370437195013
Energy: 1.3993639835846043
Energy: 1.4013910708814723
Energy: 1.9022520681146629
Energy: 1.6943527430915677
Energy: 1.8324732893331173
Energy: 1.3948768568191259
Energy: 1.395340809392012
Energy: 1.396957870544915
Energy: 1.8546871253338775
Energy: 1.5368581368897731
Energy: 1.3864376538925562
Energy: 1.395671256753737
Energy: 1.4038163572228888
Energy: 1.3942528195139952
Energy: 1.424378799521704
Energy: 1.5497353773260674
Energy: 1.4124078361641217
Energy: 1.399270789555045
Energy: 1.3979517698853055
Energy: 1.3980813073425777
Energy: 1.679131672782307
Energy: 1.5448782435627877
Energy: 1.8630128189425417
Energy: 1.398398908198734
Energy: 1.5468641756414179
Energy: 1.3968960696495283
Energy: 1.673637078701205
Energy: 1.466841785104841
Energy: 1.8492586715135713
Energy: 1.8200106112436671
Energy: 1.3925077638676213
Energy: 1.8194012636385803
Energy: 1.435016195977723
Energy: 1.5734706471405393
Energy: 1.4261309723731594
Energy: 1.3987233164761053
Energy: 1.401855112211946
Energy: 1.67749451427444
Energy: 1.425956366346836
Energy: 1.6592364545063887
Energy: 1.601449299849086
Energy: 1.7979194873565303
Energy: 1.503609687943692
Energy: 1.6042855974615098
Energy: 1.4200886658594274
Energy: 1.543197904786649
Energy: 1.4305089851672255
Energy: 1.3930651533508398
Energy: 1.4587153665004948
Energy: 1.4304676156585447
Energy: 1.4263979806981475
Energy: 1.42457644505875
Energy: 1.4262601711899885
Energy: 1.4288943725020067
Energy: 1.808951192402151
Energy: 1.43013202660823
Energy: 1.4294667455167565
Energy: 1.4150532426074285
Energy: 1.417157266116209
Energy: 1.7649498124994465
Energy: 1.4288072263029075
Energy: 1.4284761703772832
Energy: 1.418469411067641
Energy: 1.4270639364779074
Energy: 1.4279038563565833
Energy: 1.6716485922779047
Energy: 1.7173680072921107
Energy: 1.8074383187338257
Energy: 1.4266116376372013
Energy: 1.4313716933410257
Energy: 1.8155554812065269
Energy: 1.9265307354441903
Energy: 1.395714920882096
Energy: 1.8356904950933008
Energy: 1.4299842709836565
Energy: 1.4053382744988419
Energy: 1.8295129900835103
Energy: 1.4488786713341573
Energy: 1.4325106129654623
Energy: 1.8197380809953914
Energy: 1.6853559180523237
Energy: 1.4079360299187151
Energy: 1.9165716717567691
Energy: 1.4273465112274488
Energy: 1.4260834364524044
Energy: 1.4389891845723044
Energy: 1.6579908846238622
Energy: 1.425535436038586
Energy: 1.4417714988109727
Energy: 1.4179148618979975
Energy: 1.417839426161157
Energy: 1.4175760260252528
Energy: 1.4015026515401694
Energy: 2.037698183378161
Energy: 1.4264274183575543
Energy: 1.426910152903437
Energy: 1.425937300356997
Energy: 1.4301857803700824
Energy: 1.8373405467976787
Energy: 1.9692891315133638
Energy: 1.4298051560829743
Energy: 1.4281924318050943
Energy: 1.5399629284950034
Energy: 1.437175095344054
Energy: 1.8692607056239952
Energy: 1.5034234968819926
Energy: 1.6445756612245483
Energy: 1.616653267891333
Energy: 1.419401266810228
Energy: 1.6180816826313245
Energy: 1.405447332648883
Energy: 1.545038346177605
Energy: 1.678729881986583
Energy: 1.4263263451246915
Energy: 1.4267233942824564
Energy: 1.4306901713872755
Energy: 1.3950258236360011
Energy: 2.0628345525835745
Energy: 1.8185863243696319
Energy: 1.4400901305831524
Energy: 1.467612519997683
Energy: 1.8318123858824409
Energy: 1.6746359389513916
Energy: 1.5444718239184514
Energy: 1.3985841024991996
Energy: 1.8931557183002987
Energy: 1.397215926715683
Energy: 1.4086743340940326
Energy: 1.4086506942227852
Energy: 1.3999374099064803
Energy: 1.397019158321086
Energy: 1.8283737635415704
Energy: 1.8234435707736136
Energy: 1.546248391737851
Energy: 1.4006149018708394
Energy: 1.3934348321699501
Energy: 1.4035921358259564
Energy: 1.877916164584976
Energy: 1.538337030113091
Energy: 1.3900504861916068
Energy: 1.3916723214894415
Energy: 1.393502606813982
Energy: 1.3998999550443365
Energy: 1.840941177195004
Energy: 1.6293077487781953
Energy: 1.672745468077593
Energy: 1.3984611686315513
Energy: 1.4075775828648107
Energy: 1.3968198632102633
Energy: 1.8361575000916979
Energy: 1.683890712402071
Energy: 1.3959598539874953
Energy: 1.5084181080933723
Energy: 1.8792241165571049
Energy: 1.6696749114044578
Energy: 1.8478729458510534
Energy: 1.468426158367285
Energy: 1.83586466510824
Energy: 1.5432286641929414
Energy: 1.6294610715189202
Energy: 1.8406735890557147
Energy: 1.4262859638744794
Energy: 1.6264532678984092
Energy: 1.4349062370340375
Energy: 1.3961490286775518
Energy: 1.5137412811008162
Energy: 1.788577002724563
Energy: 1.4192245454254395
Energy: 1.420136572336836
Energy: 1.6023009994568724
Energy: 1.4035107623537815
Energy: 1.6845817094304676
Energy: 1.6259967375507922
Energy: 1.437267169316093
Energy: 1.4265865960915711
Energy: 1.4376737341245578
Energy: 1.393677716140674

minimum gb energy = 1.3864376538925562 eV
minimum distance =  2.22746332234481 Angstroms
sigma value = 57


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

Energy: 2.2159244408583083
Energy: 2.0759902959049783
Energy: 1.6305305726534642
Energy: 1.6315158754335464
Energy: 1.4557388485451588
Energy: 2.1130472554520527
Energy: 1.4948285224207631
Energy: 1.7270408214429356
Energy: 1.4520577403452857
Energy: 1.4446065206511367
Energy: 1.4555228881448743
Energy: 1.6191606367555589
Energy: 1.4700337238358177
Energy: 1.4613993461252646
Energy: 1.466918845223397
Energy: 1.4463118708167777
Energy: 1.4467544837517567
Energy: 1.6407062821767715
Energy: 1.8332268132738971
Energy: 1.6873934228081369
Energy: 1.455658075479244
Energy: 1.451260082446554
Energy: 1.6911788289164567
Energy: 1.6880835251979454
Energy: 1.4701668009915714
Energy: 1.9045414010090242
Energy: 1.6303702162546476
Energy: 1.4181280469368773
Energy: 1.894598282957851
Energy: 1.6692538778079011
Energy: 1.4670148428671885
Energy: 1.6229329315289902
Energy: 1.3813596340610215
Energy: 1.383863641097611
Energy: 1.6858351778976581
Energy: 1.4449905216831973
Energy: 1.4438561398566363
Energy: 1.4745925429092033
Energy: 1.665768403485823
Energy: 1.4572761266253205
Energy: 1.6910246139974978
Energy: 1.4581484331832277
Energy: 1.4355164382157821
Energy: 1.43308389982048
Energy: 1.7134521439960364
Energy: 1.4462176162730407
Energy: 1.4300260537164178
Energy: 1.434716484079986
Energy: 1.4520227449196963
Energy: 1.459529915583029
Energy: 1.6833352379583286
Energy: 1.6792125336390853
Energy: 1.7330868569783937
Energy: 1.4539462928851135
Energy: 1.470670548273578
Energy: 1.7179783056273783
Energy: 1.7563996135006057
Energy: 1.4395061768051636
Energy: 1.749625342224884
Energy: 1.4481576832372047
Energy: 1.4804585737468723
Energy: 1.7018975803036394
Energy: 1.4553602709329805
Energy: 1.4772398832971652
Energy: 1.7523204419235245
Energy: 1.4367734906593386
Energy: 1.4538509127978072
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Energy: 1.4525801436247696
Energy: 1.44466578596462
Energy: 1.7190675459010805
Energy: 1.4566568810929783
Energy: 1.4606437154132905
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Energy: 1.4609650699703005
Energy: 2.197263051332483
Energy: 1.4564502719487327
Energy: 1.4707087202659566
Energy: 1.4720938741423333
Energy: 1.464628883746774
Energy: 1.91616777103443
Energy: 1.4926043994230511
Energy: 1.7190319783327406
Energy: 1.4720380518233627
Energy: 1.4489006331184304
Energy: 1.4623126731722382
Energy: 1.7582868946549028
Energy: 1.4675033513846276
Energy: 1.4637631148413106
Energy: 1.4515244480228657
Energy: 1.4549052884609057
Energy: 1.4643743971981753
Energy: 1.4678554386341318
Energy: 1.84126630716874
Energy: 1.919299254213614
Energy: 1.4588698864185363
Energy: 1.4492597437414327
Energy: 1.4443811487394678
Energy: 1.665199527735223
Energy: 1.470342420393937
Energy: 1.8988478296440803
Energy: 1.6705024329913527
Energy: 1.4626954527345972
Energy: 1.6622276233213409
Energy: 1.6678400396620363
Energy: 1.442335798778348
Energy: 1.630538524549688
Energy: 1.3857755332045159
Energy: 1.3881629069215633
Energy: 1.9813933225194351
Energy: 1.4453180637504137
Energy: 1.4429495688282272
Energy: 1.4481304985746333
Energy: 1.6243743058359537
Energy: 1.460043151604035
Energy: 1.7126173929898245
Energy: 1.4549674482114658
Energy: 1.4264660540790879
Energy: 1.436857377329562
Energy: 1.7688588339193116
Energy: 1.4518158748775898
Energy: 1.4292800409743724
Energy: 1.4334031926726933
Energy: 1.447816686237919
Energy: 1.4589982095689316
Energy: 1.675794615654566
Energy: 1.672777057405069
Energy: 1.7361962227357934
Energy: 1.4545298408309528
Energy: 1.463507119202512
Energy: 1.4536176028238483
Energy: 1.7650799220449134
Energy: 1.4398865666127658
Energy: 1.7389682240552113
Energy: 1.4578594957274327
Energy: 1.4660446986100875
Energy: 1.6966285798597251
Energy: 1.4608002560755065
Energy: 1.474450870098396
Energy: 1.7088604765332414
Energy: 1.43090550834052
Energy: 1.4789660663618702
Energy: 1.459526827325024
Energy: 1.4526375836284304
Energy: 1.4448326973527117
Energy: 1.7298468265808304
Energy: 1.4536000040470123
Energy: 1.4622425541846829
Energy: 1.7764230021301142
Energy: 1.4658296399350128
Energy: 1.4466446442068839
Energy: 1.7098662685696728
Energy: 1.458352033779776
Energy: 2.188812713016455
Energy: 1.7414828493605548
Energy: 1.4619042142240635
Energy: 1.456227915589737
Energy: 1.4485158772292048
Energy: 1.9703955323982218

minimum gb energy = 1.3813596340610215 eV
minimum distance =  2.21077388514563 Angstroms
sigma value = 43


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

Energy: 1.5051365180731169
Energy: 1.4675655376001597
Energy: 1.5918779500123554
Energy: 1.5907168310070539
Energy: 1.59179556735563
Energy: 2.009994417811012
Energy: 1.5275153688595917
Energy: 1.4895972771505326
Energy: 1.4901832250711944
Energy: 1.4874719723106338
Energy: 1.4953827774560835
Energy: 1.901329370974412
Energy: 1.6341513785497197
Energy: 1.6979544806737437
Energy: 1.4920807758740846
Energy: 1.48728985898758
Energy: 1.488523476235142
Energy: 1.767637632014603
Energy: 1.6338292581083675
Energy: 1.8525032452226007
Energy: 1.4905301137940783
Energy: 1.4860368160491941
Energy: 1.681564980728416
Energy: 1.6809528792919417
Energy: 1.6318122621763749
Energy: 1.8574205166800284
Energy: 1.8748208384990277
Energy: 1.527384547832217
Energy: 1.8680731165714362
Energy: 1.4407651057821387
Energy: 1.4457523635885332
Energy: 1.4428084932626675
Energy: 1.8860269126548135
Energy: 1.4166853490791664
Energy: 1.6896649800734553
Energy: 1.4426160142964801
Energy: 1.4428363698200775
Energy: 1.442953025513688
Energy: 1.8755388095196532
Energy: 1.4880739646844137
Energy: 1.4393923640224138
Energy: 1.440209980459481
Energy: 1.4376794181990058
Energy: 1.439645181023454
Energy: 1.8622398065775325
Energy: 1.5671003118095235
Energy: 1.4397726980980905
Energy: 1.437790815179172
Energy: 1.4429700612071983
Energy: 1.4407680366155056
Energy: 1.8796344606834885
Energy: 1.6810374838472957
Energy: 1.6909676655758379
Energy: 1.4413453049898115
Energy: 1.6372997794483457
Energy: 1.6902255067326748
Energy: 1.8652834209464624
Energy: 1.5639417524872514
Energy: 1.8740797611704456
Energy: 1.6771809995248392
Energy: 2.0486075704068947
Energy: 1.682624830732973
Energy: 1.4978835813376952
Energy: 1.4885648474572033
Energy: 1.8715032915516308
Energy: 1.4225846391235222
Energy: 1.6397454199889943
Energy: 1.8755909776949213
Energy: 1.4851841202929785
Energy: 1.484436853424675
Energy: 1.4885711821915777
Energy: 1.7560708988828018
Energy: 1.5889332468830948
Energy: 1.4811298386211202
Energy: 1.485793987483328
Energy: 1.4837190601800792
Energy: 1.4853948967430626
Energy: 1.7712915007424317
Energy: 1.777631808445324
Energy: 1.71256247923999
Energy: 1.4973550591261071
Energy: 1.4859508409102662
Energy: 1.487889882002503
Energy: 1.8732233820935946
Energy: 1.4822937664836235
Energy: 1.7248893508258099
Energy: 1.4948747257435986
Energy: 1.491580807345417
Energy: 1.4856823834746578
Energy: 1.730386530177477
Energy: 1.6417180988668334
Energy: 1.4923138113596683
Energy: 1.480559099645099
Energy: 1.4821321794500937
Energy: 1.7027443064518069
Energy: 1.4956727892669701
Energy: 1.7917542336232382
Energy: 1.4901820362339981
Energy: 1.4889930336628987
Energy: 1.6381137452469827
Energy: 1.6224230155344954
Energy: 1.4909396651902656
Energy: 1.7931728544886483
Energy: 1.490312254581392
Energy: 1.7059411652659482
Energy: 1.6429137160768366
Energy: 1.7061728649208934
Energy: 1.4908888772373687
Energy: 1.590508587979461
Energy: 1.5963291070541463
Energy: 2.1945291499562374
Energy: 1.9909149681713494
Energy: 1.4865270667491008
Energy: 1.5878752722683094
Energy: 1.4843166925051983
Energy: 1.4967903558508755
Energy: 1.7040799348802824
Energy: 1.6424596312110193
Energy: 1.4916766199077018
Energy: 1.4914427839384816
Energy: 1.4826464296252262
Energy: 1.4877643074992692
Energy: 1.6079868236688422
Energy: 1.6360710957932265
Energy: 1.4906801786368093
Energy: 1.4833631881093048
Energy: 1.4897338967585152
Energy: 1.4872993777095047
Energy: 1.6846277971898567
Energy: 1.4427796541591333
Energy: 1.8619077407941582
Energy: 1.4974212474535467
Energy: 1.5264836711403715
Energy: 1.8668697948508812
Energy: 1.6874789501560479
Energy: 1.4889690480237157
Energy: 1.8570496811063333
Energy: 1.809416697253254
Energy: 2.0465017508043286
Energy: 1.690488765166423
Energy: 1.440129485228236
Energy: 1.4428696275837354
Energy: 1.6755947577873385
Energy: 1.8993989034334267
Energy: 1.4872025369866526
Energy: 1.6918539605121934
Energy: 1.4413812651255395
Energy: 1.4407271381924438
Energy: 1.4397030934772104
Energy: 2.026975803600553
Energy: 1.5643604294768683
Energy: 1.686494296583813
Energy: 1.4420105722743293
Energy: 1.438768206477214
Energy: 1.440150623856514
Energy: 1.6685908162438539
Energy: 1.784791379941891
Energy: 1.8904817681893238
Energy: 1.4423120402021918
Energy: 1.4428697204009173
Energy: 1.6751312795982256
Energy: 1.6773044367867207
Energy: 1.63635125157873
Energy: 1.8744112314389108
Energy: 1.687337087220895
Energy: 1.4932147447020623
Energy: 1.858969646435767
Energy: 1.8607447634158794
Energy: 1.489789047799482
Energy: 1.5037822067842077
Energy: 1.6843188250873828
Energy: 1.4361143600014894
Energy: 1.8632225189069633
Energy: 1.4877931763315766
Energy: 1.4825504402734953
Energy: 1.4870635581724752
Energy: 1.6826551505869436
Energy: 1.641235599081875
Energy: 1.6972047653348104
Energy: 1.4878473740705773
Energy: 1.4831615211707623
Energy: 1.4946814412085268
Energy: 1.7224608235892236
Energy: 1.5904985209700064
Energy: 1.480867686739979
Energy: 1.4882815026696075
Energy: 1.4865642622715185
Energy: 1.4854772353362025
Energy: 1.8704946155089988
Energy: 1.677220666700249
Energy: 1.4903674270527647
Energy: 1.4935832273645362
Energy: 1.6371173370052254
Energy: 1.490551600959955
Energy: 1.7077529354224275
Energy: 1.480807084453299
Energy: 1.724895847221957
Energy: 1.475606242716103
Energy: 1.520469200033721
Energy: 1.4885032636049487
Energy: 1.4934373475149658
Energy: 1.6424354532247578
Energy: 1.703477119514001
Energy: 1.481248871133735
Energy: 1.633671908611527
Energy: 1.498349363319985
Energy: 1.4900692815033225
Energy: 1.4861142827986074
Energy: 1.7265177109134495
Energy: 1.485947210066561
Energy: 1.6225950680728884
Energy: 1.724257738608433
Energy: 1.498451143283578
Energy: 1.4882215693149
Energy: 1.491793514867704
Energy: 1.899935020240844

minimum gb energy = 1.4166853490791664 eV
minimum distance =  2.23332961276698 Angstroms
sigma value = 81


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

Energy: 1.4366934540213678
Energy: 1.4197993040360086
Energy: 1.5494594850913188
Energy: 1.5423286897833812
Energy: 1.544883601997886
Energy: 1.41838473490276
Energy: 1.4177943533484558
Energy: 1.5443535626013527
Energy: 1.5020148164168985
Energy: 1.469317073641953
Energy: 1.508405484620975
Energy: 1.5435082132948041
Energy: 1.5526846437863164
Energy: 1.544476393895847
Energy: 1.4937351662241805
Energy: 1.455467579453957
Energy: 1.4739205574069807
Energy: 1.5487360028509136
Energy: 1.5466805365997067
Energy: 1.544533658152915
Energy: 1.485259710477909
Energy: 1.5035881243744902
Energy: 1.546590369807731
Energy: 1.543870638790366
Energy: 1.5512025150097826
Energy: 1.5510213257330567
Energy: 1.5429058875803676
Energy: 1.4209728371342158
Energy: 1.5534880058622187
Energy: 1.544984898965308
Energy: 1.5081666864962473
Energy: 1.4760321686283464
Energy: 1.4217919714666292
Energy: 1.4386952529672294
Energy: 1.5435281306535422
Energy: 1.4841274058309173
Energy: 1.4740577408311137
Energy: 1.5099655772287301
Energy: 1.5430549274105436
Energy: 1.544378248827551
Energy: 1.549947634902452
Energy: 1.493358687058294
Energy: 1.4590924396793856
Energy: 1.508931409292112
Energy: 1.5457821525121018
Energy: 1.5442019151146067
Energy: 1.5484947370355997
Energy: 1.4915668451112263
Energy: 1.508777434127845
Energy: 1.4933271067673755
Energy: 1.5442774652913116
Energy: 1.544453859572363
Energy: 1.5454483071128986
Energy: 1.4762676952863434
Energy: 1.4185567920299578
Energy: 1.543726569321056
Energy: 1.542950942430553
Energy: 1.5444500093947402
Energy: 1.5526610838476929
Energy: 1.5430968271594026

minimum gb energy = 1.4177943533484558 eV
minimum distance =  2.23189061089456 Angstroms
sigma value = 3


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

Energy: 1.4179865010337456
Energy: 1.46297907074648
Energy: 1.6554405329998068
Energy: 1.743655243934051
Energy: 1.6579795340661165
Energy: 1.9705980861158665
Energy: 1.6098707281299496
Energy: 1.4322937107990585
Energy: 1.440547477912385
Energy: 1.623094272657355
Energy: 1.451091776234172
Energy: 1.4243225500420398
Energy: 1.6206178939431146
Energy: 1.5252283440334964
Energy: 1.4176696808938016
Energy: 1.6168365648843508
Energy: 1.4219205403015158
Energy: 1.4441858587468719
Energy: 1.6118786556537745
Energy: 1.4440418022751733
Energy: 1.4638538026495704
Energy: 1.624945920302938
Energy: 1.6518138772363706
Energy: 1.6601067688169
Energy: 1.6224814259195037
Energy: 1.4258243759945648
Energy: 1.4230736523144238
Energy: 1.8009799641541981
Energy: 1.4072781189288757
Energy: 1.6282426247484334
Energy: 1.6644421352740724
Energy: 1.6134554985251353
Energy: 1.71800690903141
Energy: 1.5410114708937928
Energy: 1.6947305869702156
Energy: 1.677640456429192
Energy: 1.7914306278526078
Energy: 1.4468889601448287
Energy: 1.9056594169462602
Energy: 1.4235792310574842
Energy: 1.4081750217701225
Energy: 1.6209292100163244
Energy: 1.792919110676781
Energy: 1.4152343896874584
Energy: 1.4437019773147723
Energy: 1.4434285003450966
Energy: 1.443141880036939
Energy: 1.4195717219491386
Energy: 1.7741652696524934
Energy: 1.405747382120734
Energy: 1.42177822629053
Energy: 1.4178786271766863
Energy: 1.4130058626475006
Energy: 1.5072752126469133
Energy: 1.8014078584352402
Energy: 1.527798800022859
Energy: 1.430387164804481
Energy: 1.4459904264965078
Energy: 1.4151707431360903
Energy: 1.4626964953243544
Energy: 1.6177614888596072
Energy: 1.5314135860446898
Energy: 1.663596789202523
Energy: 1.437772202007114
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Energy: 1.638123329527345
Energy: 1.6295107866983471
Energy: 1.5298889314781223
Energy: 1.4105401752121682
Energy: 1.4462504496608437
Energy: 1.4654102162206237
Energy: 1.7333054245753847
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Energy: 1.4118460118524734
Energy: 1.446950584701612
Energy: 1.453087444368686
Energy: 1.4324421696221787
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Energy: 1.4103430301482023
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Energy: 1.415964682545409
Energy: 1.4435088261884303
Energy: 1.4417112551393394
Energy: 1.420654366440169
Energy: 1.4301673537171715
Energy: 1.7753082904054915
Energy: 1.6741009796297988
Energy: 1.4457124875827074
Energy: 1.4409965073782254
Energy: 1.7258930096052862
Energy: 1.4037188404502545
Energy: 1.625221100214218
Energy: 1.427797495683475
Energy: 1.4417316911269333
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Energy: 1.5024339998904401
Energy: 1.62092086655391
Energy: 1.7741275876466949
Energy: 1.4326868682758744
Energy: 1.3865853156172343
Energy: 1.7497596747030606
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Energy: 1.625036014682257
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Energy: 1.4607560966345314
Energy: 1.386722129383708
Energy: 1.6256745788718627
Energy: 1.6444472723597328
Energy: 1.6609276490636498
Energy: 1.639233813570085
Energy: 1.4133004895820591
Energy: 1.430558314171717
Energy: 1.619468588083269
Energy: 1.4527701277847127
Energy: 1.452815563438833
Energy: 1.6199358134980486
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Energy: 1.4435094687976942
Energy: 1.622337586037263
Energy: 1.4423799892864246
Energy: 1.638162907027147
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Energy: 1.4034778277582274
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Energy: 1.6277973598071414
Energy: 1.6133859419734833
Energy: 1.5212750181553392
Energy: 1.4019250202771854
Energy: 1.4532420382123779
Energy: 1.62951712681411
Energy: 1.7722970718862723
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Energy: 1.5036661314792594
Energy: 1.8009508263013674
Energy: 1.6650586599629758
Energy: 1.6235371653352642
Energy: 1.806908433261832
Energy: 1.9205959154533432
Energy: 1.4452654636102902
Energy: 1.440287374094948
Energy: 1.649562797154322
Energy: 1.848816056827937
Energy: 1.7727291272982226
Energy: 1.5125329995206351
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Energy: 1.4259504808888996
Energy: 1.4182516416740611
Energy: 1.8439177353982348
Energy: 1.8033392193201352
Energy: 1.4766978495447631
Energy: 1.4426810196381454
Energy: 1.432336926676647
Energy: 1.4391873422366839
Energy: 1.4187855218238699
Energy: 1.6175952351969405
Energy: 1.5327140600460367
Energy: 1.4200347163141154
Energy: 1.4408282539697124
Energy: 1.4077011785455227
Energy: 1.644831128151921
Energy: 1.6312043777406209
Energy: 1.4533329722524553
Energy: 1.424540659303129
Energy: 1.7542538080014851
Energy: 1.6741338411333186
Energy: 1.4209607982623902
Energy: 1.441003206699833
Energy: 1.4161544688788767
Energy: 1.9610928486290262
Energy: 1.433665662420918
Energy: 1.725056831194239
Energy: 1.432986212605281
Energy: 1.4275516716873151
Energy: 1.4500593415378138
Energy: 1.4747258482529806
Energy: 1.6302246064468837
Energy: 1.4060481721193892
Energy: 1.4160564298944982
Energy: 1.4203361252891307
Energy: 1.4312424766459786
Energy: 1.673731287132145
Energy: 1.7740683928880467
Energy: 1.4329616542828079
Energy: 1.4405284265183134
Energy: 1.4515568467407607
Energy: 1.6217740763587798
Energy: 1.9115754399546434
Energy: 1.6560132278115864
Energy: 1.7284040227838318
Energy: 1.4349152302914772
Energy: 1.4115256010135064
Energy: 1.5036566672870026
Energy: 1.415346330387617
Energy: 1.7726036740754982
Energy: 1.4222281604204199
Energy: 1.8582121410458279

minimum gb energy = 1.3865853156172343 eV
minimum distance =  2.22894047329548 Angstroms
sigma value = 67


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

Energy: 1.8701395629149529
Energy: 2.0763769095357287
Energy: 1.6406180782160165
Energy: 1.6599012681966736
Energy: 1.6413169924916835
Energy: 2.1716090138153934
Energy: 1.3765877018681238
Energy: 1.4446114144783762
Energy: 1.4335857337835112
Energy: 1.6055101484322352
Energy: 1.4348637038567216
Energy: 1.4385561625814092
Energy: 1.602350823075542
Energy: 1.4378212477131467
Energy: 1.3549559157832516
Energy: 1.5938385632795014
Energy: 1.3822574844843634
Energy: 1.6187604732615195
Energy: 1.5974189786007966
Energy: 1.6749871276014614
Energy: 1.4400591934226044
Energy: 1.6115240365527206
Energy: 1.4618947390695207
Energy: 1.6621033637521139
Energy: 1.6007172802471412
Energy: 1.4375036448718292
Energy: 1.3588521368005804
Energy: 1.648503346948757
Energy: 1.444773118794602
Energy: 1.6157974594522264
Energy: 1.6323210605021452
Energy: 1.665038473557465
Energy: 2.015067437156837
Energy: 1.5947428587782684
Energy: 1.6707275214816721
Energy: 1.6465957071212989
Energy: 1.8412462657178514
Energy: 1.432616104140826
Energy: 1.7111926845196503
Energy: 1.6582168315293506
Energy: 1.6920358630833727
Energy: 1.6015340390109933
Energy: 1.849085170882252
Energy: 1.3813946517552502
Energy: 1.3868293170305732
Energy: 1.3848439914979433
Energy: 1.3696537096770023
Energy: 1.9410109507570656
Energy: 1.6380103081212376
Energy: 1.4066063498757753
Energy: 1.4050356167454785
Energy: 1.354707438267884
Energy: 1.4212524374616624
Energy: 1.3987505913179614
Energy: 1.862573903068417
Energy: 1.4007151811587686
Energy: 1.4095407876771096
Energy: 1.3812528685816023
Energy: 1.387501513519299
Energy: 1.4348758705817872
Energy: 1.8473932584622093
Energy: 1.414982962247914
Energy: 1.3844927083267036
Energy: 1.3921248999137292
Energy: 1.7660620520340375
Energy: 1.4382615840959427
Energy: 1.6386811301775883
Energy: 1.7590137221858149
Energy: 1.3530125512160993
Energy: 1.380075915145211
Energy: 1.4110057514294216
Energy: 1.9675404537699763
Energy: 1.6136737136668078
Energy: 1.387624867272103
Energy: 1.3486438712292315
Energy: 1.3801902989871722
Energy: 1.442858156329092
Energy: 1.6166277114669723
Energy: 1.5929620466639558
Energy: 1.42441612083077
Energy: 1.4466684561940188
Energy: 1.6209892549120832
Energy: 1.4152467774757194
Energy: 1.4481960850466244
Energy: 1.5984101447541181
Energy: 1.432068759319311
Energy: 1.411242558393932
Energy: 1.6030669538416729
Energy: 1.4428987723289437
Energy: 1.3769022482251123
Energy: 1.3920874221197774
Energy: 1.4224555662330283
Energy: 1.676418515016967
Energy: 1.590229909704249
Energy: 1.6769135135702709
Energy: 1.4502525340746735
Energy: 1.8773206500016735
Energy: 1.3978670972521154
Energy: 1.604787991295427
Energy: 1.612504904737002
Energy: 1.6054856466149763
Energy: 1.6956928468657178
Energy: 1.8641751910266022
Energy: 1.3579195851641332
Energy: 1.6728045852873024
Energy: 1.8600977138522388
Energy: 1.4511232348117964
Energy: 1.3790172017947402
Energy: 1.3863698723624587
Energy: 1.3852755003518222
Energy: 1.9208578061407604
Energy: 1.8835172595017815
Energy: 1.681549842978413
Energy: 1.3822114958070335
Energy: 1.3675894874537626
Energy: 1.4213880820456215
Energy: 1.371827903350001
Energy: 1.8609116038349538
Energy: 1.4280539431946944
Energy: 1.3812299342936725
Energy: 1.3509093214432406
Energy: 1.4160259782159357
Energy: 1.4634836471963928
Energy: 1.8451332730442567
Energy: 1.4366043673429072
Energy: 1.3856855102638423
Energy: 1.3884314996526226
Energy: 1.3913915818342955
Energy: 1.4133986631069801
Energy: 1.6088173050477896
Energy: 1.4412724099888892
Energy: 1.386052818910405
Energy: 1.6163359274275737
Energy: 1.360174099851538
Energy: 1.440407593222312
Energy: 1.8730369199223589
Energy: 1.4446483941134105
Energy: 1.3722628071999248

minimum gb energy = 1.3486438712292315 eV
minimum distance =  2.23623396714843 Angstroms
sigma value = 33


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

Energy: 1.8645244052343948
Energy: 1.6106499005915338
Energy: 1.6348678414599276
Energy: 1.7484034845927554
Energy: 1.6350927667959032
Energy: 2.131524631913228
Energy: 1.5505702889971569
Energy: 1.5248317413749186
Energy: 1.7648883715109736
Energy: 1.690153309239422
Energy: 1.379416632475509
Energy: 1.5222084167826784
Energy: 1.4293499667745668
Energy: 1.2932183385074063
Energy: 1.6096116970751309
Energy: 1.5553824647675
Energy: 1.3856242354072064
Energy: 1.4490753660181779
Energy: 1.4180453116192362
Energy: 1.5022207420549964
Energy: 1.3800633295580444
Energy: 1.6340949988457092
Energy: 1.3596636378800928
Energy: 1.4877317751761632
Energy: 1.4263579319784812
Energy: 1.4392800081496158
Energy: 1.4662475132533197
Energy: 1.6775982858547267
Energy: 1.4442940141468044
Energy: 1.4352051952038503
Energy: 1.4415045414605747
Energy: 1.4549852488873491
Energy: 1.7384954322051256
Energy: 1.6849590168838755
Energy: 1.6604286925868401
Energy: 1.4397990353572427
Energy: 1.70994114140092
Energy: 1.4722486472480847
Energy: 1.6601969200547566
Energy: 1.5523362936335912
Energy: 1.2826681451243354
Energy: 1.564477090232807
Energy: 1.7194585257739896
Energy: 1.456038598661723
Energy: 1.4423870564281267
Energy: 1.4470103855078258
Energy: 1.3040803610426608
Energy: 1.6427959760085753
Energy: 1.6355095130453519
Energy: 1.3670198490536596
Energy: 1.4678780459749445
Energy: 1.4178893578792655
Energy: 1.502560667929845
Energy: 1.4505100225461283
Energy: 1.685091788118987
Energy: 1.3823488105407244
Energy: 1.4659004701913587
Energy: 1.4209181793715835
Energy: 1.2875290019326318
Energy: 1.7434972497382069
Energy: 1.6949242037397396
Energy: 1.8303209184460802
Energy: 1.3760972714824542
Energy: 1.4383998727946792
Energy: 1.3820484950985206
Energy: 1.606526981252638
Energy: 1.6932101865161722
Energy: 1.6858071987840408
Energy: 1.289223274812761
Energy: 1.6003941299025302
Energy: 1.2856596857567133
Energy: 1.6906220374513528
Energy: 1.8208554299818684
Energy: 1.638517552607277
Energy: 1.2889844264315624
Energy: 1.6124448949135322
Energy: 1.2962834702620423
Energy: 1.6884630897311532
Energy: 1.8130576993710643
Energy: 1.830535857063225
Energy: 1.2934379228109423
Energy: 1.3059017397051043
Energy: 1.5897326148051563
Energy: 1.9848184385161467
Energy: 1.8130642684053189
Energy: 1.2827614173257889
Energy: 1.2914924298700885
Energy: 1.2917006287177042
Energy: 1.2837753848378566
Energy: 1.7458042512236034
Energy: 1.7291604655381272
Energy: 1.2859267220719777
Energy: 1.311924289626446
Energy: 1.2833203584440718
Energy: 1.2899268974363078
Energy: 1.2814370505009405
Energy: 1.6888503574290257
Energy: 1.4717940587707186
Energy: 1.2917005414748037
Energy: 1.304162550482031
Energy: 1.2944723118275665
Energy: 1.6089797049791976
Energy: 1.781019386176392
Energy: 1.3749335061080825
Energy: 1.5150731333969196
Energy: 1.3048907313646312
Energy: 1.4453542798362056
Energy: 1.7677616881957943
Energy: 1.678939793436337
Energy: 1.6834359536161325
Energy: 1.6048002657580704
Energy: 1.6309842727834714
Energy: 1.505120543327742
Energy: 1.685142756818469
Energy: 1.6892379205702799
Energy: 1.5064080194841374
Energy: 1.4463521801746284
Energy: 1.555188505069009
Energy: 1.466625605134386
Energy: 1.686513907788909
Energy: 1.557121037726555
Energy: 1.607000933313471
Energy: 1.3026826844678336
Energy: 1.4354900791044585
Energy: 1.3725930231440875
Energy: 1.8129010750927834
Energy: 1.6871410611540911
Energy: 1.443661167328561
Energy: 1.485366811762894
Energy: 1.4200832209534833
Energy: 1.2854103923455915
Energy: 1.5098371895800042
Energy: 1.6777275572872696
Energy: 1.2820321060695412
Energy: 1.4386976866981054
Energy: 1.430080027608411
Energy: 1.2904043909700573
Energy: 1.4777103102790834
Energy: 1.7913583847509134
Energy: 1.870668583639673
Energy: 1.4368658076201555
Energy: 1.4322377291265818
Energy: 1.4568123170973004
Energy: 2.0691489912397683
Energy: 1.6825310166209362
Energy: 1.447418962462933
Energy: 1.4249024303656674
Energy: 1.5603550712146983
Energy: 1.2837193804492304
Energy: 1.6598990979320505
Energy: 1.4383567134379263
Energy: 1.4614391034961547
Energy: 1.6406976411257899
Energy: 1.8129680559308232
Energy: 1.3702116692207513
Energy: 1.4354467831700375
Energy: 1.41827682752202
Energy: 1.4690359294962971
Energy: 1.305015926556831
Energy: 1.6374640179732445
Energy: 1.285301380199279
Energy: 1.4354519707489406
Energy: 1.4211444062652676
Energy: 1.2862206218444525
Energy: 1.3741466747198356
Energy: 1.685473780842994
Energy: 1.472139046211697
Energy: 1.4683529335580157
Energy: 1.4345618887303124
Energy: 1.37338850363665
Energy: 1.8234068235064684
Energy: 1.6909364316021984
Energy: 1.8309005627496127
Energy: 1.4803657663029608
Energy: 1.6740442888228644
Energy: 1.3557819175970103
Energy: 1.689120352243611
Energy: 1.6893442553599574
Energy: 1.6331276852731824
Energy: 1.4292622709601903
Energy: 1.6292781394786093
Energy: 1.2835219646462275
Energy: 1.936109194942381
Energy: 1.7812424522657826
Energy: 1.64088392850225
Energy: 1.4192166705602376
Energy: 1.3122573830717676
Energy: 1.4605326262984921
Energy: 1.520118414496008
Energy: 1.8125268466947908
Energy: 1.4468482006309111
Energy: 1.301715162109887
Energy: 1.2916793383596146
Energy: 1.2991628946261418
Energy: 1.4717072412206302
Energy: 1.8184933913558912
Energy: 1.2850429782217492
Energy: 1.2960666815858943
Energy: 1.2787933639063107
Energy: 1.283658170474861
Energy: 1.3768163006805734
Energy: 1.7291618246698075
Energy: 1.2823165298643604
Energy: 1.2821372439236032
Energy: 1.2996130234000702
Energy: 1.2944990977335509
Energy: 1.3784372237664018
Energy: 1.6894092906294644
Energy: 1.2945835364996858
Energy: 1.3190957557801428
Energy: 1.3054073125203909
Energy: 1.5332154352151672
Energy: 1.5224079592635205
Energy: 1.689754400326549
Energy: 1.5341963602615527
Energy: 1.3005251062485317
Energy: 1.7646757108612403
Energy: 1.2825855394983119
Energy: 1.6843345395501113
Energy: 1.678998763230071
Energy: 1.931813001818904
Energy: 1.637670284712568

minimum gb energy = 1.2787933639063107 eV
minimum distance =  2.20809300962733 Angstroms
sigma value = 41


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

Energy: 2.129901631505033
Energy: 2.011880817553771
Energy: 1.3693765747489215
Energy: 1.383099411586164
Energy: 1.3708363229144442
Energy: 2.01631706512561
Energy: 1.6983043562880482
Energy: 1.144902430631271
Energy: 1.1409473221851534
Energy: 1.441794908205229
Energy: 1.1417364602476285
Energy: 1.3910044047641967
Energy: 1.3727925808536072
Energy: 1.139577916673377
Energy: 1.1419340765161372
Energy: 1.0365054121640478
Energy: 1.1393901010713503
Energy: 1.3846556352358412
Energy: 1.5881550874042338
Energy: 1.599653844886974
Energy: 1.1480211241183713
Energy: 1.3728158063389286
Energy: 1.1525883804275077
Energy: 1.5405355969488606
Energy: 1.3722914207564652
Energy: 1.4627816286358701
Energy: 1.1414334290227304
Energy: 1.3731272927434153
Energy: 1.1422893066377189
Energy: 1.3923085834183577
Energy: 1.3690966368728175
Energy: 1.3702192016140191
Energy: 1.1431488743770377
Energy: 1.3822708023615657
Energy: 1.8487362073209614
Energy: 1.3865627831952023
Energy: 1.6904824107752743
Energy: 1.5441004249101482
Energy: 1.1437009368910673
Energy: 1.370214832840636
Energy: 1.6136045294333299
Energy: 1.6973859142309247
Energy: 1.6937394610825478
Energy: 1.1448463923872951
Energy: 1.3849566132909144
Energy: 1.3718327194880058
Energy: 1.1573536556808781
Energy: 2.012990847440226
Energy: 1.36633079280332
Energy: 1.1434478750888275
Energy: 1.1442306357382594
Energy: 1.0370135914418288
Energy: 1.1479898776810695
Energy: 1.1419312653700344
Energy: 1.3932210027513279
Energy: 1.1445028304667912
Energy: 1.1482736640739697
Energy: 1.4404407357034565
Energy: 1.148573014272877
Energy: 1.4042067673066758
Energy: 1.3890947020213804
Energy: 1.5991203599124872
Energy: 1.1511788780099346
Energy: 1.366861953702243
Energy: 1.1469745914399734
Energy: 1.5461177464057114
Energy: 1.3691287711709057
Energy: 1.3900544722107713
Energy: 1.143642158356208
Energy: 1.3878511224578611
Energy: 1.1835240590415808
Energy: 1.3782069132723211
Energy: 1.3750693155976026
Energy: 1.3855629949327561
Energy: 1.142834276034238
Energy: 1.4420457133744684
Energy: 1.112697654800595
Energy: 1.3870230721115497
Energy: 1.6994227551303396
Energy: 1.6033257576853626
Energy: 1.3958565541608234
Energy: 1.372161375086355
Energy: 1.1430483789572303
Energy: 2.0209681971878486

minimum gb energy = 1.0365054121640478 eV
minimum distance =  2.22668114360126 Angstroms
sigma value = 11


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

Energy: 1.9609815214852897
Energy: 1.3661078919138765
Energy: 1.5787836748108386
Energy: 1.614562345174678
Energy: 1.5793561225164556
Energy: 2.195252823048453
Energy: 1.3586785694074524
Energy: 1.535218988682948
Energy: 1.5398497670008644
Energy: 1.7562068328389286
Energy: 1.6508533408530885
Energy: 1.3691436443357503
Energy: 1.3662263243985604
Energy: 1.4009738214867682
Energy: 1.6079762205929304
Energy: 1.6551120686328802
Energy: 1.5486980659939433
Energy: 1.3829787218479332
Energy: 1.3592612956119723
Energy: 1.4213457892040111
Energy: 1.432286742965565
Energy: 1.4743103848569898
Energy: 1.4319714617233197
Energy: 1.3907325577686926
Energy: 1.364932264472682
Energy: 1.3987589947338999
Energy: 1.5522982977820379
Energy: 1.5113884020376545
Energy: 1.4304522422705621
Energy: 1.3916917282266519
Energy: 1.3625044574810932
Energy: 1.400705155483227
Energy: 2.021771216843793
Energy: 1.7880207269037152
Energy: 1.546055886644753
Energy: 1.3796565368563638
Energy: 1.6100353127026845
Energy: 1.5512218393608475
Energy: 1.4892057740490716
Energy: 1.6006921994691676
Energy: 1.5541052335716958
Energy: 1.423673749921442
Energy: 1.5631267910849167
Energy: 1.5502374939805506
Energy: 1.4947312635116998
Energy: 1.5807756256593681
Energy: 1.5659353293102496
Energy: 2.0089631201646903
Energy: 1.3651169336921525
Energy: 1.3927737852045343
Energy: 1.5571745785021505
Energy: 1.7754169180870432
Energy: 1.5475892919983232
Energy: 1.3629209254893244
Energy: 1.4740516795330822
Energy: 1.4793223413197318
Energy: 1.5571588844494786
Energy: 1.8573115382207848
Energy: 1.5483449788520784
Energy: 1.4848320314284607
Energy: 1.5106128996817412
Energy: 1.5494215103454505
Energy: 1.425145476865143
Energy: 1.4784553638918532
Energy: 1.4279929543563323
Energy: 1.5863859101321987
Energy: 1.508751229856517
Energy: 1.5536169798373727
Energy: 1.5907759467934157
Energy: 1.511758029349142
Energy: 1.5505385343917668
Energy: 1.5831585035141404
Energy: 1.4745044252347657
Energy: 1.6049704109099276
Energy: 1.6014672477707501
Energy: 1.4845743678423426
Energy: 1.59470228716432
Energy: 1.5342805624754596
Energy: 1.7602431899059454
Energy: 1.5468271243968543
Energy: 1.3878274282433642
Energy: 1.364098776298316
Energy: 1.4047361931944644
Energy: 1.6121587488682827
Energy: 1.6475180192403729
Energy: 1.553207143397291
Energy: 1.4840518114258292
Energy: 1.3678192391320028
Energy: 1.541903378745706
Energy: 1.5431556956548704
Energy: 1.5779853511663775
Energy: 1.4925210641475848
Energy: 1.768074452890224
Energy: 2.190692075630983
Energy: 1.5388082823203082
Energy: 1.495684824503686
Energy: 1.7550383001529581
Energy: 1.426677758218579
Energy: 1.5334398756523286
Energy: 1.3595258552236447
Energy: 1.5560436276004737
Energy: 1.3623303450335473
Energy: 1.8264864638259513
Energy: 1.6066189352907285
Energy: 1.3927902757964237
Energy: 1.368939920564254
Energy: 1.4181521151781349
Energy: 1.7667950328357662
Energy: 1.474938073938138
Energy: 1.4329841462252757
Energy: 1.3925127399161652
Energy: 1.359984170933651
Energy: 1.4251087599747645
Energy: 1.5597059488302416
Energy: 1.4677999816855265
Energy: 1.4265598886063278
Energy: 1.4015479536708668
Energy: 1.3663443198532583
Energy: 1.4034341821355636
Energy: 1.5547849901437565
Energy: 1.7884250037822427
Energy: 1.9850240057738564
Energy: 1.3896448867739184
Energy: 1.363122096601101
Energy: 1.5427553026455314
Energy: 2.002843029562614
Energy: 1.4727389640531965
Energy: 1.5341699076338933
Energy: 1.538686742933904
Energy: 1.521743852874446
Energy: 1.5506258484310236
Energy: 1.600861821885245
Energy: 1.578869686281444
Energy: 1.3669168805897427
Energy: 1.9785680149834164
Energy: 1.563958451754412
Energy: 1.5519941133804669
Energy: 1.5862984139803062
Energy: 1.7749999335413187
Energy: 1.5575498509874262
Energy: 1.3774510204453172
Energy: 1.3645793485865898
Energy: 1.5413860294187152
Energy: 1.635167895740355
Energy: 1.9198411364422177
Energy: 1.5449823244909582
Energy: 1.3648936015900628
Energy: 1.474789402143493
Energy: 1.542270761473085
Energy: 1.399916224225351
Energy: 1.4777283615666315
Energy: 1.4270263091177469
Energy: 1.5486862319239971
Energy: 1.5140207767954672
Energy: 1.5504625859671866
Energy: 1.5335687973241654
Energy: 1.5172221559670975
Energy: 1.550563392189095
Energy: 1.552356358989082
Energy: 1.5115930516852147
Energy: 1.4383956602228056
Energy: 1.5464421353859688
Energy: 1.4836769341653424
Energy: 1.5956677737772336
Energy: 1.4261144479498256
Energy: 1.4756114269180303
Energy: 1.5990286684203734
Energy: 1.5277531633011203
Energy: 1.3645502376920229
Energy: 1.396816297317852
Energy: 1.547024589655762
Energy: 1.7354951440624773
Energy: 1.5487213380927725
Energy: 1.3701012553404572
Energy: 1.3650793238275052
Energy: 1.3886419894723423
Energy: 1.5581793584973875
Energy: 1.6491045869895913
Energy: 1.5499950730036867
Energy: 1.3684380341213804
Energy: 1.8585745263778015
Energy: 1.5978757943755828
Energy: 1.4912427029725273
Energy: 1.579328270103376
Energy: 1.3720085070800117
Energy: 1.76682080837001

minimum gb energy = 1.3586785694074524 eV
minimum distance =  2.21803173172437 Angstroms
sigma value = 57


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

Energy: 2.5353608968605754
Energy: 2.181764468907197
Energy: 1.4809074624918872
Energy: 1.6711169683332376
Energy: 1.4846566445789349
Energy: 2.1896200020616288
Energy: 1.4663695557221725
Energy: 1.5196971521481872
Energy: 1.5100692004963392
Energy: 1.4883652612494647
Energy: 1.5284951208148136
Energy: 1.5135279242691753
Energy: 1.479955632127452
Energy: 1.4895184906634515
Energy: 1.48586360049263
Energy: 1.4840187058891527
Energy: 1.4785692001523365
Energy: 1.4888899485822227
Energy: 1.4808898411427254
Energy: 1.4844501223053346
Energy: 1.5086903437481929
Energy: 1.4846021504985996
Energy: 1.4930508818067811
Energy: 1.4871310426859337
Energy: 1.4796239228285428
Energy: 1.4892584857312527
Energy: 1.5138908196756184
Energy: 1.485547360817835
Energy: 1.4885194584864867
Energy: 1.4840636289331088
Energy: 1.4869791371591894
Energy: 1.5124900359794262
Energy: 1.834593768746924
Energy: 1.4870160533137786
Energy: 1.833241790052588
Energy: 1.48317387503264
Energy: 1.4767967580920376
Energy: 1.5271548929461254
Energy: 1.4806371791633435
Energy: 1.480217659456021
Energy: 1.4804481374758716
Energy: 1.5275370792357272
Energy: 1.4763766695219203
Energy: 1.480692208407684
Energy: 1.6120713138253735
Energy: 1.4860308239700584
Energy: 1.6354644913133445
Energy: 1.475343757551564
Energy: 1.4907471370421959
Energy: 1.620424930395614
Energy: 1.880324899697138
Energy: 1.4686743106884292
Energy: 1.5084217968796203
Energy: 1.6155435309121766
Energy: 1.4796977435641738
Energy: 1.5095602667392214
Energy: 1.8821493480744804
Energy: 1.4670389785791633
Energy: 1.5104322763193359
Energy: 1.4848026276787274
Energy: 1.466044935946258
Energy: 1.4763240107033533
Energy: 1.6221830713087322
Energy: 1.492201002201258
Energy: 1.630143496661221
Energy: 1.4790109597579113
Energy: 1.467789698704721
Energy: 1.5337062458846622
Energy: 1.4883132485325614
Energy: 1.479359370488737
Energy: 1.4913723762452167
Energy: 1.526891660680944
Energy: 1.4790172230544767
Energy: 1.4884423477449424
Energy: 1.4884453904901744
Energy: 1.4818406044841061
Energy: 1.4851922185311874
Energy: 1.501042534166604
Energy: 1.4847521852924987
Energy: 1.4761910185991411
Energy: 1.4862037400617534
Energy: 1.481625609784381
Energy: 1.514918283863393
Energy: 1.831082932112217
Energy: 1.489603555235651
Energy: 1.5278631558713989
Energy: 1.5103253134374288
Energy: 1.605137990782649
Energy: 1.5223263015846347
Energy: 1.482835901369436
Energy: 1.4822466055832522
Energy: 1.486915893810425
Energy: 1.4790364336349189
Energy: 1.8482071116158374
Energy: 1.4867995737137205
Energy: 1.4838802531343467
Energy: 1.466819913509078
Energy: 1.515510753200709
Energy: 1.5126272278694368
Energy: 1.6115846805660914
Energy: 1.528289309596788
Energy: 1.5037559385567172

minimum gb energy = 1.466044935946258 eV
minimum distance =  2.23560637256711 Angstroms
sigma value = 9


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

Energy: 2.715083927978323
Energy: 1.6188638629746948
Energy: 1.4949866081917662
Energy: 1.6611999188800444
Energy: 1.5682230021876173
Energy: 2.255615964619878
Energy: 1.481911916677217
Energy: 1.64028564950635
Energy: 1.6508971705569704
Energy: 1.5436223106216218
Energy: 1.6582398280905701
Energy: 1.6253197476740064
Energy: 1.4988952905070176
Energy: 1.5156651778207137
Energy: 1.6019565614199107
Energy: 1.6001696361313886
Energy: 1.6117082960074227
Energy: 1.5181947800401991
Energy: 1.5470519364169053
Energy: 1.5725370466430721
Energy: 1.5131293521964972
Energy: 1.4867660783751164
Energy: 1.5656708077403902
Energy: 1.5655288673436525
Energy: 1.548014829101405
Energy: 1.5578869852638335
Energy: 1.5690024946415642
Energy: 1.5471229161205842
Energy: 1.5381229075332605
Energy: 1.566117415012787
Energy: 1.4816969126690913
Energy: 1.564442973944675
Energy: 1.5644351900059885
Energy: 1.5463128144874068
Energy: 1.5606188266202559
Energy: 1.614264508951823
Energy: 1.5471420133858649
Energy: 1.5634935417846476
Energy: 1.5953641565481564
Energy: 1.483335084728276
Energy: 1.568208287370877
Energy: 1.5794285257006206
Energy: 1.5433643915126936
Energy: 1.6792128952441523
Energy: 1.622805141406223
Energy: 1.5132759216041654
Energy: 1.6837404085377798
Energy: 1.9395745233269017
Energy: 1.4811825651835082
Energy: 1.5653534819331323
Energy: 1.6759992558052053
Energy: 1.545662510497208
Energy: 1.6382747343498933
Energy: 1.5525556999158545
Energy: 1.5061980986011894
Energy: 1.521494494019684
Energy: 1.6562012529507946
Energy: 1.5437075785845897
Energy: 1.6392350362806867
Energy: 1.5980439124728645
Energy: 1.4808288280074644
Energy: 1.6836383002453104
Energy: 1.52239385775351
Energy: 1.498998136930168
Energy: 1.518170782754117
Energy: 1.6045822697287149
Energy: 1.4897883496963318
Energy: 1.66471360411451
Energy: 1.5421155094248662
Energy: 1.4815712996363415
Energy: 1.645939836567756
Energy: 1.6023996004408239
Energy: 1.5030559238432846
Energy: 1.632731798069808
Energy: 1.6120705590752848
Energy: 1.5987721439958658
Energy: 1.6410954426380202
Energy: 1.6143327737948647
Energy: 1.4866176010082723
Energy: 1.5852515422614148
Energy: 1.6673063036564182
Energy: 1.593130617862461
Energy: 1.5675881268188216
Energy: 1.5719994563931496
Energy: 1.5513091761826914
Energy: 1.5711163479671912
Energy: 1.5472706792439783
Energy: 1.4856566820370076
Energy: 1.5690188016685378
Energy: 1.5619737097835307
Energy: 1.5013259203191542
Energy: 1.541934861541205
Energy: 1.5595524319455545
Energy: 1.5576274037004032
Energy: 1.5616496193540639
Energy: 1.5466768886069606
Energy: 1.4818556297181524
Energy: 1.5655983252044106
Energy: 1.5677990687171008
Energy: 1.4877899037434394
Energy: 1.58637807766673
Energy: 1.6831114142083181
Energy: 1.5425321005977266
Energy: 1.6319673259789547
Energy: 1.509237385359289
Energy: 1.5025222467147832
Energy: 1.5456919090505974
Energy: 1.9365238145087857
Energy: 1.4837347930667228
Energy: 1.6435061695256818
Energy: 1.6493434820155397
Energy: 1.4858256411364044
Energy: 1.6623816095365882
Energy: 1.5686529177609032
Energy: 1.4998369874562214
Energy: 1.533108909920617
Energy: 1.6144011011199129
Energy: 1.930933012950592
Energy: 1.5515489296283644
Energy: 1.5129090514790766
Energy: 1.4803561821885085
Energy: 1.6627869706872704
Energy: 1.4849649335006418
Energy: 1.509720302984649
Energy: 1.6433254511583526
Energy: 1.5650238400169147

minimum gb energy = 1.4803561821885085 eV
minimum distance =  2.2267854327635 Angstroms
sigma value = 27


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

Energy: 1.7118015829522986
Energy: 1.531476369584483
Energy: 1.6555467093304848
Energy: 1.6497296824216088
Energy: 1.5436898481083738
Energy: 1.900293264486096
Energy: 1.5094308463789787
Energy: 1.629997995412439
Energy: 1.5107585266104435
Energy: 1.52035456826243
Energy: 1.7669117283810443
Energy: 1.5146227219343409
Energy: 1.484341141899357
Energy: 1.5297890597583768
Energy: 1.8275905032101372
Energy: 1.8241930359046887
Energy: 1.6393886811002654
Energy: 1.5314310342032051
Energy: 1.4867311756527817
Energy: 1.6242898120829696
Energy: 1.628073356857894
Energy: 1.5166493315275729
Energy: 1.6472731614760059
Energy: 1.532818517213766
Energy: 1.4898200146508864
Energy: 1.6498809661740443
Energy: 1.5433965294942895
Energy: 1.5198660629566652
Energy: 1.5587105161490984
Energy: 1.6236465598688072
Energy: 1.4844998693224736
Energy: 1.5866771338469625
Energy: 1.543270302025425
Energy: 1.5234573530026516
Energy: 1.5844093031209203
Energy: 1.502476793362957
Energy: 1.510854154971632
Energy: 1.6057572485570313
Energy: 1.561971197025416
Energy: 1.5568945407980201
Energy: 1.567227952848332
Energy: 1.6419434094639787
Energy: 1.5122320339560646
Energy: 1.6549070276017501
Energy: 1.5244317288191702
Energy: 1.5258384621722654
Energy: 1.651159013159915
Energy: 1.6465071984677089
Energy: 1.4679746500225208
Energy: 1.5222401835726078
Energy: 1.7941647694858793
Energy: 1.5218820934409785
Energy: 1.5233150911748414
Energy: 1.5195104982910215
Energy: 1.4712178585954943
Energy: 1.5514564651825151
Energy: 1.7096237837773451
Energy: 1.5206211527800162
Energy: 1.6433973691550476
Energy: 1.5797614612991175
Energy: 1.4919312914343872
Energy: 1.7005623451937395
Energy: 1.506990095791398
Energy: 1.4988590553050765
Energy: 1.5426855590725936
Energy: 2.0957308622017297
Energy: 1.4936288810688287
Energy: 1.6851343174409785
Energy: 1.497078426060824
Energy: 1.489767681238978
Energy: 1.6190813150397854
Energy: 1.6872378689387708
Energy: 1.4655448147335084
Energy: 1.4764601941237345
Energy: 1.4632462389184253
Energy: 1.458059784004187
Energy: 1.4790704956404253
Energy: 1.4855532232334496
Energy: 1.4721061062021628
Energy: 1.4875734539252181
Energy: 1.687848389994469
Energy: 1.4915499384112574
Energy: 1.6848477110671314
Energy: 1.502856483950823
Energy: 1.483631602120777
Energy: 1.686665724559205
Energy: 1.5305646885926933
Energy: 1.4915998624475797
Energy: 1.5331061498842
Energy: 1.834898321678988
Energy: 1.4799465824546454
Energy: 1.6441866753556775
Energy: 1.5778612486309938
Energy: 1.5075007483766423
Energy: 1.5898912968909023
Energy: 1.5285013350585837
Energy: 1.463988812197142
Energy: 1.515721447055707
Energy: 1.503922614507111
Energy: 1.5786361390086003
Energy: 1.527444384087626
Energy: 1.4668706945546577
Energy: 1.507015224641249
Energy: 1.5519505115101107
Energy: 1.607492229630452
Energy: 1.506787568940906
Energy: 1.587657237508476
Energy: 1.5492000644522113
Energy: 1.5363887501698286
Energy: 1.5747326910775317
Energy: 1.6340692602786442
Energy: 1.518661126573455
Energy: 1.5879052843460109
Energy: 1.5699942754649159
Energy: 1.516329415315732
Energy: 1.6094371382472408
Energy: 1.6388260582944605
Energy: 1.637930114194369
Energy: 1.63825187303835
Energy: 1.495806199012808
Energy: 1.4985413952148527
Energy: 1.6543194162646613
Energy: 1.531056574224448
Energy: 1.5022931375154778
Energy: 1.5482033512902922
Energy: 1.7066449142190605
Energy: 1.474828823039237
Energy: 1.6361369636647343
Energy: 1.521684049458291
Energy: 1.5220612131216473
Energy: 1.611138468019486
Energy: 1.9962550107729344
Energy: 1.5848571784455734
Energy: 1.5331167627013462
Energy: 1.7734687883326061
Energy: 1.492149085240778
Energy: 1.7656112646609186
Energy: 1.5300172434621306
Energy: 1.4978432536813637
Energy: 1.5344407381367737
Energy: 1.7406022021281538
Energy: 1.501722068567724
Energy: 1.5727689688290505
Energy: 1.5506453218221206
Energy: 1.5249359664697626
Energy: 1.7703536675668237
Energy: 1.5549132876045892
Energy: 1.5476625367173669
Energy: 1.5586845505974591
Energy: 1.7136428999465572

minimum gb energy = 1.458059784004187 eV
minimum distance =  2.20541111902721 Angstroms
sigma value = 19


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

Energy: 1.7390749981901443
Energy: 1.4361242483518184
Energy: 1.4709971004420461
Energy: 1.5749451664093548
Energy: 1.4713669481034926
Energy: 1.436898172530336
Energy: 1.4275657345114194
Energy: 1.6037758617752593
Energy: 1.487980510685158
Energy: 1.4210648661621608
Energy: 1.796317441224649
Energy: 1.5045206840956094
Energy: 1.422518360650865
Energy: 1.4784863889706448
Energy: 1.6978314869845919
Energy: 1.829887651308905
Energy: 1.4793615510698905
Energy: 1.4810289514365866
Energy: 1.4275625858477456
Energy: 1.5531597069420087
Energy: 1.6136498288121952
Energy: 1.4209119151794556
Energy: 1.6124178883174056
Energy: 1.4784854749272527
Energy: 1.4102764364163036
Energy: 1.6182337242222695
Energy: 1.5162835373293264
Energy: 1.445439015376057
Energy: 1.521025006449401
Energy: 1.6321974547903266
Energy: 1.4289586139206192
Energy: 1.5139903533963144
Energy: 1.5076162901641634
Energy: 1.418631644903077
Energy: 1.5651228881372894
Energy: 1.428661803347499
Energy: 1.4337335601170638
Energy: 1.5114017087793425
Energy: 1.51357655841083
Energy: 1.4922489951966222
Energy: 1.5352473874600618
Energy: 1.5146414556195313
Energy: 1.4353382186061947
Energy: 1.5427733697307562
Energy: 1.4132969917385951
Energy: 1.4156593958243553
Energy: 1.511512385388382
Energy: 1.5149613169941083
Energy: 1.4893055885543312
Energy: 1.5242406920093252
Energy: 1.5733879898165104
Energy: 1.4112016996299204
Energy: 1.5849576977630968
Energy: 1.5182473206183966
Energy: 1.4332578839426307
Energy: 1.569927055334351
Energy: 1.655538095392581
Energy: 1.4202655042764636
Energy: 1.6508899179602314
Energy: 1.426745430899321
Energy: 1.4026691498768906
Energy: 1.5065049594697766
Energy: 1.4384909307504392
Energy: 1.3994317104489318
Energy: 1.4670332599696017
Energy: 1.498311672643681
Energy: 1.4162331718377832
Energy: 1.7104597834858988
Energy: 1.4989967836308988
Energy: 1.4001538066394401
Energy: 1.5168369156595987
Energy: 1.6508168399940173
Energy: 1.4577899899655875
Energy: 1.4840400924565154
Energy: 1.8588586815425472
Energy: 1.4089576794166059
Energy: 1.4689398499535404
Energy: 1.482474540904859
Energy: 1.4040315400814087
Energy: 1.5075335943777086
Energy: 1.7129973399260112
Energy: 1.4082535671154528
Energy: 1.710541159808819
Energy: 1.402717610183204
Energy: 1.384634516153524
Energy: 1.3872143497477922
Energy: 1.4076381000653815
Energy: 1.4040832583038256
Energy: 1.4022403094103761
Energy: 1.3881309851866512
Energy: 1.4615636065074453
Energy: 1.7112110326114827
Energy: 1.3958141370411838
Energy: 1.3999249443243036
Energy: 1.3867450746461778
Energy: 1.7122000931731427
Energy: 1.4022220076222403
Energy: 1.486169432891661
Energy: 1.6917519231385025
Energy: 1.8277695626354824
Energy: 1.693623476820884
Energy: 1.4867688200827174
Energy: 1.4297244057202965
Energy: 1.4828016538260005
Energy: 1.653400125253043
Energy: 1.401819624424248
Energy: 1.6411528499506614
Energy: 1.5280336048619598
Energy: 1.4095457749550235
Energy: 1.551880632063905
Energy: 1.475536570946336
Energy: 1.3997734648126339
Energy: 1.566186579690554
Energy: 1.5212921663386785
Energy: 1.4348621501384724
Energy: 1.5763956936150805
Energy: 1.475842138016733
Energy: 1.414065690982809
Energy: 1.4731401308611602
Energy: 1.432672071267588
Energy: 1.4297488496549695
Energy: 1.5640982034521933
Energy: 1.5269254928521285
Energy: 1.506881238399091
Energy: 1.5296445776381031
Energy: 1.4304155608979703
Energy: 1.430150290952771
Energy: 1.5247663932440516
Energy: 1.5516321125072394
Energy: 1.4167220515169097
Energy: 1.6111063365091804
Energy: 1.5225632920659553
Energy: 1.4702323704794875
Energy: 1.5057431655764968
Energy: 1.6353338969862763
Energy: 1.4120936191792366
Energy: 1.5622984307421448
Energy: 1.5056181531102046
Energy: 1.4297510977199541
Energy: 1.5615033685731687
Energy: 1.6455808279094288
Energy: 1.4133200220325293
Energy: 1.6417541872579697
Energy: 1.490086992783918
Energy: 1.4293372129383923
Energy: 1.6384153504071195
Energy: 1.4657831335622953
Energy: 1.4418816100801501
Energy: 1.4691021744232817
Energy: 1.6376771246258928
Energy: 1.402515039690603
Energy: 1.5878306505834707
Energy: 1.4436466499921596
Energy: 1.4122191778707762
Energy: 1.4760341279832419
Energy: 1.5947305170995716
Energy: 1.4293946497137278
Energy: 1.4298600546271474
Energy: 1.7949241902774926
Energy: 1.408585868793246
Energy: 1.6047510910331566
Energy: 1.4305946838922017
Energy: 1.4284644895994207
Energy: 1.4765497685545976
Energy: 1.4282988245702666
Energy: 1.4080309136755855
Energy: 1.4903600132620418
Energy: 1.4689801192936582
Energy: 1.4191998628798213
Energy: 1.816741262348561
Energy: 1.480324552751942
Energy: 1.4719653696486195
Energy: 1.4762645734332056
Energy: 1.7437595894917972

minimum gb energy = 1.384634516153524 eV
minimum distance =  2.20799519821195 Angstroms
sigma value = 101


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

Energy: 1.3966270212044565
Energy: 1.329001576782657
Energy: 1.4135525274401837
Energy: 1.4156895341697244
Energy: 1.4145955568969995
Energy: 1.7115150128475272
Energy: 1.332729137238759
Energy: 1.5327653796001526
Energy: 1.4600604707415374
Energy: 1.3398583498851488
Energy: 1.7845363119175277
Energy: 1.4585443314266244
Energy: 1.3393353517301205
Energy: 1.416591308717028
Energy: 1.7224921806741145
Energy: 1.726681707881986
Energy: 1.4144777471094443
Energy: 1.4143430398515073
Energy: 1.3388232281073817
Energy: 1.417504458728745
Energy: 1.4618836547847462
Energy: 1.3392440357667763
Energy: 1.5298900341084696
Energy: 1.3324228684399353
Energy: 1.3295917033614655
Energy: 1.5293123835201472
Energy: 1.4650924869747282
Energy: 1.403722343962657
Energy: 1.4662211558327196
Energy: 1.5317955023678473
Energy: 1.3384493778526882
Energy: 1.4939243033664507
Energy: 1.4560841312115613
Energy: 1.3414527520825898
Energy: 1.553563800025763
Energy: 1.3342661838353673
Energy: 1.332030117415546
Energy: 1.4465754748858255
Energy: 1.4931402940939427
Energy: 1.5082231671970958
Energy: 1.456349269085407
Energy: 1.436102829739299
Energy: 1.3328547890295734
Energy: 1.5001792413744273
Energy: 1.3402399691157123
Energy: 1.3402952047424823
Energy: 1.4995025924861916
Energy: 1.437258895287229
Energy: 1.3373709922428008
Energy: 1.4386354482389236
Energy: 1.491914265716798
Energy: 1.3440945004776719
Energy: 1.5042180547169781
Energy: 1.4388021308553414
Energy: 1.3389879161292764
Energy: 1.421710449791311
Energy: 1.4991680294631022
Energy: 1.3395776316421437
Energy: 1.4979000223393548
Energy: 1.3349124947928865
Energy: 1.3361879394177432
Energy: 1.4534832591786417
Energy: 1.4568880479434583
Energy: 1.3790803150995576
Energy: 1.4688253536723275
Energy: 1.5288742328540947
Energy: 1.3343638726638183
Energy: 1.6282017301887943
Energy: 1.4210660689051082
Energy: 1.341064346619469
Energy: 1.6286996150279394
Energy: 1.6291462116568582
Energy: 1.3996052588360297
Energy: 1.4146789860008253
Energy: 1.4175468929685233
Energy: 1.3359385964554449
Energy: 1.4126136504479838
Energy: 1.4139621411217038
Energy: 1.339501827800084
Energy: 1.458993408507488
Energy: 1.7841045120543157
Energy: 1.3331744691651601
Energy: 1.5304604158012578
Energy: 1.5609453381301872
Energy: 1.3702021433200777
Energy: 1.422908556894236
Energy: 1.3398510949379863
Energy: 1.3393692946167777
Energy: 1.3391184485696421
Energy: 1.5282987118919331
Energy: 1.3364173622160669
Energy: 1.7842107313981501
Energy: 1.3395067111970103
Energy: 1.3454570713804306
Energy: 1.419877937326816
Energy: 1.5312628393326437
Energy: 1.4121712722967132
Energy: 1.3378716203109444
Energy: 1.328844723041542
Energy: 1.7123449473706058
Energy: 1.4230203567923672
Energy: 1.339043906708317
Energy: 1.4140273382571398
Energy: 1.4174656865222388
Energy: 1.7811629202115349
Energy: 1.4193778125561676
Energy: 1.530285571826927
Energy: 1.4022329857633384
Energy: 1.3289364104407642
Energy: 1.5404987934281829
Energy: 1.4156950456534114
Energy: 1.3394083236375547
Energy: 1.5213869085375051
Energy: 1.715068941698062
Energy: 1.327602664913727
Energy: 1.6038470015041586
Energy: 1.416742991166881
Energy: 1.3383831851270853
Energy: 1.4145058915434896
Energy: 1.5449715537935995
Energy: 1.342159375624869
Energy: 1.4621143386545343
Energy: 1.6302334538277532
Energy: 1.549797429341496
Energy: 1.530898442500273
Energy: 1.4577962707870553
Energy: 1.338170232503973
Energy: 1.455882994021426
Energy: 1.5484428434479436
Energy: 1.3356557227378156
Energy: 1.562004649196519
Energy: 1.4583706006455377
Energy: 1.3428986602114654
Energy: 1.4940448928127106
Energy: 1.4419691883691923
Energy: 1.333363624640383
Energy: 1.4541661790305973
Energy: 1.498538506668023
Energy: 1.3405731221745258
Energy: 1.5384200068483096
Energy: 1.4437043694114575
Energy: 1.33177810260648
Energy: 1.4439538385021724
Energy: 1.3424775467169974
Energy: 1.339520862140533
Energy: 1.5095521688265565
Energy: 1.4352186975388532
Energy: 1.4022238220801064
Energy: 1.444505865890496
Energy: 1.5003025194927906
Energy: 1.3392503517931584
Energy: 1.492408672652819
Energy: 1.5040748887528128
Energy: 1.3336847275202048
Energy: 1.4986362661535912
Energy: 1.4972670458757655
Energy: 1.337812221686265
Energy: 1.4600614940822503
Energy: 1.4709971017083936
Energy: 1.3405796453768386
Energy: 1.4676599468024294
Energy: 1.4537328030855732
Energy: 1.3387456475237653
Energy: 1.45579285385876
Energy: 1.6289267449330842
Energy: 1.3319100632623007
Energy: 1.6273431435900259
Energy: 1.4171022937154165
Energy: 1.3324329399323798
Energy: 1.4144743365073937
Energy: 1.4148159079290816
Energy: 1.340658600937824
Energy: 1.4161062741111667
Energy: 1.6480317331133334
Energy: 1.3334389437284824
Energy: 1.5332564928863703
Energy: 1.4157440259291652
Energy: 1.3374607572423924
Energy: 1.4165468984546532
Energy: 1.530192705904777
Energy: 1.341513436174246
Energy: 1.342519235964866
Energy: 1.5451668215780718
Energy: 1.337899747627142
Energy: 1.5310411939825583
Energy: 1.3434615268817522
Energy: 1.3418201007105737
Energy: 1.3426550816119307
Energy: 1.5470908964894847
Energy: 1.3329213804671103
Energy: 1.5307264917731496
Energy: 1.3392212240803656
Energy: 1.3270811872797192
Energy: 1.5295841074834164
Energy: 1.416619018161854
Energy: 1.4134213296631835
Energy: 1.5508491827767497
Energy: 1.328669043796002

minimum gb energy = 1.3270811872797192 eV
minimum distance =  2.24236073792273 Angstroms
sigma value = 33


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

Energy: 0.014417149246154134
Energy: 0.01507260836111407
Energy: 0.09962296407981737
Energy: 0.11082884410860996
Energy: 0.09145149399239288
Energy: 0.01504313198187893
Energy: 0.014489666656330237
Energy: 0.16034989137796654
Energy: 0.14510105879417573
Energy: 0.10622149018253031
Energy: 0.17262026021767554
Energy: 0.13097842708618823
Energy: 0.9681340555360238
Energy: 0.09580799179896257
Energy: 0.014995239713746571
Energy: 0.016050414040462372
Energy: 0.10709962475250401
Energy: 0.10155930550911692
Energy: 0.10438005253959355
Energy: 0.16034989137796654
Energy: 0.14510105879417573
Energy: 0.10622149018253031
Energy: 0.17262026021767554
Energy: 0.13097842708547733

minimum gb energy = 0.014417149246154134 eV
minimum distance =  2.4448137505982 Angstroms
sigma value = 1