Model name: model_name=EAM_Dynamo_VailheFarkas_1997_CoAl__MO_284963179498_005
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049696564674378
cohesive_energy=3.3687229668997767
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.5504119091320937e-19, 2.2559768530363795e-19, 2.7727268828003996e-19, 3.18145816390014e-19, 3.51743460404994e-19, 3.79997845345584e-19, 4.04110603687284e-19, 4.24882823747094e-19, 4.428880847599859e-19, 4.58555770063872e-19, 4.72206314985552e-19, 4.8410568084627e-19, 4.94460548431812e-19, 5.03429533228944e-19, 5.11153626781458e-19, 5.177513901602699e-19, 5.233253626699559e-19, 5.279604596721179e-19, 5.317303812919199e-19, 5.347040211246239e-19, 5.3693745535242e-19, 5.384835558042299e-19, 5.393855812491719e-19, 5.396867904563639e-19, 5.39390387779074e-19, 5.384162643856019e-19, 5.366490635583e-19, 5.339558046365459e-19, 5.30187485193378e-19, 5.25155048385984e-19, 5.1863739383887195e-19, 5.10371764584066e-19, 5.00037725294766e-19, 4.87255560108714e-19, 4.7155422909551395e-19, 4.52360153020194e-19, 4.2896196545725796e-19, 4.0047526490473795e-19, 3.6579615166180794e-19, 3.2351150593728e-19, 2.71794846368394e-19, 2.0827975806673198e-19, 1.2986234423924578e-19, 3.23626862654928e-20, -8.98849930853412e-20, -2.4479977226212796e-19, -4.43631494718162e-19, -7.02721080378936e-19, -1.0470656890881179e-18, -1.515729591535896e-18, -6.4003752175032e-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: 0.012678959837842388
Energy: 0.014317415030508094
Energy: 0.19559959837521348
Energy: 0.3287300141373873
Energy: 0.3205367528123527
Energy: 0.1288295888317694
Energy: 0.013464128237069474
Energy: 0.013518170780022754
Energy: 0.26483852724329143
Energy: 0.10705244451050674
Energy: 0.1952443592960631
Energy: 0.22623229072531248
Energy: 0.013301263361435568
Energy: 0.060933687800560805
Energy: 0.013102664959495863
Energy: 0.2668684026682778
Energy: 0.1958696192285617
Energy: 0.19506867505099146
Energy: 0.2656851415274807
Energy: 0.060249410108844846
Energy: 0.06149014402569428
Energy: 0.014344360257856506
Energy: 0.1957274438900265
Energy: 0.23712990431831102
Energy: 0.32873889399200185
Energy: 0.31931104859458215
Energy: 0.06042764525849345
Energy: 0.01333110608971756
Energy: 0.06039609502373121
Energy: 0.3181073937988508
Energy: 0.10697738178979764
Energy: 0.19556327853956418
Energy: 0.2257857074045574
Energy: 0.013280749373327225
Energy: 0.06037008994345348
Energy: 0.012970746306122289
Energy: 0.26634672639091583
Energy: 0.1948005935437854
Energy: 0.19556151012192413
Energy: 0.26550172911630865
Energy: 0.0600736915510154
Energy: 0.061288285795298644

minimum gb energy = 0.012678959837842388 eV
minimum distance =  2.83685593700065 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 0.4326793766268819
Energy: 0.4786070237484615
Energy: 0.40226322830214456
Energy: 0.4157371173382757
Energy: 0.4202300621079563
Energy: 0.46469485183748316
Energy: 0.4779792063454742
Energy: 0.37431487889548765
Energy: 0.3683907513283148
Energy: 0.38923383674808953
Energy: 0.4113364589238987
Energy: 0.38043881642385863
Energy: 0.38868409041877294
Energy: 0.401839037112643
Energy: 0.4760537721891302
Energy: 0.44221709778144735
Energy: 0.47935235718731445
Energy: 0.4451279840388552
Energy: 0.41602038249645
Energy: 0.4310948156315253
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Energy: 0.38897235389932383
Energy: 0.3903413121064068
Energy: 0.3790861515316577
Energy: 0.3719127690001308
Energy: 0.4025535018150799
Energy: 0.38931797514498856
Energy: 0.39893600893791786
Energy: 0.3817022958204633
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Energy: 0.3781985477099453
Energy: 0.39547931390481295
Energy: 0.40500550057301404
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Energy: 0.39300428707391727
Energy: 0.39989359750251474
Energy: 0.37324160061651573
Energy: 0.4252355821457788
Energy: 0.3948109513863343
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Energy: 0.39163089759088854
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Energy: 0.43142843345735854
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Energy: 0.3981946426240041
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Energy: 0.4086715781739245
Energy: 0.41383285997875996
Energy: 0.4128656947535054
Energy: 0.4024485263062958
Energy: 0.371427985549761
Energy: 0.3853949806744168
Energy: 0.4294085986024278
Energy: 0.36804569943861587
Energy: 0.4159141508309835
Energy: 0.4095881011993303
Energy: 0.4187671735609331
Energy: 0.41977591384694385
Energy: 0.39817953354011265
Energy: 0.3768870995340776
Energy: 0.3772210399228926
Energy: 0.3732352378920706
Energy: 0.3802766928971441
Energy: 0.4092275582180217
Energy: 0.39610329353601337
Energy: 0.3894272486737194
Energy: 0.4413974750384735
Energy: 0.4118584727290648
Energy: 0.4133097880579926
Energy: 0.4426223919830767
Energy: 0.4428828466017119
Energy: 0.3798128558053494
Energy: 0.42409524552075883
Energy: 0.4034228050937079
Energy: 0.3742327857251926
Energy: 0.38747696903711876
Energy: 0.408448967006561
Energy: 0.3949607500946637
Energy: 0.4521026583899587
Energy: 0.4018169017455798
Energy: 0.4454762102487686
Energy: 0.3999254889143628
Energy: 0.4291628217987474
Energy: 0.4085000116275625
Energy: 0.38749330071330046
Energy: 0.38359302300090103
Energy: 0.4104196681099048
Energy: 0.38942206522984957
Energy: 0.3843496412486529
Energy: 0.381417876341231
Energy: 0.38409600963913865
Energy: 0.4123303615154442
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Energy: 0.39310137611524065
Energy: 0.4362060716586275
Energy: 0.42186928571141824
Energy: 0.3696666926242439
Energy: 0.3995153590008852

minimum gb energy = 0.36271836098745597 eV
minimum distance =  2.61246728710928 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 0.4345173671649643
Energy: 0.4338662655557869
Energy: 0.38993753125649994
Energy: 0.3779286890730973
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Energy: 0.3773539021557821
Energy: 0.38474570033587335
Energy: 0.3876744484931339
Energy: 0.42966139490854005
Energy: 0.38043279783898715
Energy: 0.36980011263362383
Energy: 0.3755887022871373
Energy: 0.3846772170217185
Energy: 0.3760422916619516
Energy: 0.37804772970958994
Energy: 0.42931355730987475
Energy: 0.41336920837999297
Energy: 0.36918166413145487
Energy: 0.37638507105314506
Energy: 0.3795824696842755
Energy: 0.37705187503112503
Energy: 0.3807671608718478
Energy: 0.4029823498008238
Energy: 0.4009794245874715
Energy: 0.4290870086689223
Energy: 0.37093139883545984
Energy: 0.38459648252507606
Energy: 0.38378723720700453
Energy: 0.3822405765268256
Energy: 0.4399064612903875
Energy: 0.40700836652894357
Energy: 0.39329718004938014
Energy: 0.3866333063714436
Energy: 0.37877325616973245
Energy: 0.40133488898510183
Energy: 0.42607606037621704
Energy: 0.3748021138904965
Energy: 0.3787508408793325
Energy: 0.39491669690291953
Energy: 0.38318001426917997
Energy: 0.3874940823275617
Energy: 0.37444799405883084
Energy: 0.38101353979268276
Energy: 0.396651153320799
Energy: 0.3708814162708791
Energy: 0.37345237963441696
Energy: 0.4079679925850185
Energy: 0.378584662595596
Energy: 0.37496719899505826
Energy: 0.4059737499078747
Energy: 0.3765726056697751
Energy: 0.37225756813713234
Energy: 0.3730588364937293
Energy: 0.4102628840964261
Energy: 0.3823593643498499
Energy: 0.40355864095064775
Energy: 0.4138672188086511
Energy: 0.38813655689445475
Energy: 0.37562006043289464
Energy: 0.3927162148469331
Energy: 0.3815067131241623
Energy: 0.3865117552396287
Energy: 0.3776634444953712
Energy: 0.42689654471318245
Energy: 0.4178753567921922
Energy: 0.3909527860024133
Energy: 0.40736936843498955
Energy: 0.36907212864458605
Energy: 0.3802881936500042
Energy: 0.3885161979586992
Energy: 0.4257824107771991
Energy: 0.4302625253853264
Energy: 0.38063812612581
Energy: 0.4092895252607571
Energy: 0.38844023380757037
Energy: 0.3850967088922935
Energy: 0.3925930880799793
Energy: 0.38933492378835066
Energy: 0.43791963074973494
Energy: 0.3833923317403145
Energy: 0.4026062103769649
Energy: 0.3736089436950921
Energy: 0.3958200230125702
Energy: 0.39257560256270024
Energy: 0.37440320738106125
Energy: 0.3751826229836305
Energy: 0.3808234683391436
Energy: 0.3693497105302554
Energy: 0.37456167521837663
Energy: 0.3882898694753618
Energy: 0.3762023095955457
Energy: 0.378732653491039
Energy: 0.4291541330867467
Energy: 0.39631381873627364
Energy: 0.4078560861059829
Energy: 0.36798237467843964
Energy: 0.39076535632023374
Energy: 0.3840789434898889
Energy: 0.3770708115947144
Energy: 0.41424990263739925
Energy: 0.4076515479269753
Energy: 0.39986833053466697
Energy: 0.38283174900771116
Energy: 0.3881632282343058
Energy: 0.39332640877731045
Energy: 0.40379872169838765
Energy: 0.4179649529213648
Energy: 0.4148508006717542
Energy: 0.39813738647783425
Energy: 0.3787807469170956
Energy: 0.38489405442633773
Energy: 0.38872315220716447
Energy: 0.41511865447343865
Energy: 0.40497046239738027
Energy: 0.3722982892433073
Energy: 0.3810666183564067
Energy: 0.40539864854918445
Energy: 0.3872278385455136
Energy: 0.38329911428948604
Energy: 0.41132131553890383
Energy: 0.37817729842286946

minimum gb energy = 0.36699842191760035 eV
minimum distance =  2.58544472298078 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 0.41582953777127685
Energy: 0.38430171908025057
Energy: 0.39800883754765437
Energy: 0.38811033885138513
Energy: 0.3933209270243221
Energy: 0.392168529141149
Energy: 0.3867773769610717
Energy: 0.3838248232495558
Energy: 0.38826313155874365
Energy: 0.3875432487882848
Energy: 0.38962550806515067
Energy: 0.3763259485193577
Energy: 0.37297463012878435
Energy: 0.40740324955362905
Energy: 0.37107222485211094
Energy: 0.3967605687335025
Energy: 0.3982433485652288
Energy: 0.3747231667871029
Energy: 0.38161758415740493
Energy: 0.368742899385199
Energy: 0.39622132430986795
Energy: 0.369239442591055
Energy: 0.4280678464500172
Energy: 0.3695551415012487
Energy: 0.4395857588529846
Energy: 0.40834518088238336
Energy: 0.38398146807081146
Energy: 0.4102694646839981
Energy: 0.39214495248323766
Energy: 0.38250421720085315
Energy: 0.39209650806660445
Energy: 0.3798936702580108
Energy: 0.38852565936110434
Energy: 0.37965669519559314
Energy: 0.4006163492605619
Energy: 0.37724254485944153
Energy: 0.39072765735483783
Energy: 0.37887868328124963
Energy: 0.3778331062237077
Energy: 0.3829969241206322
Energy: 0.37947844297335187
Energy: 0.4052071365825473
Energy: 0.38119579710195767
Energy: 0.38527875749323337
Energy: 0.3781832599024601
Energy: 0.3936219170617801
Energy: 0.3723397238232573
Energy: 0.3767359336845066
Energy: 0.39304674166211595
Energy: 0.3759740666739403
Energy: 0.414966506299422
Energy: 0.3889223838159832
Energy: 0.40527972017606756
Energy: 0.4036627155930897
Energy: 0.3805619614005861
Energy: 0.3983428521704966
Energy: 0.39424815855197215
Energy: 0.3898498086159556
Energy: 0.38450527930657236
Energy: 0.3554346445575611
Energy: 0.3761193924766515
Energy: 0.370032714078673
Energy: 0.3704105194842479
Energy: 0.3720787731929544
Energy: 0.4127925362404197
Energy: 0.3706338359840201
Energy: 0.4056338370794364
Energy: 0.4038568531613871
Energy: 0.3716726924452866
Energy: 0.4244293715579087
Energy: 0.38788424020973994
Energy: 0.38081286203642517
Energy: 0.3778286510903533
Energy: 0.38148483517619164
Energy: 0.3845150720926209
Energy: 0.377915457025604
Energy: 0.3976101580788693
Energy: 0.36696118544092493
Energy: 0.41289948330516835
Energy: 0.37829207671923465
Energy: 0.3912465010101096
Energy: 0.3829656332540438
Energy: 0.3788714889061686
Energy: 0.374250100705913
Energy: 0.3719269993305912
Energy: 0.39985936769876596
Energy: 0.37047219908680007
Energy: 0.4044873059324166
Energy: 0.3927424636081475
Energy: 0.3715993703865435
Energy: 0.3866299585203538
Energy: 0.37175567403615184
Energy: 0.41862484075688866
Energy: 0.38332403558410705
Energy: 0.39286570884411814
Energy: 0.39483592896298053
Energy: 0.4219954852665061
Energy: 0.3857314522838887
Energy: 0.3683686080199439
Energy: 0.37337723819655133
Energy: 0.3645735406124581
Energy: 0.3702255893383324
Energy: 0.37648056792847706
Energy: 0.363545363842611
Energy: 0.38009882034548137
Energy: 0.3714256979512768
Energy: 0.3952684793022111
Energy: 0.36456370006646804
Energy: 0.38912390909682537
Energy: 0.40401226776739724
Energy: 0.38092028503383146
Energy: 0.4280691115916866
Energy: 0.3996109929754241
Energy: 0.3828025013402411
Energy: 0.39193273220841224
Energy: 0.38706978823147803
Energy: 0.3832061019454439
Energy: 0.3847124404070291
Energy: 0.3875953997125412
Energy: 0.3698009218368304
Energy: 0.414110708692231
Energy: 0.3773835905693957
Energy: 0.38837219512208404
Energy: 0.375466526076467
Energy: 0.37000631424475783
Energy: 0.42663016893695704
Energy: 0.3977476614768243
Energy: 0.3752109670532556
Energy: 0.3846321300116961
Energy: 0.3745914129626358
Energy: 0.4209226432368481
Energy: 0.4215478477585887
Energy: 0.3728260882365129
Energy: 0.40638953571816533
Energy: 0.4060038618813307
Energy: 0.38653867283557436
Energy: 0.4196392738373722
Energy: 0.396773312904194
Energy: 0.3972194616117951
Energy: 0.40369973475288773
Energy: 0.3651377934784461
Energy: 0.3705307796141972
Energy: 0.3806289215697054
Energy: 0.3814948542948257
Energy: 0.37913333962511436
Energy: 0.4070543607423883
Energy: 0.3656348881032564
Energy: 0.36440796196554026
Energy: 0.3994275051263334
Energy: 0.3837687946896358
Energy: 0.3910438247335982
Energy: 0.39605733275368227
Energy: 0.3780417589294285
Energy: 0.41315358542797714
Energy: 0.4006428021964004
Energy: 0.370855218010287
Energy: 0.38773048303847046
Energy: 0.3827191626142816
Energy: 0.3810823665178905
Energy: 0.37847277232969173
Energy: 0.37825801688103455
Energy: 0.38601754212687517
Energy: 0.40129463777252067
Energy: 0.38290703959608613
Energy: 0.3970423029308997
Energy: 0.38002170182106293
Energy: 0.3770389223324767
Energy: 0.4087411324785386
Energy: 0.38078743282010163
Energy: 0.3926773794862571
Energy: 0.38706937851750933
Energy: 0.3709360394203093
Energy: 0.37718499841373626
Energy: 0.40260831658720114
Energy: 0.3827683684004524
Energy: 0.38824087414300995
Energy: 0.41124387683323776
Energy: 0.3736554546447152
Energy: 0.4241516939571416
Energy: 0.4036674592240459
Energy: 0.40471186332739023
Energy: 0.3785418539308488
Energy: 0.38634988354500854
Energy: 0.38501902051326636
Energy: 0.38045380468437157
Energy: 0.39004631250996824
Energy: 0.4082755387161186
Energy: 0.3720306262652819
Energy: 0.38949144098845945
Energy: 0.36500483522687444
Energy: 0.4039211787921062
Energy: 0.37726449329636047
Energy: 0.3980317991864489
Energy: 0.38453836158317656
Energy: 0.36949588138250267
Energy: 0.4188349649368217
Energy: 0.3844007333292649
Energy: 0.3830105849291062
Energy: 0.37762720184508175
Energy: 0.39020029705042436
Energy: 0.4018546277332955
Energy: 0.37565110341889413
Energy: 0.3997425643496279
Energy: 0.37360486435891455
Energy: 0.4152847451671232
Energy: 0.37526287650682805
Energy: 0.42086370329626227
Energy: 0.3813375086037145
Energy: 0.38081757053278337
Energy: 0.4230981748973433
Energy: 0.415144879679394
Energy: 0.39158812443400126
Energy: 0.4016390200189294
Energy: 0.37439685765515573
Energy: 0.3863927773798606
Energy: 0.38123548629844844
Energy: 0.4065249221400467
Energy: 0.37909644093803013
Energy: 0.4115899323897493
Energy: 0.3813790989550305
Energy: 0.4023137113305546
Energy: 0.4123669706961774
Energy: 0.38847838015278197
Energy: 0.3986171784633667
Energy: 0.3980614459455887
Energy: 0.38649591000716504
Energy: 0.3815113334665565
Energy: 0.391485283002836
Energy: 0.39781775371738193
Energy: 0.3817329442609697
Energy: 0.39017247747334427
Energy: 0.3776582591684444
Energy: 0.40872782858231854
Energy: 0.39539681235483654
Energy: 0.3794077962701949
Energy: 0.37868268812537115
Energy: 0.3782570264397441
Energy: 0.3979463359120559
Energy: 0.3902184390700308
Energy: 0.3983524303665964
Energy: 0.3914161383969673
Energy: 0.3865401095162305
Energy: 0.38680805012958025
Energy: 0.38730596846069965
Energy: 0.42558810142407016
Energy: 0.3736263903967525
Energy: 0.41843492811943717
Energy: 0.3882792724385292
Energy: 0.4201989739935328
Energy: 0.3868678272984076
Energy: 0.379317637676036
Energy: 0.4027678118155601

minimum gb energy = 0.3554346445575611 eV
minimum distance =  2.59031478238928 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 0.3521498594710151
Energy: 0.33373969499724276
Energy: 0.47423723517784205
Energy: 0.4307963853884362
Energy: 0.40825419884063835
Energy: 0.4107969489720542
Energy: 0.33362261239420504
Energy: 0.33366577214000315
Energy: 0.396469211902335
Energy: 0.40940787123696404
Energy: 0.4027585403288551
Energy: 0.3753467420358093
Energy: 0.37458993971069526
Energy: 0.3797210190375131
Energy: 0.372417641371135
Energy: 0.3774181398667361
Energy: 0.4075163900965054
Energy: 0.4004041950032623
Energy: 0.37523792601955874
Energy: 0.37424700587753434
Energy: 0.37341244755757536
Energy: 0.36885226780779595
Energy: 0.37805948090776054
Energy: 0.4061922997739823
Energy: 0.3812152640480633
Energy: 0.4058996718063777
Energy: 0.3856132488308839
Energy: 0.38540941164100373
Energy: 0.37554377768879155
Energy: 0.37480351984050747
Energy: 0.39717521440894976
Energy: 0.3910435943632372
Energy: 0.41587746720512275
Energy: 0.38640720393735745
Energy: 0.3740636734619863
Energy: 0.33354880099371426
Energy: 0.377602127301395
Energy: 0.3886991497574583
Energy: 0.38077003193398695
Energy: 0.3804181437132653
Energy: 0.3829543761414278
Energy: 0.38061340596223253
Energy: 0.3932670071697474
Energy: 0.4011283747862858
Energy: 0.3818026496269881
Energy: 0.4051198970966974
Energy: 0.3337143464304598
Energy: 0.3363166723591953
Energy: 0.3813926925150001
Energy: 0.3335874130145716
Energy: 0.3788645377288824
Energy: 0.4067265092108054
Energy: 0.40997661674855285
Energy: 0.4135345754681936
Energy: 0.39258890033129756
Energy: 0.3802396889621641
Energy: 0.3335529337342636
Energy: 0.3799143812279587
Energy: 0.4057258049042767
Energy: 0.3775526115741304
Energy: 0.37550100297330113
Energy: 0.38353296963455186
Energy: 0.380121812889785
Energy: 0.392857289674628
Energy: 0.39345793937301443
Energy: 0.40751995245388994
Energy: 0.40462285021251854
Energy: 0.3772956425475262
Energy: 0.3740402645651965
Energy: 0.37403194275424256
Energy: 0.36977204113759077
Energy: 0.3825200001425747
Energy: 0.4071906211629827
Energy: 0.37778371782379805
Energy: 0.37735505758479115
Energy: 0.3825108753341095
Energy: 0.41663560612016537
Energy: 0.38072933044217844
Energy: 0.3752328572939011
Energy: 0.3764850336027946
Energy: 0.38115209878121575
Energy: 0.4030765828147709
Energy: 0.3872628199491241
Energy: 0.38371355150348124
Energy: 0.33496599891818635
Energy: 0.37591042647391765
Energy: 0.4083385653291993
Energy: 0.38459622111896263
Energy: 0.40684417759143776
Energy: 0.4089876803675071
Energy: 0.3722917938513711
Energy: 0.3747301246665809
Energy: 0.37762649594478104
Energy: 0.3931975081219534
Energy: 0.3974135574772195
Energy: 0.33428633983606915
Energy: 0.3340083434618287
Energy: 0.3802582026719208
Energy: 0.33355009502284605
Energy: 0.39619069281333597
Energy: 0.3851822035594226
Energy: 0.419525883152541
Energy: 0.3339398397544834
Energy: 0.3337000742400339
Energy: 0.3799166797156729
Energy: 0.33305898730046896
Energy: 0.3924948646589666
Energy: 0.39895686632723243
Energy: 0.3912143278520432
Energy: 0.4093070664334317
Energy: 0.41132699536412165
Energy: 0.3366981687881958
Energy: 0.37290462972699806
Energy: 0.39716286409724655
Energy: 0.4102504599650703
Energy: 0.40682042418640496
Energy: 0.37538356879920803
Energy: 0.37425478733779494
Energy: 0.37970157207638144
Energy: 0.37219583225281033
Energy: 0.3798366597705997
Energy: 0.4074982683335818
Energy: 0.4000544407476237
Energy: 0.37567303944471403
Energy: 0.3746399859499488
Energy: 0.3722752118605839
Energy: 0.368755477159683
Energy: 0.3776366725053311
Energy: 0.40615422603560947
Energy: 0.3814701440487818
Energy: 0.405846330963413
Energy: 0.40712547857621434
Energy: 0.3838620421971362
Energy: 0.37501990042582134
Energy: 0.37512176706922196
Energy: 0.3971179259484081
Energy: 0.39096420048146063
Energy: 0.4151170326114364
Energy: 0.3865982445607144
Energy: 0.37386393950634494
Energy: 0.3335404564101504
Energy: 0.378674593089433
Energy: 0.3894225247480392
Energy: 0.3809041679524252
Energy: 0.37706726685156383
Energy: 0.33369245192950375
Energy: 0.3802837178401349
Energy: 0.3939186645326532
Energy: 0.4018048035737797
Energy: 0.38216052111849125
Energy: 0.40538918431088034
Energy: 0.3335798535799742
Energy: 0.3365004805962326
Energy: 0.3813185348478037
Energy: 0.33360716538461704
Energy: 0.379068043269362
Energy: 0.4040058217356463
Energy: 0.39428181120350086
Energy: 0.41678087915206213
Energy: 0.3923107037938563
Energy: 0.38042599370314295
Energy: 0.3336506976632111
Energy: 0.3804107382046981
Energy: 0.4056912227143949
Energy: 0.3778862960042335
Energy: 0.37456753212758753
Energy: 0.3835480632329096
Energy: 0.380232396745722
Energy: 0.39301222862351126
Energy: 0.3940044667656121
Energy: 0.40754353040166713
Energy: 0.4045837283716314
Energy: 0.3764131673500117
Energy: 0.37396980551490655
Energy: 0.3736130738419511
Energy: 0.36960265945491133
Energy: 0.3825593235406754
Energy: 0.40808724616743314
Energy: 0.3782562396987383
Energy: 0.37579569396938534
Energy: 0.39212310712554427
Energy: 0.4162994385526496
Energy: 0.38036069621832974
Energy: 0.3754310258357097
Energy: 0.37663701413967343
Energy: 0.38119504101126683
Energy: 0.42419581307861975
Energy: 0.38698820386631416
Energy: 0.3835338531733389
Energy: 0.33542304751021607
Energy: 0.3750287362942321
Energy: 0.40784859229554987
Energy: 0.38405617601372366
Energy: 0.40649547641403155
Energy: 0.4091271026812651
Energy: 0.37257326851423855
Energy: 0.37451828414724403
Energy: 0.3778131015888706
Energy: 0.39309053160633367
Energy: 0.39740321159884845
Energy: 0.3343676123830661
Energy: 0.33411008446870044
Energy: 0.38033018064605806
Energy: 0.3337651303243579
Energy: 0.3963141509121327
Energy: 0.3847812129688798
Energy: 0.41049208828670186
Energy: 0.3336036308882235
Energy: 0.3336240454196082
Energy: 0.3798972269527872

minimum gb energy = 0.33305898730046896 eV
minimum distance =  2.66570035942548 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 0.4861737938527921
Energy: 0.42452240991117457
Energy: 0.3774390021949294
Energy: 0.3805421244874501
Energy: 0.3749825060144983
Energy: 0.3941332951338115
Energy: 0.4603766138639203
Energy: 0.4039286465235515
Energy: 0.3628282941009067
Energy: 0.3822023774923738
Energy: 0.3825502977413862
Energy: 0.38522390107131027
Energy: 0.3873617455451887
Energy: 0.4365324789689368
Energy: 0.36804596131929307
Energy: 0.4141189450371108
Energy: 0.38009195234769594
Energy: 0.3636740449785977
Energy: 0.3761373550577571
Energy: 0.3739656240670144
Energy: 0.4146434829057459
Energy: 0.35922670360589337
Energy: 0.4172201984844748
Energy: 0.3967711026342217
Energy: 0.38998462665586825
Energy: 0.3624114632449641
Energy: 0.41084445509913936
Energy: 0.38722922228906287
Energy: 0.3624217825440636
Energy: 0.35338104884302785
Energy: 0.3749834175297011
Energy: 0.36641430370558403
Energy: 0.36338271979752523
Energy: 0.3761218910256271
Energy: 0.39340748177406987
Energy: 0.36382133459728977
Energy: 0.3737860158587073
Energy: 0.39436958826203733
Energy: 0.3743067463837829
Energy: 0.3830434340346973
Energy: 0.3756700485270466
Energy: 0.3753287134181919
Energy: 0.3710743635764725
Energy: 0.37921976134617585
Energy: 0.36508701557457646
Energy: 0.3600806079759824
Energy: 0.35277820500914925
Energy: 0.35413688295474166
Energy: 0.37472332921479073
Energy: 0.3661785293765529
Energy: 0.37565707248610386
Energy: 0.38308309707931204
Energy: 0.42850941587282415
Energy: 0.3759238790005762
Energy: 0.3884898956735378
Energy: 0.38911486599323547
Energy: 0.3682100961260244
Energy: 0.39516647260445664
Energy: 0.3920705337099353
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Energy: 0.366681736091217
Energy: 0.3394050894928444
Energy: 0.41996482245332306
Energy: 0.3494580917757259
Energy: 0.3756661116820631
Energy: 0.3536351950385264
Energy: 0.3896320268219788
Energy: 0.3771142174248137
Energy: 0.37532696953759276
Energy: 0.35983041603084204
Energy: 0.3683882002931552
Energy: 0.40732764966785495
Energy: 0.3591492356551339
Energy: 0.35415236576601977
Energy: 0.3667314702864809
Energy: 0.3680947126629533
Energy: 0.38483494093771914
Energy: 0.41890755640925953
Energy: 0.3514013222838762
Energy: 0.3439840368370101
Energy: 0.3684553613127083
Energy: 0.3845018748664646
Energy: 0.3356477224003767
Energy: 0.44776474156576673
Energy: 0.4064176570976234
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Energy: 0.3844703822323433
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Energy: 0.34136324140458907
Energy: 0.3860382152240876
Energy: 0.3911042861816706
Energy: 0.4068487470164575
Energy: 0.3477170319450103
Energy: 0.38005410362613934
Energy: 0.395208614686213
Energy: 0.40155804342516654
Energy: 0.3847934858494635
Energy: 0.3608056644035208
Energy: 0.372674847305145
Energy: 0.3729144343757147
Energy: 0.4008679898523017
Energy: 0.391375384515448
Energy: 0.4459698804306924
Energy: 0.3669063939419784
Energy: 0.36992213070050484
Energy: 0.35768255200827315
Energy: 0.36279247445251633
Energy: 0.36405288649854317
Energy: 0.38863562815313735
Energy: 0.33547148955615874
Energy: 0.42187296963165244
Energy: 0.35692379054572604
Energy: 0.35884593784667834
Energy: 0.3461931793132463
Energy: 0.36317127806375804
Energy: 0.3985883119938405
Energy: 0.35941046985316816
Energy: 0.3699511026098581
Energy: 0.43196585739742005
Energy: 0.37125068890050794
Energy: 0.3482892587779637
Energy: 0.3857234564121489
Energy: 0.3760395418313925
Energy: 0.34650770641807743
Energy: 0.3938701349868064
Energy: 0.3709929840319645
Energy: 0.33347070860724193
Energy: 0.34772108480142133
Energy: 0.35109368362118437
Energy: 0.3834534804168949
Energy: 0.3697989677483031
Energy: 0.35886211293871567
Energy: 0.3668499316923204
Energy: 0.40070357067648094
Energy: 0.3937263995115743
Energy: 0.37167952297450446
Energy: 0.3901610316856023
Energy: 0.3625799137690998
Energy: 0.3919656476409131
Energy: 0.3912654457114883
Energy: 0.4475231034587149
Energy: 0.4539281437391738
Energy: 0.3786044234528462
Energy: 0.42102525180640443
Energy: 0.3390544237082024
Energy: 0.4216701057497038
Energy: 0.37660651826711716
Energy: 0.3831418203366976
Energy: 0.35856638640867144
Energy: 0.3841884088261823
Energy: 0.3623640660477612
Energy: 0.37665064808896115
Energy: 0.372748354340416
Energy: 0.3723282563059235
Energy: 0.38727853141899404
Energy: 0.3773743344176432
Energy: 0.3696966978154279
Energy: 0.44726753402805974
Energy: 0.42423406853927376
Energy: 0.39162932336481443
Energy: 0.36725532331503163
Energy: 0.37146538315254224
Energy: 0.44103873619004996
Energy: 0.42410172028451176
Energy: 0.3847316905720575
Energy: 0.3503327090883492
Energy: 0.3803749581271721
Energy: 0.35184245512797674
Energy: 0.3954004071277048
Energy: 0.3661974057280751
Energy: 0.37407735009083587
Energy: 0.4087712387671657

minimum gb energy = 0.33347070860724193 eV
minimum distance =  2.61271664429453 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 0.40648521787260705
Energy: 0.5234398145069098
Energy: 0.40401251594887216
Energy: 0.4806138840983076
Energy: 0.47701261750744295
Energy: 0.4433697217033315
Energy: 0.49364030848767787
Energy: 0.4374153765223932
Energy: 0.5025850444047832
Energy: 0.41495231457260795
Energy: 0.4284048470444022
Energy: 0.4283973878337305
Energy: 0.36184349660564447
Energy: 0.4633549690408174
Energy: 0.4534331691463582
Energy: 0.4969938546616696
Energy: 0.4235687246805541
Energy: 0.41930430865108975
Energy: 0.41647121584708785
Energy: 0.4116409879130629
Energy: 0.4533661399093855
Energy: 0.40093206960228156
Energy: 0.4282015600015339
Energy: 0.4355555807920106
Energy: 0.4923691066317537
Energy: 0.48939528245128644
Energy: 0.4596426690621342
Energy: 0.4830993029235701
Energy: 0.36664179331351876
Energy: 0.4434710105752291
Energy: 0.4313624829521874
Energy: 0.4482825674429682
Energy: 0.41400950348438387
Energy: 0.41607059595156065
Energy: 0.4763452882043658
Energy: 0.40312395803055673
Energy: 0.4118260269392871
Energy: 0.41513300368409545
Energy: 0.4429186834659673
Energy: 0.42294706477533833
Energy: 0.4125487652811931
Energy: 0.4188848864210574
Energy: 0.3950231806014212
Energy: 0.4288200027565377
Energy: 0.40918362280503784
Energy: 0.4005002412185071
Energy: 0.4543562054763105
Energy: 0.43454693517039455
Energy: 0.426257957830281
Energy: 0.3849963906941811
Energy: 0.4192062220400938
Energy: 0.4183246643857524
Energy: 0.5055163896563045
Energy: 0.47427402729175194
Energy: 0.43983692990591855
Energy: 0.4416955499395357
Energy: 0.3662095627255272
Energy: 0.4121604282348282
Energy: 0.4193543114748594
Energy: 0.4132761493265988
Energy: 0.43085935912685186
Energy: 0.4210264036045671
Energy: 0.4230381375182838
Energy: 0.4434992414438144
Energy: 0.4180368407958318
Energy: 0.3872563238994459
Energy: 0.40967056512234246
Energy: 0.3838017804915613
Energy: 0.3811869178955794
Energy: 0.38532398248238
Energy: 0.39230453368828067
Energy: 0.4304385818160225
Energy: 0.36433965850692185
Energy: 0.42311976030187576
Energy: 0.4078559348177156
Energy: 0.3637066841278672
Energy: 0.4547383674859945
Energy: 0.370880028185286
Energy: 0.38376896804723387
Energy: 0.42578204510686657
Energy: 0.45779622234288664
Energy: 0.42571825669246044
Energy: 0.4347672490155704
Energy: 0.40921668813259254
Energy: 0.40705233473304836
Energy: 0.4117196829362052
Energy: 0.38572095841073334
Energy: 0.4758363828363925
Energy: 0.4681819935839214
Energy: 0.38898655509926755
Energy: 0.43600309437518486
Energy: 0.39545095418133114
Energy: 0.4334140959356221
Energy: 0.41216879282851915
Energy: 0.41447027915826956
Energy: 0.40774267746606735
Energy: 0.40223886805228126
Energy: 0.4062726070978475
Energy: 0.38236265506356193
Energy: 0.40695042450458585
Energy: 0.4092185361218841
Energy: 0.4114133582469382
Energy: 0.39042208116583665
Energy: 0.4044491159108229
Energy: 0.46188703656559654
Energy: 0.39956537588853236
Energy: 0.4570339193443776
Energy: 0.44029750483575275
Energy: 0.481555678812341
Energy: 0.4274495435348236
Energy: 0.4620941981069032
Energy: 0.4705494257103947
Energy: 0.41815786055601734
Energy: 0.4504798759998327
Energy: 0.4408037288958748
Energy: 0.4660653386529827
Energy: 0.4725536595731583
Energy: 0.45991829187321004
Energy: 0.4554574635887541
Energy: 0.4125868010880001
Energy: 0.46974632372141595
Energy: 0.44330184850269155
Energy: 0.4508767008435929
Energy: 0.45012285584230843
Energy: 0.3774676668543537
Energy: 0.47873030240482034
Energy: 0.4330059944727234
Energy: 0.47734764266248797
Energy: 0.43307706401734897
Energy: 0.46586818196976093
Energy: 0.4570590521403586
Energy: 0.4287087066028026
Energy: 0.45952844336377174
Energy: 0.40858138759607127
Energy: 0.45522883738222875
Energy: 0.40879827066626634
Energy: 0.4605492027841754
Energy: 0.47785229428112036
Energy: 0.47150938637688516
Energy: 0.5052245941338498
Energy: 0.4423731206840755
Energy: 0.46776281967955835
Energy: 0.4240462551939743
Energy: 0.41536049162053124
Energy: 0.46322489359227675
Energy: 0.3998494289952628
Energy: 0.46033517789433176
Energy: 0.4042731186716846
Energy: 0.4614574395358518
Energy: 0.4166958302786849
Energy: 0.4277326495611832
Energy: 0.46010833586538924
Energy: 0.4009714347485612
Energy: 0.46199662233237826
Energy: 0.4068990587724596
Energy: 0.48815304627430994
Energy: 0.4081343141425944
Energy: 0.4712089747800628
Energy: 0.47317388719431774
Energy: 0.4414478992800826
Energy: 0.5085166725800306
Energy: 0.4414277789673729
Energy: 0.509038444369532
Energy: 0.41277638053001375
Energy: 0.443254083085901
Energy: 0.4291098377292928
Energy: 0.4609319624801134
Energy: 0.43415752348103565
Energy: 0.4117562735744302
Energy: 0.494195914411308
Energy: 0.42794827144692793
Energy: 0.4131431853439279
Energy: 0.45039391891268743
Energy: 0.40879405791576523
Energy: 0.4533104271607895
Energy: 0.40146712592818035
Energy: 0.4332022013913658
Energy: 0.4360189976065269
Energy: 0.46334156346531313
Energy: 0.47772973872953745
Energy: 0.45715465632642016
Energy: 0.48296258352141547
Energy: 0.3887550222343184
Energy: 0.4431770130689868
Energy: 0.42304706244038215
Energy: 0.47121523746335964
Energy: 0.41520501163463325
Energy: 0.4408799392242443
Energy: 0.47556251123276644
Energy: 0.4088510170942803
Energy: 0.4094689350037947
Energy: 0.4149639356261038
Energy: 0.4494363662587614
Energy: 0.42461245585806995
Energy: 0.3999899286732428
Energy: 0.4619684203243166
Energy: 0.40334956308666026
Energy: 0.46151768467204113
Energy: 0.409969337205764
Energy: 0.44556367678605263
Energy: 0.450309348014037
Energy: 0.4356452649262383
Energy: 0.4197934924583239
Energy: 0.397286966504819
Energy: 0.41876395472854566
Energy: 0.3840687444746043
Energy: 0.5059786445161623
Energy: 0.4774265100166889
Energy: 0.41567838214537156
Energy: 0.4430055129318628
Energy: 0.3681058102787824
Energy: 0.41202603823910294
Energy: 0.4151393421945275
Energy: 0.4274496475155179
Energy: 0.4275661950078306
Energy: 0.4242046060459709
Energy: 0.4209015799171944
Energy: 0.4099840464900918
Energy: 0.4177521813720455
Energy: 0.3856528244068374
Energy: 0.3991187826765198
Energy: 0.40055141395063576
Energy: 0.38064960432612494
Energy: 0.42220827589758914
Energy: 0.4403142155428506
Energy: 0.4040648170334291
Energy: 0.36393367186471903
Energy: 0.38090023866297296
Energy: 0.38349891831971755
Energy: 0.36455578427453217
Energy: 0.4526791571896309
Energy: 0.37560768783983733
Energy: 0.3843660697315928
Energy: 0.4243479628365638
Energy: 0.4690227043454821
Energy: 0.4422890109948089
Energy: 0.4398174732075141
Energy: 0.40952943382752166
Energy: 0.40365900124626036
Energy: 0.41019410469255657
Energy: 0.38375680712332283
Energy: 0.4774034303568123
Energy: 0.4666326155078986
Energy: 0.37819283198295683
Energy: 0.43585352795680327
Energy: 0.4153570926788832
Energy: 0.43320669271147566
Energy: 0.4082908826303525
Energy: 0.38509644882871236
Energy: 0.4302335092400683
Energy: 0.4162741623121514
Energy: 0.4029987009372673
Energy: 0.38178604184994475
Energy: 0.40739846414426667
Energy: 0.40452806192113205
Energy: 0.41473554973075266
Energy: 0.39030733346428725
Energy: 0.4165862395312904
Energy: 0.4257418819813883
Energy: 0.39929209596488685
Energy: 0.44422998457263696
Energy: 0.4159746884220791
Energy: 0.43912863923905543
Energy: 0.41111868792256756
Energy: 0.4501121343876054
Energy: 0.4690265795108043
Energy: 0.41577726925020914
Energy: 0.4292642833637933
Energy: 0.4413678546583005
Energy: 0.4683990625432257
Energy: 0.4719453783886369
Energy: 0.43213228790797387
Energy: 0.457187684807333
Energy: 0.41143454714300476
Energy: 0.468958972051305
Energy: 0.4430207508846392
Energy: 0.4506574877954798
Energy: 0.48217364675355934
Energy: 0.3772512724784528
Energy: 0.4762480951187316
Energy: 0.4544809303069267
Energy: 0.467063189164603
Energy: 0.4346687525642848
Energy: 0.4652105959190135
Energy: 0.4351655723148493
Energy: 0.483931110632446
Energy: 0.4788611823668506
Energy: 0.4006362157882792
Energy: 0.49421525681737566
Energy: 0.4091321607864838
Energy: 0.4277684699423537
Energy: 0.47886553507586704
Energy: 0.47166571413677705
Energy: 0.5057872733716329
Energy: 0.44935138563802035
Energy: 0.46779534743333423
Energy: 0.4201015925939608
Energy: 0.430270296538326
Energy: 0.4603657212923889
Energy: 0.3987473140186963
Energy: 0.4614327101819495
Energy: 0.35817210991970666
Energy: 0.46016539543956986
Energy: 0.4177716624791214
Energy: 0.4166412776114446
Energy: 0.46297701457985735
Energy: 0.39415559634452874
Energy: 0.5228698785289548
Energy: 0.40785832993957744
Energy: 0.4878031507776006
Energy: 0.40884264235595813
Energy: 0.46082452436571214
Energy: 0.46087057037568946
Energy: 0.4688140286175095
Energy: 0.5072717307929802

minimum gb energy = 0.35817210991970666 eV
minimum distance =  2.56231706334233 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 0.4249918310925685
Energy: 0.4244920294047361
Energy: 0.4191146844123401
Energy: 0.42061352489029963
Energy: 0.4204586866979706
Energy: 0.4148213794283208
Energy: 0.4224078094556062
Energy: 0.42416260966202485
Energy: 0.49955815215200366
Energy: 0.41854944946553935
Energy: 0.4129530196172244
Energy: 0.418839106628552
Energy: 0.4191937699379522
Energy: 0.5000955311409269
Energy: 0.41539274906815254
Energy: 0.5093862673920333
Energy: 0.4163095515325214
Energy: 0.4148490199285046
Energy: 0.41419106958340507
Energy: 0.41599979452310476
Energy: 0.4154940561187677
Energy: 0.41625774967400125
Energy: 0.509830888339709
Energy: 0.41517075169900386
Energy: 0.41932908144794234
Energy: 0.4206476065959233
Energy: 0.41554239751695793
Energy: 0.42105508078318066
Energy: 0.4251255704363347
Energy: 0.49910217138742474
Energy: 0.413609918655251
Energy: 0.5008615150614071
Energy: 0.415325386189837
Energy: 0.41293349348012576
Energy: 0.49845798495521776
Energy: 0.4175586343089149
Energy: 0.5106144821086808
Energy: 0.418635413527844
Energy: 0.4201392868183014
Energy: 0.42034905377514364
Energy: 0.4147101939268161
Energy: 0.4216330540501261
Energy: 0.41579156930170813
Energy: 0.5105429653707488
Energy: 0.4171277565271516
Energy: 0.4142560189933753
Energy: 0.41406302566778846
Energy: 0.4180300980405677
Energy: 0.49923195306290286
Energy: 0.41486761060544247
Energy: 0.5086948050825192
Energy: 0.416554305190443
Energy: 0.4142205989366001
Energy: 0.4141350343607287
Energy: 0.41782978159883366
Energy: 0.5000600792878646
Energy: 0.42130755474848025
Energy: 0.5106145074736574
Energy: 0.4182760639288205
Energy: 0.4205715800794533
Energy: 0.4206936318655621
Energy: 0.41895447826779664
Energy: 0.4226955613430356
Energy: 0.42535589448251876
Energy: 0.49824348233396715
Energy: 0.4133163540219883
Energy: 0.5143669776747716
Energy: 0.5147725075655432
Energy: 0.4126188919640546
Energy: 0.5123788536110616
Energy: 0.41708800078112285
Energy: 0.5098674544218633
Energy: 0.4151235195768538
Energy: 0.42061720360031
Energy: 0.4202979809852923
Energy: 0.41945305028549223
Energy: 0.42118421355427366
Energy: 0.41476112227417555
Energy: 0.509011830774905
Energy: 0.41665873982169055
Energy: 0.41479977435976106
Energy: 0.413943370113467
Energy: 0.4164644769980156
Energy: 0.5003554915950502
Energy: 0.4164433345064958
Energy: 0.49943474431475227
Energy: 0.4177636349148878
Energy: 0.4138633129084903
Energy: 0.41367823731073
Energy: 0.418755854184942
Energy: 0.4995078187363785
Energy: 0.41846909743238764
Energy: 0.5104228088620505
Energy: 0.4202969635594976
Energy: 0.4203924163300312
Energy: 0.42018927061223016
Energy: 0.4148828165617681
Energy: 0.4227764537169672
Energy: 0.42476399250580377
Energy: 0.4997938811588009
Energy: 0.4140525707352667
Energy: 0.41397362849789593
Energy: 0.41498087875713047
Energy: 0.41950270223999386
Energy: 0.49915093413814743
Energy: 0.4159650214571908
Energy: 0.5095008701317784
Energy: 0.41514376108070017
Energy: 0.419847109929457
Energy: 0.4146002712744694
Energy: 0.4153377800220455
Energy: 0.42003831355979987
Energy: 0.4157480242724134
Energy: 0.5096389351124889
Energy: 0.41570645369184644
Energy: 0.4150402173543191
Energy: 0.4146703614123436
Energy: 0.4156984010683881
Energy: 0.4200950894836245
Energy: 0.42452903523311086
Energy: 0.49947395689576285
Energy: 0.41863614788226383
Energy: 0.4140062104329279
Energy: 0.42045437396393526
Energy: 0.4193336554557618
Energy: 0.49915222497329903
Energy: 0.4248070706940176
Energy: 0.5103978726730918
Energy: 0.41898474975956046
Energy: 0.42054343981252024
Energy: 0.42026995465520306
Energy: 0.41558408722456924
Energy: 0.421722986294655
Energy: 0.41679266144525484
Energy: 0.4990977107200568
Energy: 0.4178016163946761
Energy: 0.41343705557058963
Energy: 0.41700012288478644
Energy: 0.4186271717459173
Energy: 0.5000219223516074

minimum gb energy = 0.4126188919640546 eV
minimum distance =  2.59804070590431 Angstroms
sigma value = 23