Model name: model_name=MEAM_LAMMPS_JeongParkDo_2018_PdAl__MO_616482358807_001
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=4.044650763273239
cohesive_energy=3.360264280667934
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=[2.06278639450866e-19, 2.6524835264187e-19, 3.0828281703111e-19, 3.42542159995932e-19, 3.7098079524943198e-19, 3.95159242833126e-19, 4.16019582607806e-19, 4.3418986781399995e-19, 4.50112299202692e-19, 4.641089142773159e-19, 4.76429652592776e-19, 4.872683775217859e-19, 4.959409596416279e-19, 5.040431668797659e-19, 5.1121450949355e-19, 5.17389298240986e-19, 5.22644437600506e-19, 5.2704401463747e-19, 5.3064891206397e-19, 5.335087973556599e-19, 5.356685314582919e-19, 5.371681687877159e-19, 5.38046161583148e-19, 5.38331349024e-19, 5.38023731110272e-19, 5.37030381597192e-19, 5.35229535060576e-19, 5.32472189073462e-19, 5.285869107360119e-19, 5.23362212732538e-19, 5.16548155508136e-19, 5.078355189724439e-19, 4.968542003230079e-19, 4.831459770425039e-19, 4.661420764258619e-19, 4.45142347284024e-19, 4.19262388115022e-19, 3.87383879628324e-19, 3.48079282443036e-19, 2.9950288907678997e-19, 2.3924502587205e-19, 1.6410935044398598e-19, 6.98005874545074e-20, -4.955259958934219e-20, -2.02137012851976e-19, -3.99602078639208e-19, -6.58964034327762e-19, -1.005825662528958e-18, -1.4800314939537417e-18, -2.1462758189064e-18, -3.11512805125254e-18, -4.58810516148678e-18, -6.96430934913852e-18, -1.112867083446498e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01268002668546967
Energy: 0.014747287263533596
Energy: 0.31930581310374745
Energy: 0.5874970627526112
Energy: 0.6936963139151746
Energy: 0.2549625737944064
Energy: 0.013232914319471024
Energy: 0.013064893364854559
Energy: 0.6069545027245354
Energy: 0.28793238061202525
Energy: 0.3193976969273908
Energy: 0.3191559821338678
Energy: 0.013230841770446023
Energy: 0.06688655014101161
Energy: 0.013945571412203683
Energy: 0.4500100794255632
Energy: 0.5869439526506934
Energy: 0.3191903770415558
Energy: 0.31926242423582624
Energy: 0.06595019735325656
Energy: 0.06786137280220637
Energy: 0.014535419928157208
Energy: 0.3200911040121555
Energy: 0.49851486284297425
Energy: 0.5875737675293646
Energy: 0.6097126766565207
Energy: 0.06588071330102609
Energy: 0.013117261980523797
Energy: 0.3295258338971838
Energy: 0.605842477991482
Energy: 0.28785000807698435
Energy: 0.31917074336369394
Energy: 0.3192800174954843
Energy: 0.013315277718057182
Energy: 0.0659291243285618
Energy: 0.012881152687812095
Energy: 0.3192645233438619
Energy: 0.5862316731371048
Energy: 0.5000301520069594
Energy: 0.43311282244843885
Energy: 0.06594150858242612
Energy: 0.06735387961690023

minimum gb energy = 0.01268002668546967 eV
minimum distance =  2.83411513651771 Angstroms
sigma value = 5


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

Energy: 0.6981454347610055
Energy: 0.7182966843266279
Energy: 0.720129556355871
Energy: 0.7147849774171723
Energy: 0.7459547426422114
Energy: 0.7467374708853399
Energy: 0.7212480041330854
Energy: 0.6404670650754903
Energy: 0.6904797834025825
Energy: 0.6862100754756066
Energy: 0.6801156573650784
Energy: 0.7350111917411679
Energy: 0.6774832687826514
Energy: 0.6783442573256983
Energy: 0.7291009146286385
Energy: 0.6916231686770892
Energy: 0.7278552533744317
Energy: 0.6726943518799025
Energy: 0.6933635831834749
Energy: 0.7287875181693044
Energy: 0.6859233324827171
Energy: 0.6290446680157917
Energy: 0.7161507981251952
Energy: 0.6658630401478731
Energy: 0.7230133959568673
Energy: 0.7320298075874451
Energy: 0.6724488276201477
Energy: 0.6966374925903205
Energy: 0.7196704722196138
Energy: 0.7925093277639688
Energy: 0.6955617915022935
Energy: 0.7096272745147544
Energy: 0.7211750378164592
Energy: 0.7358361556763292
Energy: 0.8293959831416243
Energy: 0.6571739674418599
Energy: 0.7562795800965867
Energy: 0.6649514237845203
Energy: 0.7226930489485361
Energy: 0.7389764378293242
Energy: 0.649007717318382
Energy: 0.7387340593491287
Energy: 0.7518779333406223
Energy: 0.6901670555843461
Energy: 0.704970471257242
Energy: 0.6791961190266633
Energy: 0.7116214435127757
Energy: 0.6903012074921002
Energy: 0.7125166579764312
Energy: 0.6656397401892638
Energy: 0.642918435183932
Energy: 0.7102322043260852
Energy: 0.6964415700445885
Energy: 0.727631807039269
Energy: 0.7077191822834047
Energy: 0.6813259732518548
Energy: 0.6968385620853322
Energy: 0.7700084909580577
Energy: 0.7029254431711873
Energy: 0.7039108464953601
Energy: 0.7431750912052583
Energy: 0.6949105577042399
Energy: 0.7562452007114919
Energy: 0.6763596920739762
Energy: 0.7812410733653409
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Energy: 0.7321078167818651
Energy: 0.7084468376561307
Energy: 0.6854208393772996
Energy: 0.7601151281235058
Energy: 0.6718701774073168
Energy: 0.654235669304119
Energy: 0.7245182025515153
Energy: 0.7625401234405256
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Energy: 0.6897435224849892
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Energy: 0.6571566996022817
Energy: 0.7008485992582356
Energy: 0.6600087597945705
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Energy: 0.7167838733709657
Energy: 0.6722646459121048
Energy: 0.7505084850374487
Energy: 0.6609969005640655
Energy: 0.6688967711788777
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Energy: 0.6987722167951912
Energy: 0.702559328285482
Energy: 0.6951203329875566
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Energy: 0.7297434281017828
Energy: 0.6762839193827748
Energy: 0.6717841379280275
Energy: 0.7532198807067012
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Energy: 0.7186641292720746
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Energy: 0.7678463508537829
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Energy: 0.7150771358380387
Energy: 0.6607197413642855
Energy: 0.6880764837372269
Energy: 0.7535496297142705
Energy: 0.671184604201185
Energy: 0.676330483606876
Energy: 0.7096645451761269
Energy: 0.7023458336911315
Energy: 0.6924734296280937
Energy: 0.7052480732964684
Energy: 0.7060104988378456
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Energy: 0.756207822256719
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Energy: 0.6325424379723403
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Energy: 0.7061737897274566
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Energy: 0.7440499412337083
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Energy: 0.7218430772730665
Energy: 0.760506126391783
Energy: 0.6382635291641076
Energy: 0.7598019655173983
Energy: 0.666606772983781
Energy: 0.6990622158754137
Energy: 0.7008657110349001
Energy: 0.6526296321197448
Energy: 0.7602295497408725
Energy: 0.6818424499641444
Energy: 0.7003550238672281
Energy: 0.7295883780046263
Energy: 0.6957044666522172
Energy: 0.7147027317036875
Energy: 0.729873890089801
Energy: 0.6906435409641897
Energy: 0.71636622887598
Energy: 0.692722670513158
Energy: 0.6767483836168542
Energy: 0.7217772949152045
Energy: 0.7268149544891096
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Energy: 0.6982689369154103
Energy: 0.6586834853572006
Energy: 0.7564094820892185
Energy: 0.6903745136895121
Energy: 0.7166077223309654
Energy: 0.7439220713618886
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Energy: 0.6955495295191044
Energy: 0.6577560935603037
Energy: 0.7572683414281641
Energy: 0.6897185839583486
Energy: 0.691703722065916
Energy: 0.7419659183460916
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Energy: 0.6752396873064178
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Energy: 0.7271824657644042
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Energy: 0.7175088368358222
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Energy: 0.7092044530044059
Energy: 0.7033813256887286
Energy: 0.719668809925276
Energy: 0.6746129724040568
Energy: 0.6760281819099662
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Energy: 0.6477136692510318
Energy: 0.744812065313655
Energy: 0.7184516869837027
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Energy: 0.7109870025279665
Energy: 0.7176310872007321
Energy: 0.7051810093543374
Energy: 0.7162250067543798
Energy: 0.7322162610434746
Energy: 0.671974214399251
Energy: 0.6571432110217135
Energy: 0.6771579066739195
Energy: 0.703238125111846
Energy: 0.6895504925726137
Energy: 0.7029883693471576
Energy: 0.6515164432711087
Energy: 0.740228314363173
Energy: 0.7060741979062355
Energy: 0.6835002669296422
Energy: 0.6471546591926686
Energy: 0.7180461876258813
Energy: 0.7327516074061494
Energy: 0.7147867046373215
Energy: 0.6637627692215909
Energy: 0.770089024044596
Energy: 0.6421183656515909
Energy: 0.7165063298957152
Energy: 0.7215714910917179
Energy: 0.638476059331918
Energy: 0.720205725243749
Energy: 0.7314827100906642
Energy: 0.7609673087941996
Energy: 0.701468982211034
Energy: 0.702312316719166
Energy: 0.692255671450188
Energy: 0.7153938467147792
Energy: 0.6905840749074383
Energy: 0.6300748133661492
Energy: 0.7666639260886631
Energy: 0.6588593236921038
Energy: 0.7195169644811256
Energy: 0.7530743262490189
Energy: 0.6542354253093884
Energy: 0.7212628711691668
Energy: 0.7009165076273972
Energy: 0.6718715027388077
Energy: 0.7070124609770295
Energy: 0.6606689240069817
Energy: 0.6822569718094358
Energy: 0.7308001320660988
Energy: 0.6418907020340963
Energy: 0.6350724445863811
Energy: 0.7070132587888787
Energy: 0.6469654139621527
Energy: 0.7772473591092525
Energy: 0.7026898193078358
Energy: 0.678268599627872
Energy: 0.7144208320129362
Energy: 0.6712938206566609
Energy: 0.7542525981998095
Energy: 0.7266701325501962
Energy: 0.703536580776438
Energy: 0.7346923962507962
Energy: 0.6773827407819096
Energy: 0.7588588363636555

minimum gb energy = 0.6290446680157917 eV
minimum distance =  2.53268711162874 Angstroms
sigma value = 401


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

Energy: 0.6800792463097032
Energy: 0.6690026570767047
Energy: 0.7317609525781836
Energy: 0.802748571607284
Energy: 0.7854165624869134
Energy: 0.7356899864867182
Energy: 0.6673376767275591
Energy: 0.6521173517660116
Energy: 0.6337764864903472
Energy: 0.6412716855853183
Energy: 0.7164067363259347
Energy: 0.7111065219899695
Energy: 0.7078681362859901
Energy: 0.6542606230542933
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Energy: 0.7502532768858046
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Energy: 0.7058341914678045
Energy: 0.6619057815823458
Energy: 0.6904786926217167
Energy: 0.689414604618539
Energy: 0.7007116079120568
Energy: 0.6733165530426088
Energy: 0.6575809995264633
Energy: 0.7342881884164951
Energy: 0.7169613146367765
Energy: 0.6661014081446655
Energy: 0.6846326103665314
Energy: 0.7010791729086667
Energy: 0.7585115767111704
Energy: 0.7487403647106978
Energy: 0.7135271569597913
Energy: 0.7411102205987647
Energy: 0.6368916981892048
Energy: 0.6379859064606503
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Energy: 0.6292658655525228
Energy: 0.6697532552846867
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Energy: 0.7172854099444468
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Energy: 0.6529528559559604
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Energy: 0.7151267243000672
Energy: 0.6409864807254807
Energy: 0.6339351277966798
Energy: 0.6364684725689174
Energy: 0.770067372950737
Energy: 0.7674801879365734
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Energy: 0.7136657083554899
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Energy: 0.6945853415765659
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Energy: 0.7113546900056704
Energy: 0.713943916928908
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Energy: 0.6951294025111022
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Energy: 0.686271493302993
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Energy: 0.654841622990407
Energy: 0.6694820120216061
Energy: 0.7014393599611628
Energy: 0.7607595409330707
Energy: 0.7442530091746757
Energy: 0.7572419775067738
Energy: 0.6356545962995196
Energy: 0.6950200906385634
Energy: 0.6913548124169648
Energy: 0.6620017033244093
Energy: 0.6742245503538806
Energy: 0.6813079973155479
Energy: 0.7521531469516259
Energy: 0.6658907036394388
Energy: 0.710603888707817
Energy: 0.6520182480132909
Energy: 0.6476920766435568
Energy: 0.7323648506168327
Energy: 0.6978512123061434
Energy: 0.650071817633424
Energy: 0.677792244870912
Energy: 0.6791427641882919
Energy: 0.6535586721120626
Energy: 0.709021485534267
Energy: 0.753874436331067
Energy: 0.6503054462234288
Energy: 0.6769975072042878
Energy: 0.692381651906307
Energy: 0.7533100956262763
Energy: 0.8221458784951764
Energy: 0.6943290166512707
Energy: 0.6924658912839899
Energy: 0.6672259970283865
Energy: 0.634068751425004
Energy: 0.6374065433147221
Energy: 0.6709529261543333
Energy: 0.6627159241672578
Energy: 0.6464493731690868
Energy: 0.7096000973528634
Energy: 0.6394510237791928
Energy: 0.6380911967233296
Energy: 0.6504181411671204
Energy: 0.767365930405143
Energy: 0.7686023705109609
Energy: 0.7324986756181047
Energy: 0.7127965089209368
Energy: 0.6393246016355562
Energy: 0.64770483602318
Energy: 0.6650579691954032
Energy: 0.6518882949947608
Energy: 0.6968913834819291
Energy: 0.7069502951408392
Energy: 0.6579838358997836
Energy: 0.6469021287060578
Energy: 0.7056498372889491
Energy: 0.684178457732392
Energy: 0.6923944195788725
Energy: 0.6779308403813158
Energy: 0.6504501266945689
Energy: 0.7243090184029762
Energy: 0.6572036657309376
Energy: 0.6293022173479652
Energy: 0.661446139579587
Energy: 0.6501538440194968
Energy: 0.6550811926030198
Energy: 0.670152872537554
Energy: 0.6461778837540139
Energy: 0.7228633663218541
Energy: 0.7331756544753304
Energy: 0.6559103095676437
Energy: 0.6782695415192893
Energy: 0.6775944096962969
Energy: 0.7021513849869324
Energy: 0.7602095671442255
Energy: 0.7147499841429247
Energy: 0.6913552352910632
Energy: 0.6964410313036962
Energy: 0.6473198533568046
Energy: 0.664625087307087
Energy: 0.6477875036778822
Energy: 0.6437562917354012
Energy: 0.6631227870349992
Energy: 0.748532864878794
Energy: 0.6918843435613939
Energy: 0.6885949047781889
Energy: 0.6586974933394417
Energy: 0.645577057881941
Energy: 0.7330027257599241
Energy: 0.7267651951912776
Energy: 0.654902387575331
Energy: 0.6679011003142998
Energy: 0.6495746452089839
Energy: 0.7414442125287946
Energy: 0.7082773394325331
Energy: 0.7706410790521763
Energy: 0.6473321562195621
Energy: 0.6826090241857405
Energy: 0.6716981351210995
Energy: 0.7514122019470092
Energy: 0.6723855323431495
Energy: 0.6899410293224167
Energy: 0.6913979517700912
Energy: 0.647373298757784
Energy: 0.6506219035509422
Energy: 0.6343438003806914
Energy: 0.6698061152610028
Energy: 0.6523315815443322
Energy: 0.6438673323242144
Energy: 0.6341504172842459
Energy: 0.6577142984930371

minimum gb energy = 0.624849380723413 eV
minimum distance =  2.50389119528898 Angstroms
sigma value = 311


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

Energy: 0.7240394888938124
Energy: 0.6845407126596786
Energy: 0.6993764783875559
Energy: 0.6591168149431631
Energy: 0.688570516018087
Energy: 0.711643555260947
Energy: 0.7140976835161507
Energy: 0.6743562890277675
Energy: 0.6801332762110512
Energy: 0.6448317484745807
Energy: 0.6351141216150548
Energy: 0.6659208284986147
Energy: 0.6451808585040804
Energy: 0.7260694693145726
Energy: 0.6884675259062284
Energy: 0.6626607678121721
Energy: 0.6632831132439884
Energy: 0.6445545279552432
Energy: 0.6712899317410166
Energy: 0.6984801766516963
Energy: 0.6911641021046456
Energy: 0.6935247135837503
Energy: 0.6809329393377774
Energy: 0.683464764844047
Energy: 0.7226618753287227
Energy: 0.750154587210643
Energy: 0.689940705322301
Energy: 0.7096442462686956
Energy: 0.7192742311050403
Energy: 0.7309500634884583
Energy: 0.698671578445798
Energy: 0.7030975523121525
Energy: 0.6914418447301276
Energy: 0.647553737290914
Energy: 0.6913585709918235
Energy: 0.6433777141171311
Energy: 0.6753193863799877
Energy: 0.6406742521416987
Energy: 0.6885532710421906
Energy: 0.6688015211013784
Energy: 0.6388369836884757
Energy: 0.6701233674524225
Energy: 0.7067503074893381
Energy: 0.7099309446167067
Energy: 0.7071069612776001
Energy: 0.6669614844655893
Energy: 0.6776115413306999
Energy: 0.7082496141094465
Energy: 0.6852294488531698
Energy: 0.6423110371814422
Energy: 0.6665226354007908
Energy: 0.6930859757790244
Energy: 0.7409128074535167
Energy: 0.637246281470677
Energy: 0.638040591275811
Energy: 0.6962777862995528
Energy: 0.6806725445236509
Energy: 0.6742869555625416
Energy: 0.67783672400508
Energy: 0.6701548071793783
Energy: 0.690542279979458
Energy: 0.6443740696428499
Energy: 0.6984244675381374
Energy: 0.655468849108015
Energy: 0.6991780079858724
Energy: 0.640448676605625
Energy: 0.6893727057955455
Energy: 0.7428404688870403
Energy: 0.7130291835994584
Energy: 0.6826875187608302
Energy: 0.6749565443040987
Energy: 0.7146897554243905
Energy: 0.6841796286338648
Energy: 0.7149181155997633
Energy: 0.645488301122379
Energy: 0.7177250327914696
Energy: 0.7191701806976425
Energy: 0.6451170783563671
Energy: 0.6850204564559716
Energy: 0.6368548341428437
Energy: 0.6909073289781609
Energy: 0.6669374450828183
Energy: 0.6393256332304083
Energy: 0.6874292720028011
Energy: 0.7061422583249137
Energy: 0.7145197988166136
Energy: 0.704785298480567
Energy: 0.710270572458197
Energy: 0.6513429147858396
Energy: 0.709999382794255
Energy: 0.6915482753125082
Energy: 0.641644602211947
Energy: 0.7315088775908591
Energy: 0.6869154698748139
Energy: 0.6670749190023773
Energy: 0.6862219275316046
Energy: 0.6404541500759617
Energy: 0.7485486978877154
Energy: 0.6692625031546907
Energy: 0.6892820214948934
Energy: 0.7004726185083697
Energy: 0.6764632298007086
Energy: 0.6863115874104436
Energy: 0.6796684696389921
Energy: 0.6690074723339547
Energy: 0.6636735321177757
Energy: 0.7276179976301997
Energy: 0.6575706768033697
Energy: 0.6924607991355118
Energy: 0.69601522735194
Energy: 0.6751586463465276
Energy: 0.6798493032709231
Energy: 0.6874610169354067
Energy: 0.7437350085070811
Energy: 0.7088336282349466
Energy: 0.7190485021398536
Energy: 0.7208402930015968
Energy: 0.749254121454529
Energy: 0.6765395105483362
Energy: 0.6404503619507251
Energy: 0.7053658930325525
Energy: 0.6831139100360046
Energy: 0.676112028451179
Energy: 0.6688409164144486
Energy: 0.6545263949767486
Energy: 0.6838411456517497
Energy: 0.7015090079672887
Energy: 0.6836041240807819
Energy: 0.7019660509975078
Energy: 0.6416568172121301
Energy: 0.6834729636041195
Energy: 0.7032464674604767
Energy: 0.6693198988894739
Energy: 0.6517368443196767
Energy: 0.7244409162827198
Energy: 0.7054412078163523
Energy: 0.7133067902447002
Energy: 0.6927844435831304
Energy: 0.7381763658720821
Energy: 0.6463900525124756
Energy: 0.6971128590324658
Energy: 0.6862748189944864
Energy: 0.6744651141195802
Energy: 0.6458784499472657
Energy: 0.6890084631976547
Energy: 0.6966837765302928
Energy: 0.6949285127636667
Energy: 0.6470719216662053
Energy: 0.7034753179376508
Energy: 0.6719897737889697
Energy: 0.704907080881269
Energy: 0.6754136231848397
Energy: 0.6744531977977765
Energy: 0.6708882257601563
Energy: 0.7282151482047285
Energy: 0.7534575618739964
Energy: 0.7482131601446872
Energy: 0.7050039184408743
Energy: 0.7214060839463821
Energy: 0.7347633754997421
Energy: 0.7220139046714205
Energy: 0.6705498272257094
Energy: 0.7207267103120264
Energy: 0.6427518544329547
Energy: 0.6795041107402056
Energy: 0.7048862271932543
Energy: 0.6839759633738283
Energy: 0.6904781658622816
Energy: 0.6962233699368183
Energy: 0.6934754012422301
Energy: 0.7035898391007389
Energy: 0.6720750570628687
Energy: 0.6984464862475354
Energy: 0.7270871007385228
Energy: 0.6771356827003275
Energy: 0.6969436448605384
Energy: 0.7066584461219336
Energy: 0.6607897338965639
Energy: 0.753854192885953
Energy: 0.6645749635232502
Energy: 0.6583819966049338
Energy: 0.6803511065287031
Energy: 0.6765478004682255
Energy: 0.6818425506364815
Energy: 0.6792320383759243
Energy: 0.6564855579235416
Energy: 0.6747827051534852
Energy: 0.6970313984166839
Energy: 0.6853035486154929
Energy: 0.662166155393726
Energy: 0.6987384705518478
Energy: 0.6967667043637596
Energy: 0.6654211656542994
Energy: 0.6976448831511648
Energy: 0.6825689590261165
Energy: 0.6923792591121272
Energy: 0.6854934174242846
Energy: 0.7268178429128833
Energy: 0.7189106438535846
Energy: 0.7162108699959226
Energy: 0.6987636549823075
Energy: 0.7190702593121047
Energy: 0.7130446686658731
Energy: 0.6760186678885141
Energy: 0.7210463337536125
Energy: 0.7079314480313444
Energy: 0.7219733983628592
Energy: 0.6813210451410934
Energy: 0.7100000833053652
Energy: 0.718203817748842
Energy: 0.7021625260045795
Energy: 0.6753286862750324
Energy: 0.6452332998740284
Energy: 0.6639246587156584
Energy: 0.667109018724528
Energy: 0.6653927980562345
Energy: 0.6710732912991343
Energy: 0.6665995267529519
Energy: 0.6850981638554128
Energy: 0.6896096074072177
Energy: 0.7242783851666984
Energy: 0.6931378527556696
Energy: 0.6608282065495612
Energy: 0.6995453346451751
Energy: 0.6844192893698383
Energy: 0.6689616004953609
Energy: 0.6817481950713039
Energy: 0.7091312662494246
Energy: 0.6403866787627281
Energy: 0.6911642259463792
Energy: 0.6759989130207408
Energy: 0.6611821112062795
Energy: 0.6767069937714683
Energy: 0.6562342870626512
Energy: 0.681021829605623
Energy: 0.6902039890123861
Energy: 0.6434075367034199
Energy: 0.6730825354104533
Energy: 0.7312619137383299
Energy: 0.7216827238056858
Energy: 0.7069723058701624
Energy: 0.7123821615993656
Energy: 0.7456810412433275
Energy: 0.7435456241279579
Energy: 0.698185585469064
Energy: 0.7297885779248772
Energy: 0.6987767700033068
Energy: 0.7031447847713895
Energy: 0.6899449271721888
Energy: 0.7118845797898953
Energy: 0.7160661077658859
Energy: 0.7037291192768302

minimum gb energy = 0.6351141216150548 eV
minimum distance =  2.55287618382024 Angstroms
sigma value = 39


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

Energy: 0.6262444024360314
Energy: 0.6539577164314292
Energy: 0.7537005408097581
Energy: 0.7624248819436726
Energy: 0.6930727219305538
Energy: 0.7661216342236312
Energy: 0.6235231289050214
Energy: 0.6223940811464511
Energy: 0.6713916763783414
Energy: 0.6923041646420391
Energy: 0.6401691899942445
Energy: 0.6403121181299584
Energy: 0.6649561731803455
Energy: 0.6771479399015283
Energy: 0.6648585127859201
Energy: 0.6326313539123503
Energy: 0.682535452742647
Energy: 0.6394328434815326
Energy: 0.6409261696344356
Energy: 0.6598931502621319
Energy: 0.6767213974165416
Energy: 0.6470091302401517
Energy: 0.6478061447547198
Energy: 0.6773215115583163
Energy: 0.6815189882087548
Energy: 0.6389022581126225
Energy: 0.6782888134399322
Energy: 0.6732094756011144
Energy: 0.659124389567106
Energy: 0.6321549832883835
Energy: 0.6703806744856866
Energy: 0.6673455060434721
Energy: 0.6462312086294517
Energy: 0.6811804692613723
Energy: 0.654114861673299
Energy: 0.6216691331452879
Energy: 0.6337639348467706
Energy: 0.6896121456279467
Energy: 0.7539896797004011
Energy: 0.7003318457748235
Energy: 0.6562881407308386
Energy: 0.6746517296967056
Energy: 0.764373023839558
Energy: 0.6316312793498404
Energy: 0.7332075091649559
Energy: 0.7084638475781302
Energy: 0.6217284179950302
Energy: 0.6244694338447035
Energy: 0.6743288224911499
Energy: 0.6231342340930144
Energy: 0.673700751888687
Energy: 0.7450470902900073
Energy: 0.7273040370059605
Energy: 0.6919067730990575
Energy: 0.6800902472963875
Energy: 0.6746791786982459
Energy: 0.6235033510033917
Energy: 0.6730653219722187
Energy: 0.7368342056295487
Energy: 0.6550231491512479
Energy: 0.6395265004461744
Energy: 0.6893576744719135
Energy: 0.6747540204645959
Energy: 0.7661450301581179
Energy: 0.6333367351418022
Energy: 0.6770833709147733
Energy: 0.638949576094497
Energy: 0.6440388506866122
Energy: 0.6523807623859721
Energy: 0.6728227045749823
Energy: 0.6459670245499044
Energy: 0.6326223032079535
Energy: 0.6763123293596256
Energy: 0.681155473420211
Energy: 0.6392698483416799
Energy: 0.6563033376581524
Energy: 0.6752796155062424
Energy: 0.6591599558357256
Energy: 0.6326096982146048
Energy: 0.6644965814734493
Energy: 0.632254644602417
Energy: 0.6393393456661932
Energy: 0.6922681288637434
Energy: 0.6737680306058234
Energy: 0.6227149623425358
Energy: 0.6322821405549593
Energy: 0.6833553239623443
Energy: 0.6918492267807241
Energy: 0.6765984580259775
Energy: 0.6797236895164979
Energy: 0.6616033296650221
Energy: 0.7638876226699906
Energy: 0.6529370955436188
Energy: 0.7369766206227844
Energy: 0.7080749859515217
Energy: 0.6225810092125306
Energy: 0.6220638899659217
Energy: 0.6739765177735422
Energy: 0.6221452134228802
Energy: 0.6738343065048968
Energy: 0.7457179825193956
Energy: 0.7077626188116687
Energy: 0.6220610154509784
Energy: 0.6214608939734563
Energy: 0.6748431321647486
Energy: 0.6222233135471615
Energy: 0.6973346481187772
Energy: 0.736055190455279
Energy: 0.6473435085871359
Energy: 0.6387649917439738
Energy: 0.6883444612294921
Energy: 0.6232079303004036
Energy: 0.6510913883030423
Energy: 0.6715024477291542
Energy: 0.6919392109805451
Energy: 0.6401679052982623
Energy: 0.6399141909766831
Energy: 0.6648375965840742
Energy: 0.6775330709377012
Energy: 0.6677681745613456
Energy: 0.6325122726035369
Energy: 0.6823979631264607
Energy: 0.6396119463526844
Energy: 0.6410709768356262
Energy: 0.6599001997272608
Energy: 0.6767957703744187
Energy: 0.646645849227744
Energy: 0.6318307146710399
Energy: 0.6791275162284603
Energy: 0.6819923223116058
Energy: 0.6389061848448117
Energy: 0.6782093789091757
Energy: 0.6759923398824403
Energy: 0.6593414807654008
Energy: 0.6321432987351623
Energy: 0.6708782632575363
Energy: 0.6676759466535981
Energy: 0.7442411149087681
Energy: 0.6886042561119875
Energy: 0.6543540903473755
Energy: 0.6217120092562284
Energy: 0.6318775495744546
Energy: 0.6895600168062367
Energy: 0.7537817810773136
Energy: 0.6988945200477094
Energy: 0.621649094638275
Energy: 0.6740488675119861
Energy: 0.7638865864980574
Energy: 0.6318021542865631
Energy: 0.7332332500312041
Energy: 0.7084596437974832
Energy: 0.6245557227393184
Energy: 0.624400611560707
Energy: 0.6739816829280685
Energy: 0.6227059755932951
Energy: 0.6728875191777874
Energy: 0.7448805947172035
Energy: 0.7273964213472263
Energy: 0.692244922202503
Energy: 0.6799906410217101
Energy: 0.6742315477036991
Energy: 0.6238049983993079
Energy: 0.6731151096851979
Energy: 0.7376110143450194
Energy: 0.6549975649853309
Energy: 0.6390972993855921
Energy: 0.6896725736292894
Energy: 0.6744266050010901
Energy: 0.7658634493625999
Energy: 0.6319788166299563
Energy: 0.6767468077109792
Energy: 0.6387518658424417
Energy: 0.6437754412265594
Energy: 0.6522663905303919
Energy: 0.6734153485706068
Energy: 0.6467995862195898
Energy: 0.6328819292721553
Energy: 0.67602638337802
Energy: 0.6813693098496757
Energy: 0.6395339848464029
Energy: 0.6765652731318643
Energy: 0.6748769786402062
Energy: 0.6595349661890618
Energy: 0.63324176435456
Energy: 0.6631451154068766
Energy: 0.6324148372459598
Energy: 0.6391399002319567
Energy: 0.6922827494150708
Energy: 0.6741388247442575
Energy: 0.6229739921980403
Energy: 0.6319910709838581
Energy: 0.6961150679744419
Energy: 0.6907354929816621
Energy: 0.6765650279472156
Energy: 0.6807285032874917
Energy: 0.6622647648032037
Energy: 0.7638120529454512
Energy: 0.6540532260128823
Energy: 0.7369731012094793
Energy: 0.7078920797361837
Energy: 0.6226061282123702
Energy: 0.622193927326108
Energy: 0.6754352042579723
Energy: 0.6220743261277064
Energy: 0.6738423127766858
Energy: 0.7465629267022056
Energy: 0.7233848456705668
Energy: 0.6224438439724685
Energy: 0.6214705422507819
Energy: 0.6753813550246378

minimum gb energy = 0.6214608939734563 eV
minimum distance =  2.53644839076697 Angstroms
sigma value = 21


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

Energy: 0.7827206807689975
Energy: 0.7319374380416623
Energy: 0.7619225859441056
Energy: 0.696730511284205
Energy: 0.6969201534779846
Energy: 0.7758355449744884
Energy: 0.7342957139561856
Energy: 0.6979113339615173
Energy: 0.6882185008838588
Energy: 0.7649947334593753
Energy: 0.7438608013791995
Energy: 0.7766134791684325
Energy: 0.7481206659572572
Energy: 0.7263261240136344
Energy: 0.7450965572400758
Energy: 0.6428417468453109
Energy: 0.6567013053407811
Energy: 0.7627083765363489
Energy: 0.7525991612444219
Energy: 0.7292506146426758
Energy: 0.7139478846626428
Energy: 0.6494263208878643
Energy: 0.7012565471171487
Energy: 0.6894156126577063
Energy: 0.6746354943779582
Energy: 0.6624585369076873
Energy: 0.6642620527598607
Energy: 0.7017572135361325
Energy: 0.6500653929914622
Energy: 0.68548456554865
Energy: 0.6457664610940493
Energy: 0.6245760165709008
Energy: 0.6794378014633076
Energy: 0.6541036553554
Energy: 0.6455137871852507
Energy: 0.6277920580319228
Energy: 0.6301983215044732
Energy: 0.6835606208439653
Energy: 0.6875214182999798
Energy: 0.7156395844872866
Energy: 0.671585260124833
Energy: 0.6387569008872847
Energy: 0.7785573914416004
Energy: 0.6311441233601333
Energy: 0.6756949576487884
Energy: 0.6728118544087142
Energy: 0.6445956859147471
Energy: 0.6285332977926703
Energy: 0.6338352303035882
Energy: 0.6814264851277381
Energy: 0.6238856083763928
Energy: 0.6554267122556235
Energy: 0.6960942688541678
Energy: 0.6432019650435608
Energy: 0.6501347262398866
Energy: 0.6496117216560521
Energy: 0.665188697795339
Energy: 0.6952081697033805
Energy: 0.7328937903563031
Energy: 0.7634952653465924
Energy: 0.8010391513320555
Energy: 0.7977410498301274
Energy: 0.7474194933666658
Energy: 0.7523891431647483
Energy: 0.7085023049218182
Energy: 0.6604801618671595
Energy: 0.706979560955528
Energy: 0.6525235136350642
Energy: 0.7451594718470821
Energy: 0.7453134824291249
Energy: 0.707351009165522
Energy: 0.6842458633999517
Energy: 0.6731003579393023
Energy: 0.654822814392822
Energy: 0.6672995354340995
Energy: 0.6329828413891824
Energy: 0.7567576802231206
Energy: 0.720160029133271
Energy: 0.6587128945927078
Energy: 0.729500121980065
Energy: 0.8157908014298169
Energy: 0.7356998301618117
Energy: 0.7310703066105805
Energy: 0.7227480538719717
Energy: 0.7499793276753416
Energy: 0.6818160545163466
Energy: 0.7749722691579202
Energy: 0.7047181300628649
Energy: 0.6888225738377598
Energy: 0.665268740265164
Energy: 0.6971963624061509
Energy: 0.7039417024598515
Energy: 0.6572185372749195
Energy: 0.711346286112281
Energy: 0.6375769361317967
Energy: 0.6900724658312862
Energy: 0.7152002551081792
Energy: 0.722597756987938
Energy: 0.753544032371231
Energy: 0.6425455974544103
Energy: 0.6609152699743978
Energy: 0.7532631066466177
Energy: 0.7600276442539348
Energy: 0.7420294184315684
Energy: 0.7132044609691766
Energy: 0.71333696970329
Energy: 0.642532051083054
Energy: 0.6838232075088535
Energy: 0.6930557015217067
Energy: 0.6588120464114471
Energy: 0.6597773139281544
Energy: 0.7934144400308981
Energy: 0.7270480950895621
Energy: 0.7056906232961658
Energy: 0.6807923201703134
Energy: 0.6540709974570446
Energy: 0.6376049514077154
Energy: 0.688516180557682
Energy: 0.6387885567830126
Energy: 0.627780666743325
Energy: 0.6436596038357645
Energy: 0.6437501255107532
Energy: 0.6946146606788481
Energy: 0.6327056336324026
Energy: 0.674349474598879
Energy: 0.6697861089466683
Energy: 0.6316074857712369
Energy: 0.6318368779953816
Energy: 0.699868164748653
Energy: 0.6628383001830138
Energy: 0.6403540323167844
Energy: 0.6286944861920897
Energy: 0.6414646503801772
Energy: 0.7527082750694759
Energy: 0.6243451811060273
Energy: 0.699007036706529
Energy: 0.6324437739185061
Energy: 0.7004087314968777
Energy: 0.6515317014931259
Energy: 0.6537786299795638
Energy: 0.6765969597419884
Energy: 0.6433767735875514
Energy: 0.7621047013204653
Energy: 0.7462310337427889
Energy: 0.7560406541011017
Energy: 0.6911421968610226
Energy: 0.6727971376715147
Energy: 0.6331368696228816
Energy: 0.7453886860405168
Energy: 0.6596518431051878
Energy: 0.6544637789716998
Energy: 0.7233325017700221
Energy: 0.7786481026023228
Energy: 0.7024201044963406
Energy: 0.7548909931080722
Energy: 0.6589972808872611
Energy: 0.7887551067443883
Energy: 0.7312560724060552
Energy: 0.6766029666435207
Energy: 0.7455772351749945
Energy: 0.7514369716384
Energy: 0.7449290448582315
Energy: 0.644118063320673
Energy: 0.765989955789804
Energy: 0.8158386310426361
Energy: 0.7306105075296384
Energy: 0.7316779724812683
Energy: 0.7519089454897738
Energy: 0.7050002442421045
Energy: 0.6756490958959221
Energy: 0.7710600074043401
Energy: 0.6374791306667783
Energy: 0.676421959792151
Energy: 0.6839233973643167
Energy: 0.7226441032901779

minimum gb energy = 0.6238856083763928 eV
minimum distance =  2.50090424073039 Angstroms
sigma value = 113


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

Energy: 0.7556043716755966
Energy: 0.7797029308058867
Energy: 0.805447231224874
Energy: 0.831426200349901
Energy: 0.7887986214840016
Energy: 0.7940989267140851
Energy: 0.8356935004262546
Energy: 0.8294636848863558
Energy: 0.7977807550352722
Energy: 0.7644568473910865
Energy: 0.8226207129654476
Energy: 0.7777262377236616
Energy: 0.7753292951350872
Energy: 0.8058445408671773
Energy: 0.836238656684451
Energy: 0.767576987053268
Energy: 0.7660460446571724
Energy: 0.7801512075113658
Energy: 0.8028973794749369
Energy: 0.7810400991530703
Energy: 0.7916775681649267
Energy: 0.7489215031058347
Energy: 0.7978878074355366
Energy: 0.7746303716081453
Energy: 0.805913212217816
Energy: 0.794702403487575
Energy: 0.7614656681631699
Energy: 0.8009739144265069
Energy: 0.734999196918362
Energy: 0.7866584968380664
Energy: 0.7692269256872155
Energy: 0.8088448258577421
Energy: 0.8106349856132093
Energy: 0.7527282440084054
Energy: 0.7731505884246266
Energy: 0.7142287714682828
Energy: 0.7522932715807732
Energy: 0.7667622331024054
Energy: 0.7342929203176455
Energy: 0.7194796765787911
Energy: 0.7151370887556497
Energy: 0.7633211320694583
Energy: 0.7712355492873969
Energy: 0.7834450533365354
Energy: 0.7751522392682941
Energy: 0.7619252018392403
Energy: 0.7748955416833315
Energy: 0.7605674721959763
Energy: 0.7920791911125129
Energy: 0.798403000776462
Energy: 0.6933964873072367
Energy: 0.7775650007502783
Energy: 0.7790068661053408
Energy: 0.7776033934212171
Energy: 0.7384732216620451
Energy: 0.7069106751500552
Energy: 0.6714642888570613
Energy: 0.7218646374914743
Energy: 0.7799017174550354
Energy: 0.7285194170477701
Energy: 0.7343089231287724
Energy: 0.7640628750431152
Energy: 0.7270976037965702
Energy: 0.7555784876804488
Energy: 0.7319655143167114
Energy: 0.7425963066741961
Energy: 0.7118164468201158
Energy: 0.798383460814226
Energy: 0.7528038991770853
Energy: 0.7260537365994343
Energy: 0.7582433050650687
Energy: 0.7230520235934592
Energy: 0.7656402789050909
Energy: 0.7171460244615186
Energy: 0.720323751634173
Energy: 0.7421004200230717
Energy: 0.71177853704367
Energy: 0.7063068899392589
Energy: 0.76367601435154
Energy: 0.7773413051551523
Energy: 0.7669615265079153
Energy: 0.7629977974428934
Energy: 0.7763746111063068
Energy: 0.7628531609538539
Energy: 0.722069335473089
Energy: 0.6892236869542432
Energy: 0.7203995764090918
Energy: 0.7574532411668304
Energy: 0.7577697758723522
Energy: 0.7382550945620124
Energy: 0.6992235901147692
Energy: 0.748144959223734
Energy: 0.7322309305035973
Energy: 0.7605173998237996
Energy: 0.7414244733692074
Energy: 0.6770007196281715
Energy: 0.7274105322340119
Energy: 0.7374110739670235
Energy: 0.6914214168185555
Energy: 0.7513615885082661
Energy: 0.7549637470518379
Energy: 0.7053215409511302
Energy: 0.7342052742394756
Energy: 0.740051653945208
Energy: 0.7527252713505864
Energy: 0.7442960479082621
Energy: 0.7459947810262776
Energy: 0.773904991650775
Energy: 0.7529595385329281
Energy: 0.7752871008283778
Energy: 0.7796834816020173
Energy: 0.7477285307181153
Energy: 0.7505864008418431
Energy: 0.8492644364014917
Energy: 0.7486029178085134
Energy: 0.78988544807607
Energy: 0.7733168509733718
Energy: 0.7782818838261278
Energy: 0.7701612661424982
Energy: 0.7578688162477947
Energy: 0.7752774516912511
Energy: 0.7500965457267492
Energy: 0.7525593123519301
Energy: 0.7421658536546365
Energy: 0.7825410919002527
Energy: 0.7647800018872286
Energy: 0.7555666305943588
Energy: 0.8070181319250439
Energy: 0.76871913916358
Energy: 0.843008832073485
Energy: 0.8113454710252128
Energy: 0.7764607372248278
Energy: 0.805321536823763
Energy: 0.7338619084372918
Energy: 0.777834926141476
Energy: 0.7793225859580108
Energy: 0.8078654815350967
Energy: 0.7949452985772599
Energy: 0.8029825809701548
Energy: 0.7925319440904467
Energy: 0.8274101541218567
Energy: 0.7754765657169251
Energy: 0.7580295238629898
Energy: 0.8271567360917826
Energy: 0.7947861958609735
Energy: 0.7491444006095977
Energy: 0.7570212685074394
Energy: 0.8153590268921063
Energy: 0.760807063288586
Energy: 0.7644694379444735
Energy: 0.8123918037180863
Energy: 0.7981635227574253
Energy: 0.7426989665819326
Energy: 0.7936575166145811
Energy: 0.734122163615479
Energy: 0.7874160452378732
Energy: 0.8018721920140083
Energy: 0.8064138939862997
Energy: 0.8037205934923026
Energy: 0.799809111860935
Energy: 0.7872599933591018
Energy: 0.8097694768371132
Energy: 0.8158510257355824
Energy: 0.7614687277354447
Energy: 0.8245297779410629
Energy: 0.8181296127649592
Energy: 0.7795443262910611
Energy: 0.7958304055739883
Energy: 0.7734876085188718
Energy: 0.7756385571959622
Energy: 0.7652308154277504
Energy: 0.7799357160681601
Energy: 0.7786070556456336
Energy: 0.7895316313477292
Energy: 0.7601187424406366
Energy: 0.7406013475925931
Energy: 0.8243658362393709
Energy: 0.7610921477173546
Energy: 0.787125676191056
Energy: 0.7959965732991584
Energy: 0.7628870241975683
Energy: 0.7670586409548303
Energy: 0.7328370342236914
Energy: 0.7838110286367435
Energy: 0.7629651905611731
Energy: 0.7608032043934942
Energy: 0.7779919665463624
Energy: 0.7707441218511195
Energy: 0.7712684880556347
Energy: 0.714477735690751
Energy: 0.7624068730116843
Energy: 0.751288347171112
Energy: 0.7503535274192265
Energy: 0.7017778600689141
Energy: 0.7278242609872819
Energy: 0.7632078450751831
Energy: 0.7751373043471742
Energy: 0.7657295015877379
Energy: 0.7754973394693124
Energy: 0.7447483909072817
Energy: 0.7753452495110007
Energy: 0.74318223371073
Energy: 0.7458258470628691
Energy: 0.7768454917830041
Energy: 0.6918689536926043
Energy: 0.7517376800234848
Energy: 0.7788982575694866
Energy: 0.7827236869596929
Energy: 0.7110012781695253
Energy: 0.6964877694655756
Energy: 0.6796434310391963
Energy: 0.7588785546083442
Energy: 0.7871011887464133
Energy: 0.742150407507251
Energy: 0.7444491263587935
Energy: 0.7640222136163795
Energy: 0.7789285928522971
Energy: 0.7409953244802148
Energy: 0.7320918598340593
Energy: 0.7495542868550189
Energy: 0.6920886112341468
Energy: 0.7851648645671634
Energy: 0.7573997761568803
Energy: 0.7308994811250722
Energy: 0.7577795452387441
Energy: 0.7283241308226641
Energy: 0.7541674222357442
Energy: 0.7598707961558651
Energy: 0.7214167225178432
Energy: 0.7466075151183044
Energy: 0.7163649360558613
Energy: 0.6994358594078595
Energy: 0.7054559499172642
Energy: 0.7775051097648698
Energy: 0.7491169860774464
Energy: 0.7548517067766989
Energy: 0.7746720652086757
Energy: 0.715454522164068
Energy: 0.7704879075139904
Energy: 0.6870992280519559
Energy: 0.7559272829750865
Energy: 0.759160902813123
Energy: 0.7698354998307715
Energy: 0.7387536226746843
Energy: 0.6895528205163045
Energy: 0.7664561434326045
Energy: 0.7391457635603584
Energy: 0.7910819677256334
Energy: 0.7630968427221754
Energy: 0.6768255673137069
Energy: 0.7456946280848555
Energy: 0.7358474822930484
Energy: 0.699844980117201
Energy: 0.7467583363450971
Energy: 0.742093552394323
Energy: 0.7020717009481061
Energy: 0.6989629158521543
Energy: 0.7389494092909472
Energy: 0.7554203077533446
Energy: 0.7439052470161229
Energy: 0.7487998403727564
Energy: 0.7519352936987678
Energy: 0.7663506713391868
Energy: 0.7475491334160965
Energy: 0.7653416895881779
Energy: 0.744109137088779
Energy: 0.7282035781536623
Energy: 0.7406167996797215
Energy: 0.7476413672571294
Energy: 0.7892071517039406
Energy: 0.7760675498292975
Energy: 0.7502745919564785
Energy: 0.775172935925218
Energy: 0.7586991393642727
Energy: 0.7473136365334886
Energy: 0.7446246468732535
Energy: 0.7532020373511132
Energy: 0.7924530389146933
Energy: 0.7740015688792236
Energy: 0.7594922624115128
Energy: 0.8060300088994844
Energy: 0.8176696212532174
Energy: 0.7551359955721233
Energy: 0.8387931553854883
Energy: 0.8057896414508186
Energy: 0.785379678288183
Energy: 0.7885247441704513
Energy: 0.7495487756629194
Energy: 0.7843880158253931
Energy: 0.7756322539543012
Energy: 0.8068007242497583
Energy: 0.794882255901717
Energy: 0.7973337916944251
Energy: 0.8123712280045119
Energy: 0.8298149958185854
Energy: 0.7537624877418223
Energy: 0.7546182911861946
Energy: 0.8227788063702669
Energy: 0.7880868252206512
Energy: 0.7584363525874572
Energy: 0.8231300846806795
Energy: 0.8129202652789461
Energy: 0.7617417488323963
Energy: 0.7619991849570873
Energy: 0.8226644274294979
Energy: 0.7734433969904382
Energy: 0.7504174110290301
Energy: 0.7879648804394345
Energy: 0.752331835665952
Energy: 0.7751764454328914
Energy: 0.8052238680029059
Energy: 0.8146009710387554
Energy: 0.788573451740762
Energy: 0.753503629051285
Energy: 0.815263845444766

minimum gb energy = 0.6714642888570613 eV
minimum distance =  2.47226694755249 Angstroms
sigma value = 365


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

Energy: 0.7164312444670398
Energy: 0.6891016519473847
Energy: 0.7120566722651284
Energy: 0.6891614611947677
Energy: 0.6894965973144499
Energy: 0.7123138065740471
Energy: 0.6888662724090228
Energy: 0.6585572861446994
Energy: 0.8198414299933137
Energy: 0.6898481868961154
Energy: 0.6912085448520773
Energy: 0.6905985813307604
Energy: 0.6898633565691461
Energy: 0.8198702406743532
Energy: 0.696474207996739
Energy: 0.7809434002734557
Energy: 0.6889945133891515
Energy: 0.6900196118553291
Energy: 0.6893284715675082
Energy: 0.6883754310551855
Energy: 0.6890151480913691
Energy: 0.7000631934550616
Energy: 0.777476437081689
Energy: 0.6894326854183954
Energy: 0.6907862304281255
Energy: 0.6893126343402822
Energy: 0.6889211047983136
Energy: 0.6907086478979401
Energy: 0.6580786290425086
Energy: 0.8207094560739993
Energy: 0.643162602984688
Energy: 0.8200053055524249
Energy: 0.691247292987699
Energy: 0.6443303971974511
Energy: 0.8186139182342156
Energy: 0.7031849067481007
Energy: 0.7777383977998091
Energy: 0.6892139868918085
Energy: 0.6893613448607387
Energy: 0.6899375898430334
Energy: 0.6909185987199918
Energy: 0.6892935616146744
Energy: 0.6966382210470486
Energy: 0.8203202437546248
Energy: 0.6888859944962469
Energy: 0.6905509813864952
Energy: 0.6897246812728032
Energy: 0.6889081451949466
Energy: 0.8193407223277924
Energy: 0.6962425908854841
Energy: 0.8358881625066032
Energy: 0.6890720427353182
Energy: 0.6897997282855347
Energy: 0.689081467767239
Energy: 0.6881297685105519
Energy: 0.8197347487069241
Energy: 0.7015489545954784
Energy: 0.7817129160580876
Energy: 0.6892810942722812
Energy: 0.69060181389692
Energy: 0.6943887719374331
Energy: 0.6904383530812384
Energy: 0.6894287007848747
Energy: 0.65855652905883
Energy: 0.8206083104396782
Energy: 0.6429392903435829
Energy: 0.819626305556395
Energy: 0.8204332809491807
Energy: 0.6441603048788646
Energy: 0.8199987378303313
Energy: 0.701440719417708
Energy: 0.7773459056293687
Energy: 0.690336336501044
Energy: 0.6897897252969382
Energy: 0.6901589475313169
Energy: 0.6898372731680757
Energy: 0.690174447395325
Energy: 0.6968948145693163
Energy: 0.7820845870765994
Energy: 0.6888328503847355
Energy: 0.6897667754000469
Energy: 0.6891072200205174
Energy: 0.6886981522749807
Energy: 0.8198156010217656
Energy: 0.6975625311163651
Energy: 0.8200502485049445
Energy: 0.6894442084934581
Energy: 0.6907458270728776
Energy: 0.6896745162444038
Energy: 0.6889099007115235
Energy: 0.8192263290599473
Energy: 0.7043446183768247
Energy: 0.7774398317827331
Energy: 0.688789854824444
Energy: 0.6894790955087675
Energy: 0.690394578238567
Energy: 0.6896785989536183
Energy: 0.6885466174327224
Energy: 0.6584387264357981
Energy: 0.8205449257672218
Energy: 0.6427949777766195
Energy: 0.6917520457734574
Energy: 0.6911005730523937
Energy: 0.6907940194533497
Energy: 0.8201701098986671
Energy: 0.6966638039178438
Energy: 0.7807910762474798
Energy: 0.6893566143019584
Energy: 0.6903101648834702
Energy: 0.6898246848447964
Energy: 0.6888579720259179
Energy: 0.691483625533608
Energy: 0.6965564347275096
Energy: 0.7808534984017397
Energy: 0.6890087594747715
Energy: 0.6902726627428873
Energy: 0.6892599818445723
Energy: 0.6889647617654764
Energy: 0.6892704893524167
Energy: 0.6583033182763696
Energy: 0.8204168128571067
Energy: 0.6905274683771668
Energy: 0.6914951027232297
Energy: 0.6907945261661418
Energy: 0.6901290115377875
Energy: 0.8195934940512218
Energy: 0.701575708500287
Energy: 0.7772363513088346
Energy: 0.689459689149759
Energy: 0.6890410894940364
Energy: 0.6897852036221463
Energy: 0.689498132623692
Energy: 0.6889764593742186
Energy: 0.6977313940685574
Energy: 0.8199191079705039
Energy: 0.6894155147403239
Energy: 0.6907286380394643
Energy: 0.690298523879257
Energy: 0.6894390398139602
Energy: 0.8190802345918663

minimum gb energy = 0.6427949777766195 eV
minimum distance =  2.48750806469513 Angstroms
sigma value = 23