Model name: model_name=EAM_Dynamo_MendelevHanSrolovitz_2003Potential5_Fe__MO_942420706858_005
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.855258293449879
cohesive_energy=4.134425479783591
mass=55.845
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=[1.7453631597805798e-19, 2.4881002037703e-19, 3.0979046524370396e-19, 3.65185722364254e-19, 4.10527321106454e-19, 4.46632371553644e-19, 4.75586907683292e-19, 4.99666020315678e-19, 5.20914086835786e-19, 5.4047826571356e-19, 5.5863893785995e-19, 5.75346435799302e-19, 5.905110376401119e-19, 6.040702584936539e-19, 6.16035313596366e-19, 6.26460676953804e-19, 6.354152421612299e-19, 6.429695049905399e-19, 6.491859503304599e-19, 6.54130267422984e-19, 6.57860134626936e-19, 6.60426821594604e-19, 6.618944153913479e-19, 6.623558422619399e-19, 6.6188320015491e-19, 6.6040919765163e-19, 6.57842510683962e-19, 6.540693847108919e-19, 6.48939215128824e-19, 6.42242116798704e-19, 6.337409675786999e-19, 6.2316660179429995e-19, 6.10224218944848e-19, 5.94492446575602e-19, 5.75348037975936e-19, 5.521901769080999e-19, 5.24253022941042e-19, 4.90096219280796e-19, 4.4723158561476e-19, 3.9274796699895597e-19, 3.17769304881024e-19, 1.8924910400808e-19, -4.39230315504564e-20, -4.54656072136716e-19, -1.086741991252494e-18, -1.9495926153165598e-18, -3.1136059834502397e-18, -4.6934162316396e-18, -6.942055115692259e-18, -1.0137980934597419e-17, -1.4493530157659098e-17, -2.03955483331566e-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: 0.015651561283100027
Energy: 0.015913241129301436
Energy: 1.6816513977870735
Energy: 0.01610799946658625
Energy: 0.016069710477323567
Energy: 1.680076511856263
Energy: 0.01592977298943076
Energy: 0.016282213770507536
Energy: 0.20617312778928298
Energy: 0.4146020416971647
Energy: 0.167881941639596
Energy: 0.41438715385336355
Energy: 0.4147064451932419
Energy: 0.16799836616021688
Energy: 0.16789119158546922
Energy: 0.20568597764915317
Energy: 0.4145868847091767
Energy: 0.16758954228372805
Energy: 0.41409017015299837
Energy: 0.205605442807398
Energy: 0.16755488014068892
Energy: 0.16916389074458008
Energy: 0.41491534145580816
Energy: 0.20614911331421254
Energy: 0.16800582701478453
Energy: 0.1687027638173588
Energy: 0.20580579752967573
Energy: 0.16759378678971476
Energy: 0.1676777093376727
Energy: 0.20567858697546676
Energy: 0.41510007010942196
Energy: 0.1684240099968637
Energy: 0.41399300506404374
Energy: 0.20538753607594168
Energy: 0.16826611805219044
Energy: 0.01599970885410215
Energy: 0.20630218545739762
Energy: 0.41440984827046495
Energy: 0.016503772872633122
Energy: 0.016579270577012008
Energy: 0.41466548430670436
Energy: 0.16748863850225554

minimum gb energy = 0.015651561283100027 eV
minimum distance =  2.44031548367688 Angstroms
sigma value = 5


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

Energy: 2.4394574419667867
Energy: 1.3333107023724549
Energy: 1.7617972550632137
Energy: 1.5645538533769723
Energy: 1.5660981951467887
Energy: 1.2985602729678944
Energy: 1.3326972363657914
Energy: 1.3462437597146188
Energy: 1.3792738370717361
Energy: 1.4203853041250627
Energy: 1.3119885205302186
Energy: 1.3413372156848469
Energy: 1.289946839403513
Energy: 1.366941209524046
Energy: 1.3031056682377835
Energy: 1.3525781057681905
Energy: 1.3415569364429116
Energy: 1.3219693937491819
Energy: 1.339098589156959
Energy: 1.3414512880719978
Energy: 1.3400303621949412
Energy: 1.26508876014564
Energy: 1.3184228823389827
Energy: 1.3415597566970285
Energy: 1.3045362667768738
Energy: 1.3427874691885058
Energy: 1.3472513420663579
Energy: 1.30979602415306
Energy: 1.3670499210111573
Energy: 1.3249172311975856
Energy: 1.3339040323203821
Energy: 1.3191324572227743
Energy: 1.3422906613044046
Energy: 1.3406141910334994
Energy: 1.3082957868108565
Energy: 1.3140966410550992
Energy: 1.33544192724899
Energy: 1.3145965242170803
Energy: 1.3310389063655081
Energy: 1.3296857231305592
Energy: 1.3068791535909727
Energy: 1.3357689654313418
Energy: 1.3019331782050352
Energy: 1.3289619112760207
Energy: 1.3065601060832734
Energy: 1.341799841981001
Energy: 1.3357778578847619
Energy: 1.296403169643149
Energy: 1.3328903826348597
Energy: 1.3122388288964166
Energy: 1.316940805085668
Energy: 1.3314832215901988
Energy: 1.3913570178234054
Energy: 1.3360789833823716
Energy: 1.3240336976759317
Energy: 1.3170410401151298
Energy: 1.3607881586859547
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Energy: 1.347787719033682
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Energy: 1.2891314634735946
Energy: 1.329960063215454
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Energy: 1.3071489760019652
Energy: 1.3596789618468688
Energy: 1.3560945074554371
Energy: 1.3349254622326616
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Energy: 1.341178065338838
Energy: 1.3353905907138333
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Energy: 1.2686267747810103
Energy: 1.2938898688583873
Energy: 1.27265479996226
Energy: 1.2830744029707626
Energy: 1.301634314180905
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Energy: 1.2540573476129795
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Energy: 1.2884610996888517
Energy: 1.2627169175425408
Energy: 1.2880642638323556
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Energy: 1.3265155111580977
Energy: 1.3387714161459483
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Energy: 1.362605267351811
Energy: 1.3057389857793307
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Energy: 1.2691777898603454
Energy: 1.2930086007868011
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Energy: 1.2833144454638616
Energy: 1.2299916070379358
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Energy: 1.2987284607669638
Energy: 1.26532612093063
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Energy: 1.3072035932572819
Energy: 1.2694008181022498
Energy: 1.4130594566421861
Energy: 1.2734361305317436
Energy: 1.3294260717807531
Energy: 1.2673777471157952
Energy: 1.3209607552758746
Energy: 1.3214431973901732
Energy: 1.364316129193923
Energy: 1.3091397578931605
Energy: 1.3040655752474155
Energy: 1.3447285817448593
Energy: 1.3059895466984435
Energy: 1.3347689388870496
Energy: 1.240365271474576
Energy: 1.3281379236559123
Energy: 1.3457217287804002
Energy: 1.3421918820716603
Energy: 1.2824653729623727
Energy: 1.4081286904722035
Energy: 1.3334830331870287
Energy: 1.2650224172514068
Energy: 1.3343497322765934
Energy: 1.316451018028536
Energy: 1.3731629922711273
Energy: 1.3339661246685683
Energy: 1.2636787896337607
Energy: 1.2726809553340865
Energy: 1.3489346983433734
Energy: 1.342967942805046
Energy: 1.3093588410105836
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Energy: 1.3637881382552577
Energy: 1.2651651487240527
Energy: 1.3576547746496295
Energy: 1.3957009610857152
Energy: 1.3414288815272244
Energy: 1.3502260002641737
Energy: 1.2983874571822758
Energy: 1.342537725890987
Energy: 1.3166377919757781
Energy: 1.277017224909221
Energy: 1.3317454051594675
Energy: 1.4144511100537553
Energy: 1.3374994189946
Energy: 1.3545768156538478
Energy: 1.325061687131791
Energy: 1.3345404152564984
Energy: 1.3527410671641178
Energy: 1.2806068545103975
Energy: 1.2618904675421698
Energy: 1.2823698100505283
Energy: 1.3137462027900055
Energy: 1.322811030756492
Energy: 1.2650119316377546
Energy: 1.3418098476854303
Energy: 1.325964071494508
Energy: 1.2316402188173359
Energy: 1.2660713212021026
Energy: 1.2956756658184305
Energy: 1.2865691944268687
Energy: 1.2651167013362277
Energy: 1.312738445950742
Energy: 1.2824801001827482
Energy: 1.2571358485990163
Energy: 1.2702223752246065
Energy: 1.2945810083476508
Energy: 1.2704331357872387
Energy: 1.2575817790532613
Energy: 1.292631283245517
Energy: 1.2622302863275188
Energy: 1.3684819632339125
Energy: 1.361797267759424
Energy: 1.2928881860960006
Energy: 1.3712936618409421
Energy: 1.3599811173086571
Energy: 1.3278339203379683
Energy: 1.3564122299081254
Energy: 1.2826738702489695
Energy: 1.340860225826219
Energy: 1.3440410550990438
Energy: 1.2901966655825545
Energy: 1.3356837795395275
Energy: 1.3326535998568816
Energy: 1.2959427809637505
Energy: 1.2955755043869708
Energy: 1.338671077581611
Energy: 1.3423702505447463
Energy: 1.3177423575133762
Energy: 1.3389552693285607
Energy: 1.3454997837301872
Energy: 1.3238148089502373
Energy: 1.369038206639071
Energy: 1.3557872840326073
Energy: 1.4405588488990497
Energy: 1.3382200859375435
Energy: 1.370010335968504
Energy: 1.4004060306101886
Energy: 1.3354719873345209
Energy: 1.3312010592892405
Energy: 1.3371668982550025
Energy: 1.3761491248364357
Energy: 1.269636997084405
Energy: 1.3270011594005635
Energy: 1.350578679310481
Energy: 1.3279979152780916

minimum gb energy = 1.216604278903699 eV
minimum distance =  2.22911883840515 Angstroms
sigma value = 401


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

Energy: 2.065898591068654
Energy: 1.7270218567597753
Energy: 1.3412256772513786
Energy: 1.5972679158221839
Energy: 1.5975073317344517
Energy: 1.4387468017475662
Energy: 1.7396099435036088
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Energy: 1.3815295523070883
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Energy: 1.485910335756678
Energy: 1.2906778021070762
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Energy: 1.4058767777799515
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Energy: 1.4805581252114532
Energy: 1.3316190192470778
Energy: 1.3623012605494191
Energy: 1.4550972542716534
Energy: 1.30237745744848
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Energy: 1.3595358664085673
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Energy: 1.439783817731202
Energy: 1.3744085368815344
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Energy: 1.4504935413786975
Energy: 1.400857576938598
Energy: 1.3708360615074042
Energy: 1.4578965614059771
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Energy: 1.4457780357287002
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Energy: 1.3527591632632998
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Energy: 1.363395987159583
Energy: 1.2588994521598285
Energy: 1.347815589685802
Energy: 1.3663572235847015
Energy: 1.255307638753432
Energy: 1.2568234148519504
Energy: 1.3502854226090215
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Energy: 1.3763487994701176
Energy: 1.384861443318583
Energy: 1.242237205563214
Energy: 1.2340572218519468
Energy: 1.3434057220973399
Energy: 1.3662125592638643
Energy: 1.38349757737699
Energy: 1.3497832395573122
Energy: 1.5049069297252549
Energy: 1.3596002846109798
Energy: 1.3523998170482634
Energy: 1.5030828554884457
Energy: 1.354567690916079
Energy: 1.3548733186258906
Energy: 1.3734046783977816
Energy: 1.4789696056896553
Energy: 1.3837193944849466
Energy: 1.3811608325460778
Energy: 1.5029302199166044
Energy: 1.388643199924906
Energy: 1.4113255403959881
Energy: 1.3742060002544287
Energy: 1.4824338704378952
Energy: 1.416721690183672
Energy: 1.381524305398909
Energy: 1.47268786459616
Energy: 1.4175682396524827
Energy: 1.4500728042752176
Energy: 1.3379942720948839
Energy: 1.385731584378574
Energy: 1.4693856406807233
Energy: 1.4565310358187185
Energy: 1.4169703561821965
Energy: 1.4549807381086874
Energy: 1.4313002135637012
Energy: 1.3885535558804252
Energy: 1.358621221351135
Energy: 1.477371373327902
Energy: 1.4614232880021978
Energy: 1.3566412122119056
Energy: 1.4498576439818216
Energy: 1.4604802195916615
Energy: 1.3985707241546939
Energy: 1.4030069105059657
Energy: 1.4473344704438131
Energy: 1.4879465832751007
Energy: 1.3893894985617432
Energy: 1.4451692128436802
Energy: 1.5986849095588436
Energy: 1.3388070981118367
Energy: 1.371884961491384
Energy: 1.3640143592623493
Energy: 1.380996237460811
Energy: 1.3717891000919449
Energy: 1.429728693558572
Energy: 1.56968030923732
Energy: 1.4025331049793173
Energy: 1.7263645324653223
Energy: 1.5030002970218987
Energy: 1.374690594359888
Energy: 1.7245287988762492
Energy: 1.4716194251790284
Energy: 1.4095512761522486
Energy: 1.369617863899761
Energy: 1.3724152633173754
Energy: 1.3585390297841256
Energy: 1.3766314278002825
Energy: 1.3936469013819215
Energy: 1.3698684419229632
Energy: 1.5268751234784117
Energy: 1.436420015926318
Energy: 1.3932517517211624
Energy: 1.4493404051263945
Energy: 1.5179283324335056
Energy: 1.4195505436418263
Energy: 1.462008297185077
Energy: 1.5400831000209723
Energy: 1.419574308482005
Energy: 1.412232172081164
Energy: 1.4875834855867616
Energy: 1.4944448203749778
Energy: 1.4121513594570458
Energy: 1.4747268796394992
Energy: 1.5151753441704732
Energy: 1.3622063143824088
Energy: 1.4056298440805575
Energy: 1.4574651626476902
Energy: 1.3750630369190524
Energy: 1.4126418190023404
Energy: 1.4666379137997747
Energy: 1.3418254534895786
Energy: 1.3132738958575023
Energy: 1.353554021051275
Energy: 1.3847819761489402
Energy: 1.3385495660245914
Energy: 1.3561855334975197
Energy: 1.3593597800592756
Energy: 1.3128584526299631
Energy: 1.3287194863245264
Energy: 1.3527227783082423
Energy: 1.356464450524665
Energy: 1.3469178926762355
Energy: 1.3362733675856338
Energy: 1.3561707106506022
Energy: 1.3355688146504276
Energy: 1.30860144523491
Energy: 1.394934224139686
Energy: 1.3518831858301312
Energy: 1.3070503812031582
Energy: 1.3475569364815045
Energy: 1.365186300844498
Energy: 1.3484555107711789
Energy: 1.329386166151275
Energy: 1.421954278557526
Energy: 1.3018916948040098
Energy: 1.340426012861039
Energy: 1.4549769525194305
Energy: 1.3007341949072817
Energy: 1.414940226388413
Energy: 1.317302309438479
Energy: 1.482523204898984
Energy: 1.2763444081229884
Energy: 1.3249679643803889
Energy: 1.4933610265411428
Energy: 1.4438742712908514
Energy: 1.2942779787789471
Energy: 1.2809542707826211
Energy: 1.3572709763182318
Energy: 1.2949860479175732
Energy: 1.2865121110886806
Energy: 1.3605725513202214
Energy: 1.2947321435601726
Energy: 1.3065386140043729
Energy: 1.3018656038143224
Energy: 1.3108401152032045
Energy: 1.2444203176122166
Energy: 1.2630953124744422
Energy: 1.3034497803251168
Energy: 1.2809819019041118

minimum gb energy = 1.2328115113237175 eV
minimum distance =  2.23044982125221 Angstroms
sigma value = 311


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

Energy: 1.5857577157922345
Energy: 1.4984054333082617
Energy: 1.4465188775549573
Energy: 1.5057979070984375
Energy: 1.5060066845683215
Energy: 1.4379696000684226
Energy: 1.4692585709356878
Energy: 1.361318628107448
Energy: 1.3217811314315637
Energy: 1.337021293550954
Energy: 1.309478329044888
Energy: 1.3348718102595616
Energy: 1.3398676096144302
Energy: 1.3020050227189959
Energy: 1.3722552474769567
Energy: 1.3429161176103994
Energy: 1.3440618285399206
Energy: 1.3150449669902455
Energy: 1.387381251688241
Energy: 1.355937426092985
Energy: 1.3131832618890928
Energy: 1.3206029881029602
Energy: 1.3434937561094833
Energy: 1.329495192198063
Energy: 1.3418654914978558
Energy: 1.3479455352287946
Energy: 1.3488017458094868
Energy: 1.3344428904753682
Energy: 1.3754733296975221
Energy: 1.3642563947981787
Energy: 1.3802656365290389
Energy: 1.367632181061287
Energy: 1.4017506507778001
Energy: 1.397335964483653
Energy: 1.3683366519453113
Energy: 1.4377941574649629
Energy: 1.4325267098045398
Energy: 1.471400462831922
Energy: 1.4356134131594134
Energy: 1.4432524927856243
Energy: 1.467570415051725
Energy: 1.4393407469335269
Energy: 1.4161736292340543
Energy: 1.4513435562716923
Energy: 1.4571786483561564
Energy: 1.4345822890252944
Energy: 1.4353976871125662
Energy: 1.4572457426804992
Energy: 1.4329969178390654
Energy: 1.3570989227056303
Energy: 1.4262898755648572
Energy: 1.4480549339006015
Energy: 1.429124899268732
Energy: 1.4189691384052001
Energy: 1.4438757505892383
Energy: 1.4247846952060663
Energy: 1.4378924648434719
Energy: 1.3423113823894017
Energy: 1.3891002475565588
Energy: 1.346604968820622
Energy: 1.4335154342818202
Energy: 1.3833489876947511
Energy: 1.3228388898625745
Energy: 1.4591387645053573
Energy: 1.4380021356134292
Energy: 1.4806403564206339
Energy: 1.4975781744430006
Energy: 1.343621764125784
Energy: 1.4286865375810138
Energy: 1.4911961281299357
Energy: 1.3725064888216987
Energy: 1.3372539026766095
Energy: 1.476360823769221
Energy: 1.3472958325763913
Energy: 1.3563934024562831
Energy: 1.4662269259144352
Energy: 1.3794141798962112
Energy: 1.4188286929201963
Energy: 1.4139564801017968
Energy: 1.4845393559623723
Energy: 1.429907718310539
Energy: 1.4182140896756064
Energy: 1.4670495037055764
Energy: 1.5172420834005742
Energy: 1.4070979694994579
Energy: 1.4464712244701599
Energy: 1.486052311034582
Energy: 1.4890621781516862
Energy: 1.44410614760746
Energy: 1.4857924670794223
Energy: 1.4854339487232049
Energy: 1.3270389695097953
Energy: 1.341666129656928
Energy: 1.3123309629004574
Energy: 1.3337591076530655
Energy: 1.337557528138117
Energy: 1.3093723418664918
Energy: 1.3307872964442506
Energy: 1.3822068528683837
Energy: 1.3503039025825938
Energy: 1.3694149300589153
Energy: 1.386363905227941
Energy: 1.3572293083134654
Energy: 1.3478262306333535
Energy: 1.4166262766239717
Energy: 1.3505702332832707
Energy: 1.335823036418119
Energy: 1.3370143808987285
Energy: 1.3657897026230028
Energy: 1.3729557014972258
Energy: 1.3667618095944365
Energy: 1.3743365391155673
Energy: 1.3914056801739014
Energy: 1.3750664075358907
Energy: 1.3486615519187841
Energy: 1.3313347034015193
Energy: 1.3832685936303948
Energy: 1.3488998948712398
Energy: 1.3269007517479239
Energy: 1.4242558660980003
Energy: 1.4711270697477643
Energy: 1.4353603232020982
Energy: 1.4384883419840662
Energy: 1.4682012275740335
Energy: 1.4396314682189149
Energy: 1.433427917013312
Energy: 1.4351469280023113
Energy: 1.4511091805970344
Energy: 1.4333978620439622
Energy: 1.4331114395319267
Energy: 1.4536092889682117
Energy: 1.434805508973553
Energy: 1.433418411959505
Energy: 1.3692100095314172
Energy: 1.3851880066239581
Energy: 1.3451476343035973
Energy: 1.3388088229114623
Energy: 1.3431414319385833
Energy: 1.4036432092283826
Energy: 1.387932321170696
Energy: 1.447671231158572
Energy: 1.4803947911507975
Energy: 1.464591407186453
Energy: 1.438206903126133
Energy: 1.3917292080761625
Energy: 1.4725622828428024
Energy: 1.409815810099204
Energy: 1.4304053652014803
Energy: 1.3920549614369688
Energy: 1.436750126089336
Energy: 1.3647609620707764
Energy: 1.400678285222916
Energy: 1.459812750334425
Energy: 1.345454533920265
Energy: 1.3653262455567752
Energy: 1.4722009011132444
Energy: 1.4312830042147848
Energy: 1.4508509212914453
Energy: 1.412592732279957
Energy: 1.424045213356056
Energy: 1.4410031277134916
Energy: 1.4368541001796704
Energy: 1.504017583088116
Energy: 1.4327030278041206
Energy: 1.4306007817060133
Energy: 1.4809337069650612
Energy: 1.4811725856045606
Energy: 1.4377968754786552
Energy: 1.4343726538339543
Energy: 1.4994971181481718
Energy: 1.4937325528110372
Energy: 1.4443298020540325
Energy: 1.4889146084047555
Energy: 1.4549467978162929
Energy: 1.430650538953789
Energy: 1.2966494843466685
Energy: 1.3331314931456641
Energy: 1.3336022679564281
Energy: 1.344240430564093
Energy: 1.3115256400285435
Energy: 1.333331591361214
Energy: 1.353724204577763
Energy: 1.3519260929419337
Energy: 1.3549817299458686
Energy: 1.3886238072275774
Energy: 1.3722689007013675
Energy: 1.3739940260972063
Energy: 1.3934812084647326
Energy: 1.4026847386965327
Energy: 1.344047185433705
Energy: 1.3447491142054577
Energy: 1.383954253572585
Energy: 1.354536263347362
Energy: 1.3383112421967278
Energy: 1.3470814567249385
Energy: 1.4036449241204252
Energy: 1.3794500869256068
Energy: 1.3529209178449684
Energy: 1.3427644428528343
Energy: 1.3710709481537036
Energy: 1.339729944267438
Energy: 1.3285591900685856
Energy: 1.3733099471381731
Energy: 1.42433939360529
Energy: 1.4506077361040894
Energy: 1.4568594317970704
Energy: 1.4730326469070336
Energy: 1.4337137705791676
Energy: 1.4240763882456404
Energy: 1.4433463740773675
Energy: 1.3987568047748549
Energy: 1.4107242396930983
Energy: 1.4411135240564745
Energy: 1.4627083519251998
Energy: 1.4100976979183497
Energy: 1.4102025867831218
Energy: 1.4236804319122163
Energy: 1.4325508334066916
Energy: 1.3694722050923278
Energy: 1.3441561923513416
Energy: 1.3933907626507032
Energy: 1.3458297489997433
Energy: 1.3662164497892575
Energy: 1.3665134377434127
Energy: 1.4658891407057881
Energy: 1.4281482123448384
Energy: 1.4386092344305919
Energy: 1.436408542414816
Energy: 1.4346827064754057
Energy: 1.4188233847372893
Energy: 1.4298034295594868
Energy: 1.3785667310160066
Energy: 1.357365191582866
Energy: 1.3688744884090154
Energy: 1.3920804608407256
Energy: 1.3774771724002153
Energy: 1.3448110134036118
Energy: 1.3838900161395964
Energy: 1.3820563014998226
Energy: 1.4166994364909815
Energy: 1.4182560282233108
Energy: 1.4275304497903636
Energy: 1.4221145266925075
Energy: 1.4192307915708382
Energy: 1.4423012969901827
Energy: 1.4590609867360977
Energy: 1.444031900559242
Energy: 1.4352821403244027
Energy: 1.4829250973299974
Energy: 1.4826292703214212
Energy: 1.4361874048314438
Energy: 1.4883466865164825

minimum gb energy = 1.2966494843466685 eV
minimum distance =  2.2264598971135 Angstroms
sigma value = 39


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

Energy: 1.5337367337690464
Energy: 1.536971956720592
Energy: 1.3527634194270073
Energy: 1.5339852358248518
Energy: 1.5341247293836417
Energy: 1.571196106678267
Energy: 1.5341103300005599
Energy: 1.3246727512564715
Energy: 1.4059080851022803
Energy: 1.297908814991075
Energy: 1.3866953884082835
Energy: 1.4051084301299666
Energy: 1.2962656343987387
Energy: 1.387068386626254
Energy: 1.3976827523156403
Energy: 1.297640879539066
Energy: 1.341460548151824
Energy: 1.385438765401313
Energy: 1.4135815379630638
Energy: 1.3413283423556825
Energy: 1.40256599841795
Energy: 1.481402498755125
Energy: 1.3244574253268835
Energy: 1.4235974792161923
Energy: 1.4019896097949962
Energy: 1.333049028342218
Energy: 1.2178962141685232
Energy: 1.400904937873516
Energy: 1.3673226677641168
Energy: 1.2962043845044602
Energy: 1.353052084150069
Energy: 1.4665359516543537
Energy: 1.311714294088984
Energy: 1.3494743115246386
Energy: 1.361318154645826
Energy: 1.3611306932388822
Energy: 1.385294912057896
Energy: 1.2880485719163528
Energy: 1.399469717369718
Energy: 1.3645362656876239
Energy: 1.2939639131463865
Energy: 1.3364682522844455
Energy: 1.3801091002434815
Energy: 1.366442713777578
Energy: 1.2931089199998258
Energy: 1.4222717494752883
Energy: 1.3548082786600084
Energy: 1.3087337987636458
Energy: 1.401890158357652
Energy: 1.399499821672114
Energy: 1.380262221403968
Energy: 1.3395659660944856
Energy: 1.4248400411366013
Energy: 1.390778207262555
Energy: 1.3437445931374823
Energy: 1.4586064890698134
Energy: 1.387743849829208
Energy: 1.46964712336328
Energy: 1.4155938677249178
Energy: 1.4509136422682112
Energy: 1.4662144205509728
Energy: 1.3361668538372655
Energy: 1.4618488259100155
Energy: 1.506290501625415
Energy: 1.4672937052915804
Energy: 1.5732957752348617
Energy: 1.4418103860816662
Energy: 1.4918549462610937
Energy: 1.5780276850812989
Energy: 1.4608942505647295
Energy: 1.384972128558437
Energy: 1.3896506343795367
Energy: 1.3516093139536405
Energy: 1.4269392428898655
Energy: 1.388717034488386
Energy: 1.4224265346427587
Energy: 1.3861724339950316
Energy: 1.3973952188257754
Energy: 1.374543069423131
Energy: 1.467064823386365
Energy: 1.3852000980804395
Energy: 1.408569799565673
Energy: 1.35852555478617
Energy: 1.3857857311863777
Energy: 1.4827237517264946
Energy: 1.4034009018127946
Energy: 1.556662521924398
Energy: 1.5093732706358969
Energy: 1.4022849148778702
Energy: 1.3534502237993868
Energy: 1.5686887733947197
Energy: 1.3983115421996564
Energy: 1.422921673668371
Energy: 1.3635563740086742
Energy: 1.3863443741545227
Energy: 1.399975743321443
Energy: 1.4209437655398176
Energy: 1.3856335066076648
Energy: 1.3245710305122789
Energy: 1.390165764048731
Energy: 1.5773934994557843
Energy: 1.3861630273312646
Energy: 1.3873619355753295
Energy: 1.576979614929534
Energy: 1.466683484686096
Energy: 1.5337715018076619
Energy: 1.5068573205584885
Energy: 1.3515576543563437
Energy: 1.5341310732042581
Energy: 1.5346124545695348
Energy: 1.3366148437955516
Energy: 1.4662002241681704
Energy: 1.3970330262145771
Energy: 1.3990394196001243
Energy: 1.2966051428358016
Energy: 1.3867153203387712
Energy: 1.4048102557636526
Energy: 1.303259997179435
Energy: 1.3874900536717545
Energy: 1.3972095141548764
Energy: 1.2960695540238278
Energy: 1.3409949717029372
Energy: 1.3853427903125721
Energy: 1.4191110434269514
Energy: 1.341318978250304
Energy: 1.402282491099812
Energy: 1.484449085582518
Energy: 1.3247054644616731
Energy: 1.4165695244423129
Energy: 1.4013037794213863
Energy: 1.3335227787144506
Energy: 1.2191236377213204
Energy: 1.4005917269530919
Energy: 1.3113507636313486
Energy: 1.3179972606534045
Energy: 1.3524735823528347
Energy: 1.4240166976899062
Energy: 1.3111379794035882
Energy: 1.341484962390691
Energy: 1.3413835218500978
Energy: 1.3611172082025098
Energy: 1.3853332247301982
Energy: 1.2896910388945186
Energy: 1.3342044372880315
Energy: 1.363780414256814
Energy: 1.2938303225900714
Energy: 1.337805231804177
Energy: 1.3824465593692423
Energy: 1.3667234328082059
Energy: 1.2890701746219604
Energy: 1.426458159327885
Energy: 1.3548492238140093
Energy: 1.2854092342692558
Energy: 1.3974834000053002
Energy: 1.399592504919583
Energy: 1.3799379519190829
Energy: 1.3401824465107022
Energy: 1.4265966323786656
Energy: 1.3898189870528106
Energy: 1.34061830380605
Energy: 1.4615123575552018
Energy: 1.3885224587704992
Energy: 1.4656371842273404
Energy: 1.4205353603927904
Energy: 1.441620471308616
Energy: 1.4916614648060567
Energy: 1.3394187091869334
Energy: 1.4616433111856972
Energy: 1.3852200914979604
Energy: 1.4661649676916604
Energy: 1.572147199534996
Energy: 1.4419798854438255
Energy: 1.4918804752228751
Energy: 1.5782034659477064
Energy: 1.4506886788306603
Energy: 1.3852504924998277
Energy: 1.4119890795351748
Energy: 1.351522647715005
Energy: 1.419433300054526
Energy: 1.3889170775503963
Energy: 1.3534931848442688
Energy: 1.3858128479834582
Energy: 1.3970343425130514
Energy: 1.3744350127647134
Energy: 1.4670230409716893
Energy: 1.3849777609452285
Energy: 1.3841577167959163
Energy: 1.4730170944533776
Energy: 1.3821172095280285
Energy: 1.3931394085615898
Energy: 1.4035386405627004
Energy: 1.6701821550180356
Energy: 1.510118957013629
Energy: 1.4027118082281727
Energy: 1.3532033675391415
Energy: 1.5105851144032802
Energy: 1.3981109332090815
Energy: 1.4154487017818298
Energy: 1.3637557688015574
Energy: 1.3861649712788024
Energy: 1.423566445338072
Energy: 1.4214004906694269
Energy: 1.385648604585857
Energy: 1.3245948515865316
Energy: 1.3897334286443024
Energy: 1.5774800039631929
Energy: 1.3863388571545439
Energy: 1.3934990754725278
Energy: 1.577299592174901
Energy: 1.466790258175753

minimum gb energy = 1.2178962141685232 eV
minimum distance =  2.21443808055754 Angstroms
sigma value = 21


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

Energy: 1.7658313114161117
Energy: 1.258210856881232
Energy: 1.2292708515057837
Energy: 1.31305964668344
Energy: 1.258264339448276
Energy: 1.3020768181443538
Energy: 1.2582151234725152
Energy: 1.333486714167023
Energy: 1.2798850048157786
Energy: 1.2404803158238777
Energy: 1.336970715548145
Energy: 1.2382677907167106
Energy: 1.239861583635258
Energy: 1.3010694816324369
Energy: 1.339817623463059
Energy: 1.2350919171877788
Energy: 1.261706370253775
Energy: 1.3048064155508825
Energy: 1.2630395667375753
Energy: 1.2381915158141323
Energy: 1.3030819500635067
Energy: 1.3328203528474754
Energy: 1.1800793235558726
Energy: 1.1802488341821225
Energy: 1.3158009755462639
Energy: 1.2949521446347836
Energy: 1.1801880751217344
Energy: 1.3246289849505366
Energy: 1.198181750132302
Energy: 1.2125770242355767
Energy: 1.237948453476934
Energy: 1.2336892465601217
Energy: 1.2073162357783536
Energy: 1.1801452139533761
Energy: 1.262574852853618
Energy: 1.195817151176455
Energy: 1.223219937984796
Energy: 1.254993895039615
Energy: 1.2229534441951437
Energy: 1.206672542234126
Energy: 1.2172763966309994
Energy: 1.2565233286031712
Energy: 1.1818449124054833
Energy: 1.1856506114959475
Energy: 1.1729140497596124
Energy: 1.2416700688501563
Energy: 1.1853895050677017
Energy: 1.2452397996694167
Energy: 1.2021197440361047
Energy: 1.1806955658431872
Energy: 1.2023158820092739
Energy: 1.252702585225374
Energy: 1.2065568214912874
Energy: 1.2022861211860947
Energy: 1.2704773571214585
Energy: 1.2111701060792244
Energy: 1.1716016570037355
Energy: 1.1709724187222066
Energy: 1.24828118872983
Energy: 1.1831014728556373
Energy: 1.1600153652575282
Energy: 1.2583869111066552
Energy: 1.1870748033780099
Energy: 1.1625429697589873
Energy: 1.1466218334982137
Energy: 1.2332265124751156
Energy: 1.1869140978368078
Energy: 1.148287306812177
Energy: 1.2375207093765501
Energy: 1.1711824535395394
Energy: 1.169458419263645
Energy: 1.1967417952151853
Energy: 1.2384087073306764
Energy: 1.1917990743994826
Energy: 1.2063563513952953
Energy: 1.232220752611439
Energy: 1.1921506317997037
Energy: 1.2014585194752694
Energy: 1.2346799150545391
Energy: 1.211273522106555
Energy: 1.1949145869011264
Energy: 1.231668605928501
Energy: 1.2103993555635286
Energy: 1.2029605183570937
Energy: 1.1840336051722984
Energy: 1.2419579306216053
Energy: 1.1408963909402434
Energy: 1.1731702119806429
Energy: 1.2421356548296292
Energy: 1.1411239327646545
Energy: 1.1763185684667086
Energy: 1.2138132485332809
Energy: 1.1796164198780144
Energy: 1.1511841300168906
Energy: 1.1706938726891722
Energy: 1.2277600086432126
Energy: 1.1508228260275095
Energy: 1.1709919586977797
Energy: 1.209125282153691
Energy: 1.2532007706944688
Energy: 1.1810519646655016
Energy: 1.1872267009967754
Energy: 1.244007360964785
Energy: 1.201169632371605
Energy: 1.2068327108459362
Energy: 1.2550725315563689
Energy: 1.250461299714836
Energy: 1.1851486290019695
Energy: 1.2447953964843863
Energy: 1.2306430573686071
Energy: 1.185977604459121
Energy: 1.2592924157328613
Energy: 1.2524516909410168
Energy: 1.2284094742244354
Energy: 1.1854178152648436
Energy: 1.2471330002188192
Energy: 1.263588267834204
Energy: 1.1855690427906251
Energy: 1.2459142871080016
Energy: 1.2622148014092247
Energy: 1.2380143340574146
Energy: 1.2071617258184615
Energy: 1.2514359336462022
Energy: 1.2383175171617764
Energy: 1.2090838172076546
Energy: 1.2337171812738168
Energy: 1.239150164592515
Energy: 1.1802076269105295
Energy: 1.2768978578623398
Energy: 1.2777817816892738
Energy: 1.1802545128905537
Energy: 1.2146981832237056
Energy: 1.265940413474981
Energy: 1.262135032012798
Energy: 1.2383086894736726
Energy: 1.237814779872375
Energy: 1.3032085711663925
Energy: 1.2384983034198578
Energy: 1.2476987371222752
Energy: 1.3171448606635092
Energy: 1.2617697379151074
Energy: 1.238954360912746
Energy: 1.2384314396412046
Energy: 1.3189906794214956
Energy: 1.2393613693995322
Energy: 1.252114883544654
Energy: 1.318302661381546
Energy: 1.268402920470638
Energy: 1.232831814761364
Energy: 1.3327345629338865
Energy: 1.2938103332212887
Energy: 1.2557507620468125
Energy: 1.2584715035386729
Energy: 1.3345374812369664
Energy: 1.3280256952610419
Energy: 1.2328450371600985
Energy: 1.3329953256876526
Energy: 1.3175128845315294
Energy: 1.3020932406271135
Energy: 1.1801242502793723
Energy: 1.334678942023224
Energy: 1.328424755444176
Energy: 1.2391603219528675
Energy: 1.2385273592009456
Energy: 1.3178876787448746
Energy: 1.2389002859726757
Energy: 1.2564934603282274
Energy: 1.3190482545788846
Energy: 1.3426662269285798
Energy: 1.2806760039178564
Energy: 1.264449807030587
Energy: 1.3345276884027382
Energy: 1.3347389143715598
Energy: 1.2558654847483108
Energy: 1.3010168845552281

minimum gb energy = 1.1408963909402434 eV
minimum distance =  2.22562922646403 Angstroms
sigma value = 113


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

Energy: 1.787934400692594
Energy: 1.1059066666048023
Energy: 1.1312209419384314
Energy: 1.2463280918333992
Energy: 1.246130229763629
Energy: 1.1555656047570029
Energy: 1.0544889367928647
Energy: 1.1629974736663713
Energy: 1.0912959557485138
Energy: 1.1099417757560164
Energy: 1.1401647946931255
Energy: 1.1284590957590166
Energy: 1.105605419628162
Energy: 1.137593668086462
Energy: 1.168717110465312
Energy: 1.0885843774122381
Energy: 1.1402005755652465
Energy: 1.1451851460030436
Energy: 1.1066676246838736
Energy: 1.1201657470186694
Energy: 1.1426291391559014
Energy: 1.0871741859230362
Energy: 1.0853713784960546
Energy: 1.076578957246771
Energy: 1.065543250796327
Energy: 1.0606312510485258
Energy: 1.077012182136097
Energy: 1.1630663572861195
Energy: 1.0230784202369956
Energy: 1.075377099895994
Energy: 1.1374725494875615
Energy: 1.1077121917219153
Energy: 1.0714774481177796
Energy: 1.0760266799313694
Energy: 1.11217817923315
Energy: 1.0647272006707658
Energy: 1.0698496364418952
Energy: 1.1062476640377468
Energy: 1.0960041153011004
Energy: 1.0644106555356088
Energy: 1.0916152276636168
Energy: 1.1064523267095852
Energy: 1.0638235416266304
Energy: 1.184348479027481
Energy: 1.0680912699936145
Energy: 1.0709803566003269
Energy: 1.0641543739726076
Energy: 1.090435369848868
Energy: 1.070325289082887
Energy: 1.078910233377296
Energy: 1.2012330818683565
Energy: 1.088200462237689
Energy: 1.0617992934299363
Energy: 1.082902566107194
Energy: 1.0896442357985014
Energy: 1.064610943366395
Energy: 1.0778490486763328
Energy: 1.072454498988021
Energy: 1.0804417310267558
Energy: 1.0497675911520707
Energy: 1.0552663634713877
Energy: 1.0785319150743593
Energy: 1.0521027169944408
Energy: 1.0242940692461444
Energy: 1.041379040960351
Energy: 1.0407054278105337
Energy: 1.0462165405199733
Energy: 1.0433958052168024
Energy: 1.0767519184577934
Energy: 1.0248330135052404
Energy: 1.0518796967434374
Energy: 1.0731848901805543
Energy: 1.0771905545608436
Energy: 1.0420259281036646
Energy: 1.0427723239829114
Energy: 1.0764305058931134
Energy: 1.0309270039211655
Energy: 1.0471300692277752
Energy: 1.0650172629129921
Energy: 1.0367748839628823
Energy: 1.0331804266028985
Energy: 1.0556453106582098
Energy: 1.0354247450531775
Energy: 1.0334332015905787
Energy: 1.0448180377536342
Energy: 1.0537923725437017
Energy: 0.9984492264341219
Energy: 1.025446030196062
Energy: 1.0760733054195926
Energy: 1.0011401029398115
Energy: 1.0145191078640852
Energy: 1.0390286303832477
Energy: 1.0119991735342035
Energy: 0.9995716450935376
Energy: 1.0230267486907934
Energy: 1.070944734105205
Energy: 0.9855113781666356
Energy: 1.0223630401196813
Energy: 1.061132682089735
Energy: 1.0255816352837483
Energy: 1.0157498489004655
Energy: 1.0337828602864227
Energy: 1.016930672877975
Energy: 1.01115728474647
Energy: 1.0297074757173086
Energy: 0.9987023293799067
Energy: 1.0015081468862412
Energy: 1.0149249671911793
Energy: 1.0174095714873646
Energy: 0.9921856827095413
Energy: 1.0142808773698624
Energy: 1.0150572137803144
Energy: 0.9959449645860496
Energy: 1.0009243248904205
Energy: 1.0146362221436607
Energy: 1.020171623758077
Energy: 1.000997013238355
Energy: 1.014713401404494
Energy: 1.021309932069137
Energy: 1.0003453001859173
Energy: 1.0027840029735227
Energy: 1.040434235427295
Energy: 1.0311714525615896
Energy: 1.003909390185476
Energy: 1.0360163786619674
Energy: 1.0379256418935239
Energy: 1.002250708485769
Energy: 0.9980467819065323
Energy: 1.0315948766268894
Energy: 1.0201935154185682
Energy: 0.9980878857292454
Energy: 1.0369737716649998
Energy: 1.01133479152686
Energy: 0.9895370390736036
Energy: 0.979256372101496
Energy: 1.037727382662805
Energy: 0.9991569376645774
Energy: 0.9769452129880183
Energy: 1.0358094786225462
Energy: 0.9971796818945173
Energy: 1.027239274499941
Energy: 1.0207521265064565
Energy: 1.030198099199073
Energy: 1.0099908465442178
Energy: 1.0238715144415915
Energy: 1.0281603932737908
Energy: 1.0083879348857567
Energy: 1.0171235457218148
Energy: 1.0286001161546974
Energy: 1.0238637132163015
Energy: 1.0086324178592059
Energy: 1.0268761663286239
Energy: 1.0249139016411235
Energy: 1.0090035383780578
Energy: 1.0054614970391313
Energy: 1.0330169416259949
Energy: 0.9755879710645273
Energy: 1.0000484838477484
Energy: 1.034263076081691
Energy: 0.9767514962530041
Energy: 0.998608862426102
Energy: 1.0308783413108726
Energy: 1.04606290117609
Energy: 0.9976449831966336
Energy: 1.0231683851597564
Energy: 1.0352537990149822
Energy: 0.998384575674503
Energy: 1.023026116233121
Energy: 1.0510458171880468
Energy: 1.0285198456526747
Energy: 1.0042259468506176
Energy: 1.0315534578172876
Energy: 1.0414944529577295
Energy: 1.0044881487959914
Energy: 1.0289022292632988
Energy: 1.0270554511834848
Energy: 1.0031045185875358
Energy: 1.0013976836213163
Energy: 1.0207906691407844
Energy: 1.0137748900492312
Energy: 1.0002790686159377
Energy: 1.0171447901084358
Energy: 1.023056317972696
Energy: 0.998220758935594
Energy: 0.994007749703514
Energy: 1.0169703220619064
Energy: 1.0157647526659985
Energy: 0.9925573884116292
Energy: 1.016855701616919
Energy: 1.0242511220521813
Energy: 1.0098931430812872
Energy: 1.014415878289515
Energy: 1.0489470733330624
Energy: 1.014022526721772
Energy: 1.0245151994242725
Energy: 1.044850245086982
Energy: 1.011012322652812
Energy: 0.9998160778833688
Energy: 1.071209241762723
Energy: 1.022111431016046
Energy: 0.9994545719783042
Energy: 1.068852662513726
Energy: 1.022627008164214
Energy: 1.009049841507917
Energy: 1.0051065687397611
Energy: 1.0656753896693614
Energy: 1.016553321291037
Energy: 0.9988651901608008
Energy: 1.0622159419499415
Energy: 1.0183759404932067
Energy: 1.0540866146514045
Energy: 1.0284791558271753
Energy: 1.0554165476757926
Energy: 1.0325919040254505
Energy: 1.0366575926177257
Energy: 1.0548617853638276
Energy: 1.0333920881640066
Energy: 1.0451676480953804
Energy: 1.057545039222559
Energy: 1.0377834273516195
Energy: 1.0389411964615105
Energy: 1.0759194531115654
Energy: 1.0547073196318357
Energy: 1.0478818607666491
Energy: 1.0412790148688957
Energy: 1.0793718507898964
Energy: 1.041026556961654
Energy: 1.0553646649290527
Energy: 1.0781937660863614
Energy: 1.0435233612534573
Energy: 1.0523049325195826
Energy: 1.0710742075166928
Energy: 1.0803438057770263
Energy: 1.061688743607513
Energy: 1.052204266628083
Energy: 1.0781176722556292
Energy: 1.0577691137391783
Energy: 1.05228540850519
Energy: 1.0756377688926895
Energy: 1.1026314388861607
Energy: 1.0821123066980374
Energy: 1.0665932100380693
Energy: 1.0545045977739325
Energy: 1.0830211145852282
Energy: 1.0526280428912267
Energy: 1.0484782749513413
Energy: 1.090632789086303
Energy: 1.0641101299367168
Energy: 1.0331911638476978
Energy: 1.1274976263112264
Energy: 1.0644381125284852
Energy: 1.0819743464352036
Energy: 1.11593880320502
Energy: 1.0937039863740707
Energy: 1.0652960278721062
Energy: 1.0955965118987394
Energy: 1.126240126036327
Energy: 1.065969230605737
Energy: 1.0952930084839514
Energy: 1.1723253910576512
Energy: 1.0776600626284634
Energy: 1.0866717010988636
Energy: 1.1131369729454639
Energy: 1.0769171837383762
Energy: 1.075212222504966
Energy: 1.1231841322267964
Energy: 1.156981804094857
Energy: 1.1975184342204506
Energy: 1.0502104014320062
Energy: 1.1228769834339272
Energy: 1.076196282756469
Energy: 1.07452503440755
Energy: 1.0697308772286451
Energy: 1.1417165578079211
Energy: 1.1201490223898325
Energy: 1.106816495801629
Energy: 1.1387277441910666
Energy: 1.1324335055953396
Energy: 1.0974090492275819
Energy: 1.133639668665841
Energy: 1.1190986247123673
Energy: 1.1055639836295548
Energy: 1.1862436395080234
Energy: 1.1355314835507044
Energy: 1.1116552308282086
Energy: 1.1077052254979223
Energy: 1.1737118153429522
Energy: 1.061424520168209
Energy: 1.1474125663241883
Energy: 1.135372984562662
Energy: 1.0541913011858515
Energy: 1.061037100206797
Energy: 1.1349442277909025
Energy: 1.1908157242438309
Energy: 1.1689949826531505
Energy: 1.1084737848581245
Energy: 1.1401923423472609
Energy: 1.1353566722594133
Energy: 1.1317990739784944
Energy: 1.1189887762907287
Energy: 1.1415757588976312
Energy: 1.1404091933414604
Energy: 1.1184690009809963
Energy: 1.1301931593835988
Energy: 1.140766868395311
Energy: 1.130468920517678
Energy: 1.1057048114174763
Energy: 1.169384383823454
Energy: 1.20462328873494
Energy: 1.0604401197763453
Energy: 1.0613547667980543
Energy: 1.135255081356929
Energy: 1.1352923176804275
Energy: 1.072603566198152
Energy: 1.0547213462679197

minimum gb energy = 0.9755879710645273 eV
minimum distance =  2.23276510080176 Angstroms
sigma value = 365


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

Energy: 1.2737747326650952
Energy: 1.3651440135081783
Energy: 1.2827477447412805
Energy: 1.281350527445743
Energy: 1.2809835365196298
Energy: 1.2826516608545855
Energy: 1.2874060649534178
Energy: 1.1941771039383564
Energy: 0.397652937007926
Energy: 0.39751097488184794
Energy: 0.3973350653804369
Energy: 0.39721841834011695
Energy: 0.397734420738236
Energy: 0.3976964263273989
Energy: 0.4136184060199745
Energy: 0.39789329281743246
Energy: 0.39781690482797916
Energy: 0.3977023682818875
Energy: 0.3974064500106485
Energy: 0.3974785104463002
Energy: 0.3976303002703313
Energy: 1.1945335371346415
Energy: 1.1933533239857925
Energy: 1.2592216196668637
Energy: 1.243055408623695
Energy: 1.258414078714117
Energy: 1.2612026934464946
Energy: 1.2611746380885853
Energy: 1.1944250171290454
Energy: 1.1924747031137606
Energy: 1.1936505386594156
Energy: 1.193140204887777
Energy: 1.2875573755739196
Energy: 1.1934811660113438
Energy: 1.1931466806289073
Energy: 0.4139434511296637
Energy: 0.3977803633705694
Energy: 0.39760759126397377
Energy: 0.3975389623495471
Energy: 0.39731643052862
Energy: 0.3974800143385222
Energy: 0.39768930448576273
Energy: 1.1944588954711737
Energy: 1.1932189152664696
Energy: 1.2595992155999038
Energy: 1.288747786446388
Energy: 1.2602638622735043
Energy: 1.2599831304126703
Energy: 1.192904440070381
Energy: 1.1943877094080737
Energy: 1.193085802724903
Energy: 1.2617987333335392
Energy: 1.2596123430049524
Energy: 1.287168217917701
Energy: 1.260142971505376
Energy: 1.1923553771775168
Energy: 0.41374945771023625
Energy: 0.39790870429444763
Energy: 0.3975514162652411
Energy: 0.39730092102450326
Energy: 0.3976442317235419
Energy: 0.3975867370179874
Energy: 0.3977572018616646
Energy: 1.1942050541576565
Energy: 1.1927161228591578
Energy: 1.19327748343051
Energy: 1.1935853481021432
Energy: 1.1915804871143025
Energy: 1.193526992234975
Energy: 1.1926764505243905
Energy: 1.194619834095742
Energy: 1.1926615534947382
Energy: 1.260059328057101
Energy: 1.2587606366852595
Energy: 1.255844833189162
Energy: 1.2487518883686552
Energy: 1.25889200170113
Energy: 0.413602444879542
Energy: 0.39778891043285103
Energy: 0.3975143906166384
Energy: 0.39745675905254774
Energy: 0.3976684440871055
Energy: 0.39759332552924237
Energy: 0.3978582080261223
Energy: 0.41355233172504025
Energy: 0.39801260468461674
Energy: 0.39775820675942575
Energy: 0.3975641069032268
Energy: 0.39739238722160775
Energy: 0.3972624743149459
Energy: 0.397746324455523
Energy: 1.237029356334224
Energy: 1.192696051274596
Energy: 1.2497512628676972
Energy: 1.2461443691467695
Energy: 1.2526588459874075
Energy: 1.2484232897055914
Energy: 1.2586828248347004
Energy: 1.194208418612036
Energy: 1.1919291882665737
Energy: 1.1937733787860063
Energy: 0.39740788566061713
Energy: 0.39734195642663916
Energy: 0.3976412360996726
Energy: 1.1933899066011493
Energy: 0.41368106876292765
Energy: 0.39792467669567805
Energy: 0.3977175514729541
Energy: 0.39755697422345504
Energy: 0.3975969619856623
Energy: 0.3977542681478806
Energy: 0.3974816403694022
Energy: 1.194432839228188
Energy: 1.1917523023089036
Energy: 1.2602340765821618
Energy: 1.2466121094311602
Energy: 1.25936242479797
Energy: 1.2610073041662644
Energy: 1.2610044514135221
Energy: 1.194265947724183
Energy: 1.1922641494177622
Energy: 1.1933842950858036
Energy: 1.2874267820802718
Energy: 1.2894788748187236
Energy: 1.193413629330728
Energy: 1.1930172388449505
Energy: 0.41419553149924365
Energy: 0.39767162707979786
Energy: 0.39754043433655245
Energy: 0.39752076272459785
Energy: 0.3975580518346804
Energy: 0.39738124165348665
Energy: 0.3973939714819277
Energy: 1.1933445589464218
Energy: 1.1931668062141172
Energy: 1.192995930754256
Energy: 1.288937201301801
Energy: 1.2877853773360954
Energy: 1.2597697893551079
Energy: 1.1931945641880204

minimum gb energy = 0.39721841834011695 eV
minimum distance =  2.32959442180184 Angstroms
sigma value = 23