Model name: model_name=EAM_Dynamo_DeluigiPasianotValencia_2021_FeNiCrCoCu__MO_657255834688_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.560000121593475
cohesive_energy=4.4003460121350955
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: 0.017552102249541186
Energy: 0.01825655354527086
Energy: 0.017757079763205577
Energy: 0.01825655354527086
Energy: 0.01825655354527086
Energy: 1.163609980655831
Energy: 0.01825655354527086
Energy: 1.163609980655831
Energy: 0.017757079761337197
Energy: 0.01825655354527086
Energy: 0.017552102249541186
Energy: 0.01825655354527086
Energy: 0.01825655354527086
Energy: 1.163609980655831
Energy: 0.01825655354527086
Energy: 1.163609980655831

minimum gb energy = 0.017552102249541186 eV
minimum distance =  2.41817413986084 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 1.285164089148041
Energy: 1.334719867615029
Energy: 1.303754892651845
Energy: 1.334719867615029
Energy: 1.2712913295222479
Energy: 1.341222223855643
Energy: 1.2815942964105762
Energy: 1.3412222238564275
Energy: 1.2781274021561153
Energy: 1.331104831750492
Energy: 1.2743450380246333
Energy: 1.3311048317512766
Energy: 1.27092805688903
Energy: 1.348335069416004
Energy: 1.255488505283093
Energy: 1.3483350694167882
Energy: 1.2740673408066399
Energy: 1.3361155681569543
Energy: 1.2676521379307641
Energy: 1.336115568153817
Energy: 1.2103660166805468
Energy: 1.3230884397709868
Energy: 1.2461773913327754
Energy: 1.323088439784321
Energy: 1.273859551120469
Energy: 1.333696199152398
Energy: 1.210544202519801
Energy: 1.3336961991539666
Energy: 1.1543236944171364
Energy: 1.3351232692098
Energy: 1.2574734888597094
Energy: 1.3351232692105846
Energy: 1.254537702242557
Energy: 1.2679658934959357
Energy: 1.2752858584877464
Energy: 1.2679658934959357
Energy: 1.2506619439202133
Energy: 1.3320878940253222
Energy: 1.1612044572401998
Energy: 1.3320878940237537
Energy: 1.2855504857188813
Energy: 1.3282982751546109
Energy: 1.2546996770662198
Energy: 1.3282982751538266
Energy: 1.3163522085605426
Energy: 1.3353151382413253
Energy: 1.2462032026854117
Energy: 1.3353151382413253
Energy: 1.2637289536404896
Energy: 1.3339221986591312
Energy: 1.273741927496577
Energy: 1.333922198658347
Energy: 1.2708212134748749
Energy: 1.3393610257577393
Energy: 1.258282981752968
Energy: 1.3393610257585236
Energy: 1.2770193170020832
Energy: 1.3359468033606925
Energy: 1.2769405491864625
Energy: 1.3359468033621897
Energy: 1.2794355531092179
Energy: 1.3370924604562326
Energy: 1.2730065570671536
Energy: 1.3370924604578014
Energy: 1.27411141116272
Energy: 1.3312231800610193
Energy: 1.214526358715208
Energy: 1.3312231800610193
Energy: 1.2816438188765416
Energy: 1.3352277433552566
Energy: 1.2718001431087071
Energy: 1.3352277433536879
Energy: 1.220902991926591
Energy: 1.3345304860794795
Energy: 1.2509734201307174
Energy: 1.334530486080264
Energy: 1.2846504308927218
Energy: 1.2693707818511033
Energy: 1.2570872009048395
Energy: 1.2693707818503188
Energy: 1.2472718459145715
Energy: 1.3310699711420981
Energy: 1.187130325595959
Energy: 1.331069971139745
Energy: 1.2544237597059247
Energy: 1.3256156729487305
Energy: 1.2724671123344358
Energy: 1.325615672949515
Energy: 1.2677207460848179
Energy: 1.3357481414266845
Energy: 1.2150100440044955
Energy: 1.3357481414259
Energy: 1.2596650279159365
Energy: 1.3325925988386131
Energy: 1.209948325362698
Energy: 1.3325925988386131
Energy: 1.2106773774322206
Energy: 1.3237697440349776
Energy: 1.2737022115253092
Energy: 1.323769744035762
Energy: 1.2779246636468535
Energy: 1.335896853155481
Energy: 1.224020232854612
Energy: 1.3358968531546966
Energy: 1.2674233527627625
Energy: 1.337792442131553
Energy: 1.2552026203090372
Energy: 1.3377924421307685
Energy: 1.2343529441544565
Energy: 1.3313412069980741
Energy: 1.2633106932199565
Energy: 1.3313412070004274
Energy: 1.2707508733711281
Energy: 1.344902024687956
Energy: 1.2853881329495886
Energy: 1.344902024687956
Energy: 1.262225838601278
Energy: 1.3348283024378083
Energy: 1.3210551035696554
Energy: 1.334828302435455
Energy: 1.2737671536091741
Energy: 1.3396246650922992
Energy: 1.2634258590786063
Energy: 1.3396246650938677
Energy: 1.2817668983814674
Energy: 1.3323133344444118
Energy: 1.271789912080672
Energy: 1.3323133344444118
Energy: 1.2755003594564447
Energy: 1.345424299610708
Energy: 1.2559863261697815
Energy: 1.345424299612277

minimum gb energy = 1.1543236944171364 eV
minimum distance =  2.30606223288648 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 1.3988795363264537
Energy: 1.4550471735049106
Energy: 1.4024024573665952
Energy: 1.4550471735013333
Energy: 1.353721102673868
Energy: 1.429193760402216
Energy: 1.3773265721622332
Energy: 1.4291937604031104
Energy: 1.3137930233110173
Energy: 1.455211552751972
Energy: 1.3593362402459621
Energy: 1.455211552743029
Energy: 1.342990357231416
Energy: 1.4715153330786557
Energy: 1.2913584786117511
Energy: 1.4715153330750783
Energy: 1.3432249698562917
Energy: 1.4481132955592464
Energy: 1.3547437944049572
Energy: 1.4481132955601408
Energy: 1.4144470843494696
Energy: 1.4478644895413921
Energy: 1.3553682737115973
Energy: 1.4478644895413921
Energy: 1.3534911412413497
Energy: 1.4134932189550589
Energy: 1.328823057480845
Energy: 1.413493218955953
Energy: 1.2357175955676054
Energy: 1.4547752147654789
Energy: 1.3239405645521114
Energy: 1.4547752147681619
Energy: 1.3433316009914578
Energy: 1.367642915631858
Energy: 1.3885917306874944
Energy: 1.3676429156264924
Energy: 1.3870084721055769
Energy: 1.4550888133923627
Energy: 1.36702480124494
Energy: 1.4550888133977287
Energy: 1.3531530934888598
Energy: 1.447366082065211
Energy: 1.369942903328673
Energy: 1.4473660820643166
Energy: 1.293389619905328
Energy: 1.4521647942350773
Energy: 1.3554486597410977
Energy: 1.4521647942386542
Energy: 1.3680809298334256
Energy: 1.448105726575219
Energy: 1.3562966131541576
Energy: 1.448105726575219
Energy: 1.3679784139446984
Energy: 1.4478670537986154
Energy: 1.3302088302965698
Energy: 1.4478670538057696
Energy: 1.2927268402199157
Energy: 1.4523409064371715
Energy: 1.3670378797232436
Energy: 1.4523409064344885
Energy: 1.3533137659505907
Energy: 1.4472247089636283
Energy: 1.3771744425782482
Energy: 1.447224708966311
Energy: 1.3867035993980346
Energy: 1.4549643942268529
Energy: 1.3100750298131907
Energy: 1.4549643942304302
Energy: 1.343664275981547
Energy: 1.366730831491345
Energy: 1.3912110358814287
Energy: 1.366730831491345
Energy: 1.235731256847769
Energy: 1.4550430499540512
Energy: 1.2916064209958786
Energy: 1.4550430499549452
Energy: 1.3535120717078328
Energy: 1.4136189258348508
Energy: 1.2915490851093738
Energy: 1.4136189258330625
Energy: 1.4145270462806505
Energy: 1.4475738508231133
Energy: 1.3193912538020451
Energy: 1.4475738508231133
Energy: 1.3432201071591872
Energy: 1.4480834393949775
Energy: 1.355712816440376
Energy: 1.4480834393914004
Energy: 1.3429558736663796
Energy: 1.4718441917385874
Energy: 1.3029591079557297
Energy: 1.471844191737693
Energy: 1.3137920303983683
Energy: 1.4550751715933263
Energy: 1.356882329935926
Energy: 1.4550751715843833
Energy: 1.354064414869506
Energy: 1.4295951487193073
Energy: 1.3774188157559153
Energy: 1.4295951487228846
Energy: 1.3988795363264537
Energy: 1.4550471735049106
Energy: 1.4380319538803905
Energy: 1.4550471735013333
Energy: 1.353721102673868
Energy: 1.429193760402216
Energy: 1.3773265721613388
Energy: 1.4291937604040046
Energy: 1.3137930233110173
Energy: 1.455211552751972
Energy: 1.3593362402450677
Energy: 1.455211552743029
Energy: 1.3429903572323103
Energy: 1.4715153330786557
Energy: 1.2913584786117511
Energy: 1.4715153330750783

minimum gb energy = 1.2357175955676054 eV
minimum distance =  2.29331751404753 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 1.4652027394609275
Energy: 1.58612117728897
Energy: 1.5218450287437841
Energy: 1.5861211772900097
Energy: 1.4759225213579683
Energy: 1.6014523603537802
Energy: 1.4635311512583673
Energy: 1.6014523603527406
Energy: 1.4085685588525119
Energy: 1.5976365500941896
Energy: 1.4615405407296598
Energy: 1.5976365500931502
Energy: 1.4781880282665145
Energy: 1.6061264953667158
Energy: 1.3915738383684273
Energy: 1.606126495365676
Energy: 1.3911857282160414
Energy: 1.5867385270486247
Energy: 1.4065501188772225
Energy: 1.5867385270475851
Energy: 1.534895237876244
Energy: 1.5978798156958551
Energy: 1.4753288098886723
Energy: 1.5978798156958551
Energy: 1.475557223890228
Energy: 1.465711127721108
Energy: 1.3898510556757533
Energy: 1.465711127721108
Energy: 1.601961113473755
Energy: 1.5856259120701734
Energy: 1.3151778584759828
Energy: 1.5856259120722527
Energy: 1.390539380552512
Energy: 1.5431758389268262
Energy: 1.4754433515468177
Energy: 1.543175838928858
Energy: 1.46548558228263
Energy: 1.5981246795629185
Energy: 1.3921338830707846
Energy: 1.5981246795629185
Energy: 1.478376139164961
Energy: 1.5868143327515325
Energy: 1.4598627522452878
Energy: 1.586814332752572
Energy: 1.4028672589115694
Energy: 1.5873134236555575
Energy: 1.4592639684016928
Energy: 1.5873134236545179
Energy: 1.461258308086502
Energy: 1.6084165544756266
Energy: 1.3932562793179881
Energy: 1.608416554477706
Energy: 1.390748011840236
Energy: 1.6163640030116795
Energy: 1.475846230186677
Energy: 1.6163640030106399
Energy: 1.417551236216986
Energy: 1.5863103613593894
Energy: 1.3130959839697887
Energy: 1.5863103613583498
Energy: 1.4847176348342908
Energy: 1.4654090496791958
Energy: 1.3936295322515133
Energy: 1.4654090496781562
Energy: 1.3268191622749106
Energy: 1.5976362667123756
Energy: 1.320163219133307
Energy: 1.5976362667123756
Energy: 1.39131724529348
Energy: 1.5898278876584189
Energy: 1.485332993468613
Energy: 1.5898278876594583
Energy: 1.3942828479775702
Energy: 1.6077804964346956
Energy: 1.3920803249391438
Energy: 1.6077804964346956
Energy: 1.4759688099389712
Energy: 1.5979375765411388
Energy: 1.4587324528350416
Energy: 1.5979375765421784
Energy: 1.4569953354284277
Energy: 1.5996787785769961
Energy: 1.4610168003893924
Energy: 1.5996787785780358
Energy: 1.4587797994724616
Energy: 1.5856500093741182
Energy: 1.5468030509968074
Energy: 1.5856500093730785
Energy: 1.4760988626160385
Energy: 1.542612378236478
Energy: 1.4590979313714194
Energy: 1.542612378236478
Energy: 1.4074275479663794
Energy: 1.5976189167586616
Energy: 1.4656454226401687
Energy: 1.5976189167586616
Energy: 1.459057461742683
Energy: 1.5462833714527104
Energy: 1.3905850721379251
Energy: 1.5462833714506312

minimum gb energy = 1.3130959839697887 eV
minimum distance =  2.28647128149626 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 1.6077907524681776
Energy: 1.792979571101485
Energy: 1.672442634392437
Energy: 1.792979571105206
Energy: 1.5494731358948843
Energy: 1.780137440156559
Energy: 1.5773400013373808
Energy: 1.7801374401540788
Energy: 1.5212208560754497
Energy: 1.7796834436207751
Energy: 1.5616964161206937
Energy: 1.7796834436220155
Energy: 1.6061985172544782
Energy: 1.7881009233324607
Energy: 1.4112315302883802
Energy: 1.7881009233312206
Energy: 1.616791506733702
Energy: 1.7162219829867762
Energy: 1.51297559545009
Energy: 1.716221982988016
Energy: 1.4727561026968792
Energy: 1.6961634258449916
Energy: 1.4582217775447308
Energy: 1.696163425843751
Energy: 1.5884865690436205
Energy: 1.4112713400244081
Energy: 1.41167988265852
Energy: 1.4112713400244081
Energy: 1.5078373978613548
Energy: 1.6967024107309643
Energy: 1.4621104784762016
Energy: 1.6967024107309643
Energy: 1.5882121747601616
Energy: 1.7167699749429914
Energy: 1.558037655573363
Energy: 1.7167699749429914
Energy: 1.5873992812880313
Energy: 1.7945951322720552
Energy: 1.4124896025812574
Energy: 1.7945951322732954
Energy: 1.509936812530933
Energy: 1.7873866890601033
Energy: 1.562125789638639
Energy: 1.7873866890613437
Energy: 1.5890997447699133
Energy: 1.6247673760592845
Energy: 1.458690483136749
Energy: 1.6247673760605248
Energy: 1.4835566660571928
Energy: 1.780042719254539
Energy: 1.4146674211706762
Energy: 1.780042719255779
Energy: 1.4114623214726951
Energy: 1.5581255902821731
Energy: 1.618817022703384
Energy: 1.5581255902834135
Energy: 1.483603976758772
Energy: 1.780078715731343
Energy: 1.5089999197867916
Energy: 1.780078715731343
Energy: 1.5894539974010522
Energy: 1.6347853747582244
Energy: 1.4114639527014594
Energy: 1.6347853747545038
Energy: 1.5791313338566177
Energy: 1.7794706223590344
Energy: 1.5620161555332048
Energy: 1.7794706223627552
Energy: 1.5525697039767101
Energy: 1.7762832122044403
Energy: 1.4602285754992297
Energy: 1.7762832122032004
Energy: 1.5549042246992173
Energy: 1.641072314422844
Energy: 1.512942695380092
Energy: 1.6410723144240842
Energy: 1.588132177138062
Energy: 1.5986029857045452
Energy: 1.462333760946074
Energy: 1.5986029857020647
Energy: 1.5884388728458572
Energy: 1.4586021649195229
Energy: 1.4597306767219467
Energy: 1.4586021649182825

minimum gb energy = 1.4112315302883802 eV
minimum distance =  2.31766141803059 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 1.4902817240508173
Energy: 1.9897624670220588
Energy: 1.7116331784279215
Energy: 1.9897624670220588
Energy: 1.4947701749439402
Energy: 1.6056866199647182
Energy: 1.5004336561224116
Energy: 1.6056866199631843
Energy: 1.5005741448343781
Energy: 1.5525607959708276
Energy: 1.5001900816466782
Energy: 1.552560795972361
Energy: 1.4892579440961735
Energy: 1.5729912616073043
Energy: 1.7121885376270747
Energy: 1.5729912616088377
Energy: 1.7096756542833085
Energy: 1.4949571799101116
Energy: 1.517743809664055
Energy: 1.4949571799101116
Energy: 1.5045498834625093
Energy: 1.6094871441561807
Energy: 1.5035867395537474
Energy: 1.6094871441561807
Energy: 1.517608574305079
Energy: 1.5729948245438101
Energy: 1.500160184950799
Energy: 1.5729948245438101
Energy: 1.699689177576555
Energy: 1.988918704099929
Energy: 1.4906875966692634
Energy: 1.988918704099929
Energy: 1.4999339861422196
Energy: 1.7586228737781755
Energy: 1.4974534316395764
Energy: 1.7586228737766418
Energy: 1.714807211787512
Energy: 1.5517661408962902
Energy: 1.5047478571075752
Energy: 1.5517661408947563
Energy: 1.5040285234441235
Energy: 1.7818305792824631
Energy: 1.8945236218326753
Energy: 1.7818305792839968
Energy: 1.4999177851346037
Energy: 1.497625805544303
Energy: 1.7128481159061293
Energy: 1.4976258055657754
Energy: 1.7108880815027765
Energy: 1.5211278400764958
Energy: 1.4998666178266529
Energy: 1.5211278376588795
Energy: 1.499743778437718
Energy: 1.5134929117320777
Energy: 1.4906480614530186
Energy: 1.5134929106604866
Energy: 1.517581232265249
Energy: 1.7832436310878237
Energy: 1.6991035489674962
Energy: 1.7832436310847561
Energy: 1.4946579659644772
Energy: 1.5241369359608814
Energy: 1.5043711245810276
Energy: 1.524136938381565
Energy: 1.5004668857587125
Energy: 1.570494150091781
Energy: 1.7134085887957
Energy: 1.570494150091781

minimum gb energy = 1.4892579440961735 eV
minimum distance =  2.35730479197909 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 1.7414659093269929
Energy: 1.7399577682718184
Energy: 1.991301009694518
Energy: 1.7399577682778986
Energy: 1.7427252177877004
Energy: 1.6025530355120263
Energy: 1.537285456209853
Energy: 1.6025530355120263
Energy: 1.741708198678423
Energy: 1.539904813058881
Energy: 1.5505639267542055
Energy: 1.539904813054538
Energy: 1.539538549583365
Energy: 1.706036136654559
Energy: 1.6587645696892412
Energy: 1.706036136714495
Energy: 1.7518774441766554
Energy: 1.5448662333623184
Energy: 1.5516442320563855
Energy: 1.5448662332685454
Energy: 1.5315496570069929
Energy: 1.5532759512117136
Energy: 1.7555893628064652
Energy: 1.5532759512125822
Energy: 1.5427387515897384
Energy: 1.5988593775378606
Energy: 1.5393364940627763
Energy: 1.598859377526608
Energy: 1.7489348792204082
Energy: 1.5307868059731364
Energy: 1.5393796509038853
Energy: 1.5307868059774798
Energy: 1.5344097396037555
Energy: 1.6384390507768753
Energy: 1.7914608187843866
Energy: 1.6384390507803501
Energy: 1.895901089830835
Energy: 1.5450501132781764
Energy: 1.5461648012140472
Energy: 1.545050113279914
Energy: 1.5424622804945813
Energy: 1.5326743740418134
Energy: 1.7456485420137409
Energy: 1.5326743741043154
Energy: 1.5363975682235338
Energy: 1.5999395493392783
Energy: 1.5368096558656854
Energy: 1.5999395493401471
Energy: 1.769212715424069
Energy: 1.5319912804616695
Energy: 1.5290340330237444
Energy: 1.5319912804634066
Energy: 1.5460827670201909
Energy: 1.622106339368794
Energy: 1.7484627351968332
Energy: 1.622106339368794
Energy: 1.6522599034386234
Energy: 1.600300512048947
Energy: 1.5346333394879201
Energy: 1.600300512048947
Energy: 1.7489443231798574
Energy: 1.6569474259021866
Energy: 1.7490655997835571
Energy: 1.6569474258935002
Energy: 1.5388548681078653
Energy: 1.6363057438666408
Energy: 1.8995846548776518
Energy: 1.6363057438666408
Energy: 1.759566964611282
Energy: 1.5412987639297973
Energy: 1.531554847976079
Energy: 1.541298763925454
Energy: 1.5386698744697256
Energy: 1.7077829319396733
Energy: 1.6612137916254623
Energy: 1.707782931940542
Energy: 1.5387544736696175
Energy: 1.7028185197364811
Energy: 1.539557617218198
Energy: 1.7028185197364811
Energy: 1.6565127751422322
Energy: 1.543171250414942
Energy: 1.7416333835104731
Energy: 1.5431712504236281
Energy: 1.5391249368798983
Energy: 1.7134404851646006
Energy: 1.8979064351764232
Energy: 1.713440485163732
Energy: 1.7985008480091593
Energy: 1.5344125965162017
Energy: 1.5376813564020666
Energy: 1.5344125965205446
Energy: 1.5303997676458245
Energy: 1.5988661626121297
Energy: 1.7429221873823713
Energy: 1.5988661626129983
Energy: 1.5287167641660722
Energy: 1.5400795328157384
Energy: 1.7652131079412385
Energy: 1.5400795328148695
Energy: 1.7971596072468774
Energy: 1.532560334203199
Energy: 1.5394822337703569
Energy: 1.532560334205805
Energy: 1.5513718592673238
Energy: 1.852017162684628
Energy: 1.9088733197041348
Energy: 1.852017162684628
Energy: 1.7558052079606141
Energy: 1.5538496064962841
Energy: 1.7429083004374215
Energy: 1.55384960649889
Energy: 1.7934173770743786
Energy: 1.706351453845543
Energy: 1.5422680474464272
Energy: 1.7063514538438058
Energy: 1.5364996463353215
Energy: 1.6403994549509653
Energy: 1.7620986930791027
Energy: 1.640399454951834

minimum gb energy = 1.5287167641660722 eV
minimum distance =  2.34925434415678 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 1.4907705313983848
Energy: 1.4903065563826543
Energy: 1.9665910219599954
Energy: 1.4903065563846538
Energy: 1.7875340096770445
Energy: 1.6187211759416782
Energy: 1.509022955413029
Energy: 1.6187211759396785
Energy: 1.4928950556080978
Energy: 1.4911183364830911
Energy: 1.7996229302022133
Energy: 1.491118336485091
Energy: 1.492961083614511
Energy: 1.4907847701478276
Energy: 1.6965482888596812
Energy: 1.490784770145828
Energy: 1.787257378341034
Energy: 1.6186761307674242
Energy: 1.5395730659669236
Energy: 1.6186761307774227
Energy: 1.490770531396385
Energy: 1.4903065563866538
Energy: 2.070010799062361
Energy: 1.4903065563866538
Energy: 1.7875340096790442
Energy: 1.6187211759436777
Energy: 1.6957951363548989
Energy: 1.6187211759416782
Energy: 1.4928950556080978
Energy: 1.4911183364810914
Energy: 1.7996229302002138
Energy: 1.4911183364830911
Energy: 1.492961083614511
Energy: 1.490784770145828
Energy: 1.8206658779102949
Energy: 1.490784770143828
Energy: 1.7872573783430339
Energy: 1.6186761307694237
Energy: 1.7252488674167759
Energy: 1.6186761307734232
Energy: 1.4907705313983848
Energy: 1.4903065563826543
Energy: 2.070010799058361
Energy: 1.4903065563846538
Energy: 1.7875340096750447
Energy: 1.6187211759436777
Energy: 1.799882394953974
Energy: 1.6187211759416782
Energy: 1.4928950556080978
Energy: 1.4911183364830911
Energy: 1.7996229302022133
Energy: 1.491118336485091

minimum gb energy = 1.4903065563826543 eV
minimum distance =  2.34216885939758 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 1.5939303868893357
Energy: 1.835876158116447
Energy: 2.168573555818823
Energy: 1.8358761580868417
Energy: 1.8424981437988053
Energy: 1.6547184770076826
Energy: 1.615862155754116
Energy: 1.654718477008423
Energy: 1.6013088534609152
Energy: 1.5975541801508406
Energy: 1.6239520477013782
Energy: 1.5975541801478803
Energy: 1.810128539915044
Energy: 1.8759112677435796
Energy: 1.614707781046873
Energy: 1.8759112677376588
Energy: 1.843219198067063
Energy: 1.6500934904390143
Energy: 1.6207509763144423
Energy: 1.6500934904390143
Energy: 1.5984748358881073
Energy: 1.5975525877532455
Energy: 1.8298888665675141
Energy: 1.5975525877539858
Energy: 2.1217105096055144
Energy: 1.6529384516003907
Energy: 1.6110422502379012
Energy: 1.6529384516018708
Energy: 1.5938581355126284
Energy: 1.8736221388028655
Energy: 1.8196417241704597
Energy: 1.8736221388028655
Energy: 1.6044636002186423
Energy: 1.8729474106545219
Energy: 1.6113375262932066
Energy: 1.8729474106515611
Energy: 1.6041629995730178
Energy: 1.6490596586638253
Energy: 1.6071217927079953
Energy: 1.649059658663085
Energy: 1.5960957688374835
Energy: 1.8762591209880535
Energy: 2.13179080954598
Energy: 1.8762591209843527
Energy: 1.8207947711165235
Energy: 1.9418720713562774
Energy: 1.6084503523093772
Energy: 1.9418720713518367
Energy: 1.6055731510022737
Energy: 1.7138286304644408
Energy: 1.9639198502076218
Energy: 1.7138286304644408
Energy: 1.8148178807722533
Energy: 1.9707022351828354
Energy: 1.6021545456320632
Energy: 1.9707022351783943
Energy: 1.5983926485705493
Energy: 1.7620825411633778
Energy: 1.809493872573875
Energy: 1.762082541168559
Energy: 1.6096344328474796
Energy: 1.873022679848524
Energy: 1.8245169683313303
Energy: 1.8730226798448235
Energy: 1.710639968704278
Energy: 1.762212502356098
Energy: 1.5992272805695484
Energy: 1.762212502356098
Energy: 1.6002728859069901
Energy: 1.6544709869345153
Energy: 1.8372470221117052
Energy: 1.6544709869352556
Energy: 1.8569314079726353
Energy: 1.7137216495062828
Energy: 1.6017306401949156
Energy: 1.7137216495136842
Energy: 1.6088122129240345
Energy: 1.6452097199952826
Energy: 1.709663524442649
Energy: 1.6452097199997233
Energy: 1.8187039125893516
Energy: 1.8752873778217178
Energy: 1.812662881954665
Energy: 1.8752873778194976
Energy: 1.712998765665624
Energy: 1.7542514207592008
Energy: 1.6038837774508667
Energy: 1.754251420760681
Energy: 1.611206689075886
Energy: 1.76728929381724
Energy: 1.6040820197805448
Energy: 1.7672892938150198
Energy: 2.1739394921302915
Energy: 1.7128862003878456
Energy: 1.593271596925846
Energy: 1.712886200310131
Energy: 1.612799108531097
Energy: 1.9399019846286572
Energy: 1.9761600227805867
Energy: 1.9399019846264365
Energy: 1.7311935983398403
Energy: 1.5981771907411653
Energy: 1.6020641430542593
Energy: 1.5981771907581213
Energy: 1.8141580746228128
Energy: 1.7963363471656855
Energy: 1.8101549130650814
Energy: 1.7963363471693863
Energy: 1.610108817171544
Energy: 1.8764288510524831
Energy: 1.8106583483629763
Energy: 1.8764288510532234
Energy: 1.7173731944963426
Energy: 1.5973017353209995
Energy: 1.6008935550160557
Energy: 1.597301735318779
Energy: 1.6142978655766405
Energy: 1.9391677377267453
Energy: 1.9775908999580942
Energy: 1.9391677377274856
Energy: 2.0468050039157264
Energy: 1.7129106308981628
Energy: 1.5919299517811782
Energy: 1.7129106308966822
Energy: 1.6156727609198651
Energy: 1.6552074993318873
Energy: 1.6024351529385978
Energy: 1.6552074993333674
Energy: 1.6155881561766974
Energy: 1.7549978063734173
Energy: 1.6020380296609753
Energy: 1.7549978063756377
Energy: 1.8200630883785052
Energy: 1.8746900950545535
Energy: 1.8101215528982304
Energy: 1.8746900950538135
Energy: 1.6202115575764968
Energy: 1.7532992858441325
Energy: 2.1231953788828726
Energy: 1.7532992858441325

minimum gb energy = 1.5919299517811782 eV
minimum distance =  2.30003847744727 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 1.728316398326279
Energy: 1.71067057052559
Energy: 2.1907714114865016
Energy: 1.710670570516196
Energy: 1.6924424220320267
Energy: 1.6585186513681478
Energy: 1.5961262120269026
Energy: 1.6585186513681478
Energy: 1.6075230463782417
Energy: 1.9081793866911658
Energy: 1.600682579205608
Energy: 1.9081793866923402
Energy: 1.623103867530672
Energy: 1.7923841121056998
Energy: 1.5937916150528462
Energy: 1.7923841121021769
Energy: 1.7194494891367078
Energy: 1.6741556550629229
Energy: 1.6014724529156117
Energy: 1.6741556550617485
Energy: 1.609673893685183
Energy: 1.907242189229065
Energy: 2.002317593001321
Energy: 1.9072421892278908
Energy: 2.078257098186853
Energy: 1.756817302992797
Energy: 1.6036245332917403
Energy: 1.7568173029951455
Energy: 1.6219992375398498
Energy: 1.599432454978555
Energy: 1.9681459662680139
Energy: 1.5994324549762065
Energy: 2.0855347903327526
Energy: 1.5943547068051172
Energy: 1.5960019058780974
Energy: 1.5943547068039428
Energy: 1.60608562569095
Energy: 1.6793947592811205
Energy: 1.6057273277604867
Energy: 1.6793947592799459
Energy: 1.6205331243412981
Energy: 1.5946785595870667
Energy: 1.9623558093624915
Energy: 1.5946785595847182
Energy: 1.8472064327979076
Energy: 1.7928147454375223
Energy: 1.62513465517331
Energy: 1.7928147454351737
Energy: 1.5967085536562635
Energy: 1.6808698977600973
Energy: 1.8825308413633985
Energy: 1.680869897758923
Energy: 2.027236964734725
Energy: 1.798247176844054
Energy: 1.606050295918651
Energy: 1.7982471768428796
Energy: 1.6072096201403911
Energy: 1.7824388698574791
Energy: 1.9256167781690803
Energy: 1.782438869862176
Energy: 1.9722066074393705
Energy: 1.5951709162151773
Energy: 1.6224900201473391
Energy: 1.5951709162151773
Energy: 1.7023907293636549
Energy: 1.6994013253171085
Energy: 1.608116933252973
Energy: 1.6994013253159341
Energy: 1.702208943254393
Energy: 1.7923407073132938
Energy: 1.6085593679634238
Energy: 1.7923407073121196
Energy: 1.6253643739885317
Energy: 1.601443226358051
Energy: 1.6210481600204463
Energy: 1.601443226358051
Energy: 1.5970862824536005
Energy: 1.7194026955502701
Energy: 2.0276995135798956
Energy: 1.7194026955502701
Energy: 2.0236464159647674
Energy: 1.5969397612337053
Energy: 1.6100796298530493
Energy: 1.5969397612337053
Energy: 1.593926997152855
Energy: 1.6672173907560353
Energy: 1.7554837557529948
Energy: 1.6672173907572099

minimum gb energy = 1.5937916150528462 eV
minimum distance =  2.29911590841541 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 1.635521264413807
Energy: 1.632192920972064
Energy: 2.196050785813591
Energy: 1.632192920972064
Energy: 2.031074333299373
Energy: 1.6433301683651567
Energy: 1.5877135269657412
Energy: 1.643330168368478
Energy: 1.6211183022662246
Energy: 1.8701963520826748
Energy: 1.6495640332204253
Energy: 1.8701963520835052
Energy: 1.6851384307034147
Energy: 1.6828153935953456
Energy: 1.5876866726236103
Energy: 1.6828153935928545
Energy: 1.6221277288357663
Energy: 1.667575629056647
Energy: 1.6183117426946372
Energy: 1.6675756290583077
Energy: 1.5999510262810588
Energy: 1.6305158723672246
Energy: 2.032119674792709
Energy: 1.6305158723622426
Energy: 1.8258012062293512
Energy: 1.8315464298710364
Energy: 1.623006811217506
Energy: 1.831546429874358
Energy: 1.5997694823519166
Energy: 1.6327484932999534
Energy: 2.0074753314006335
Energy: 1.6327484933024443
Energy: 1.8710207700606571
Energy: 1.6899866867672726
Energy: 1.5917653843254995
Energy: 1.6899866867656121
Energy: 1.600100284903154
Energy: 1.6924062823060044
Energy: 1.8164706503967256
Energy: 1.692406282310156
Energy: 1.670634299084259
Energy: 1.8606733774948652
Energy: 1.651776102109016
Energy: 1.8606733774981863
Energy: 1.641726539137884
Energy: 1.6684720502747716
Energy: 1.673909034782165
Energy: 1.6684720502814145
Energy: 1.6339646340761607
Energy: 1.630955472090307
Energy: 1.664382670930481
Energy: 1.6309554720894763
Energy: 1.6474616534327082
Energy: 1.6448627852663469
Energy: 1.6742395925616813
Energy: 1.6448627852663469
Energy: 1.595301714567148
Energy: 1.8221490727493175
Energy: 1.8277607245935903
Energy: 1.8221490727543
Energy: 2.195760460206634
Energy: 1.645151794677962
Energy: 1.6282997626710256
Energy: 1.6451517946704888
Energy: 1.5955332986187092
Energy: 1.6633005708849855
Energy: 1.6926657184502756
Energy: 1.6633005708849855
Energy: 1.6207584100915382
Energy: 1.6539998650854508
Energy: 1.673123191523806
Energy: 1.6539998650871117
Energy: 1.595476772290632
Energy: 1.8605785690257186
Energy: 1.6551618076190455
Energy: 1.8605785690282097
Energy: 1.6002239206101954
Energy: 1.6686690255842234
Energy: 1.672612629033434
Energy: 1.6686690255809018
Energy: 1.6717159302976445
Energy: 1.8616407967336481
Energy: 1.5913521478872685
Energy: 1.8616407967319872
Energy: 1.5997525151014726
Energy: 1.873824907982374
Energy: 1.8276223975100792
Energy: 1.8738249079815439
Energy: 2.014982975860218
Energy: 1.824700092199404
Energy: 1.6376038064031135
Energy: 1.8247000921985737
Energy: 1.632193604238451
Energy: 1.630479665086541
Energy: 2.0394469582753043
Energy: 1.6304796650873712
Energy: 1.636436362571711
Energy: 1.6695852742189174
Energy: 1.6189268303054034
Energy: 1.6695852742122745
Energy: 1.6812264574983884
Energy: 1.8625115867020627
Energy: 1.646635654720096
Energy: 1.8625115867004018
Energy: 1.6073739455263325
Energy: 1.6886434486700035
Energy: 1.7336375847348189
Energy: 1.6886434486791368
Energy: 1.6861312788039038
Energy: 1.6634851973317102
Energy: 1.587476223969705
Energy: 1.663485197326728
Energy: 1.6330100610336835
Energy: 1.6331688763069294
Energy: 1.8773288365181888
Energy: 1.633168876306099
Energy: 1.6451486393653554
Energy: 1.5847545606105222
Energy: 1.5874753697715385
Energy: 1.58475456060554
Energy: 1.6330470976056795
Energy: 1.6333002940788424
Energy: 1.9729455176556214
Energy: 1.6333002940813335

minimum gb energy = 1.58475456060554 eV
minimum distance =  2.28782618829554 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 1.540557751213766
Energy: 1.596347166454052
Energy: 1.5761199875019576
Energy: 1.596347166454052
Energy: 1.5490873832713905
Energy: 1.5432960462397136
Energy: 1.5356106848356752
Energy: 1.5432960462388778
Energy: 1.5496377432000321
Energy: 1.5976110496790024
Energy: 1.5465778041417564
Energy: 1.5976110496784237
Energy: 1.5418625742429273
Energy: 1.6097333000074507
Energy: 1.5351432274957248
Energy: 1.6097333000065828
Energy: 1.538890499418366
Energy: 1.610647246349901
Energy: 1.5463781568215145
Energy: 1.6106472463504795
Energy: 1.5962700455455454
Energy: 1.611084649566079
Energy: 1.5963347131063086
Energy: 1.6110846495663684
Energy: 1.5960892474385757
Energy: 1.6102007897024384
Energy: 1.5388949263266056
Energy: 1.6102007897024384
Energy: 1.5350402744067302
Energy: 1.609591071442346
Energy: 1.5397212512321368
Energy: 1.6095910714415107
Energy: 1.5479319479002
Energy: 1.599593897827547
Energy: 1.549851873831776
Energy: 1.599593897828093

minimum gb energy = 1.5350402744067302 eV
minimum distance =  2.31489439018157 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 1.4651132794130237
Energy: 1.4786660249231853
Energy: 1.8635723464685108
Energy: 1.4786660249255383
Energy: 1.4836546968620423
Energy: 1.482924979310865
Energy: 1.477343275660942
Energy: 1.482924979192426
Energy: 1.4654509635351005
Energy: 1.4861606026384282
Energy: 1.7725364444523901
Energy: 1.4861606026376437
Energy: 1.4942145658421049
Energy: 1.5246825058937725
Energy: 1.4551692583555342
Energy: 1.5246825058937725
Energy: 1.4628712485725786
Energy: 1.5243616466831262
Energy: 1.7975104340054358
Energy: 1.5243616466846948
Energy: 1.5044075773089565
Energy: 1.482093077484078
Energy: 1.4567107493331086
Energy: 1.4820930774848624
Energy: 1.4647495131386818
Energy: 1.5224043374461296
Energy: 1.483541051486075
Energy: 1.5224043374461296
Energy: 1.461608375010405
Energy: 1.4814947197970751
Energy: 1.476960785662661
Energy: 1.4814947197955062
Energy: 1.461195641050301
Energy: 1.5230125780183617
Energy: 1.4771554451892739
Energy: 1.5230125780175774
Energy: 1.4601686628305042
Energy: 1.522890861186357
Energy: 1.4898523878692977
Energy: 1.522890861187141
Energy: 1.499835664587752
Energy: 1.482251348794526
Energy: 1.4763451709047357
Energy: 1.4822513488000166
Energy: 1.4782612892822709
Energy: 1.5332158166575307
Energy: 1.5614667107711269
Energy: 1.5332158166590995
Energy: 1.5033707703738677
Energy: 1.4806231174599684
Energy: 1.4751603723017372
Energy: 1.4806231174576157
Energy: 1.4625791083823927
Energy: 1.4796047640612788
Energy: 1.4832833109361125
Energy: 1.4796047640581416
Energy: 1.4777329505294052
Energy: 1.5272326392181355
Energy: 1.4763086185940597
Energy: 1.527232639217351
Energy: 1.4587800840142062
Energy: 1.4862347619768386
Energy: 1.5059249897302722
Energy: 1.486234761976054
Energy: 1.7745779600600184
Energy: 1.5371387883541634
Energy: 1.4632062376840065
Energy: 1.5371387883541634
Energy: 1.4610541683162024
Energy: 1.4795660704861529
Energy: 1.559990125847316
Energy: 1.4795660704830151
Energy: 1.4635939487279792
Energy: 1.5243398802762078
Energy: 1.4595360466401068
Energy: 1.5243398802777768
Energy: 1.4655425961562734
Energy: 1.5065648610143605
Energy: 1.4805985004426914
Energy: 1.506564860964161
Energy: 1.4919857710307027
Energy: 1.523253890563874
Energy: 1.4573371642154784
Energy: 1.5232538905662272
Energy: 1.480287628945624
Energy: 1.522761383329272
Energy: 1.4633023319895138
Energy: 1.522761383329272
Energy: 1.4565733118260342
Energy: 1.4803622767389462
Energy: 1.46842509338151
Energy: 1.4803622767373774
Energy: 1.4920221189054046
Energy: 1.472199120239532
Energy: 1.4817658904849806
Energy: 1.4721991202403162
Energy: 1.4862292243645403
Energy: 1.4719410157167359
Energy: 1.4789168730853297
Energy: 1.4719410157190889
Energy: 1.4753267728555741
Energy: 1.4802955072108237
Energy: 1.4612494344308804
Energy: 1.4802955072123927
Energy: 1.456179227081668
Energy: 1.5243542798735175
Energy: 1.4905575738499925
Energy: 1.5243542798727334
Energy: 1.5346847226263705
Energy: 1.5289803902426793
Energy: 1.4583399581091454
Energy: 1.5289803902450323
Energy: 1.479841901730163
Energy: 1.4848033335564743
Energy: 1.4671232549042257
Energy: 1.4848033335211779
Energy: 1.6863373736670184
Energy: 1.4791690505659725
Energy: 1.4610224307822872
Energy: 1.479169050565188
Energy: 1.4570716244314432
Energy: 1.469800129660267
Energy: 1.6849665010002148
Energy: 1.4698001296626202
Energy: 1.7449883453208503
Energy: 1.5060941053279768
Energy: 1.46593636871121
Energy: 1.5060941053193486
Energy: 1.46045761108771
Energy: 1.483197559980657
Energy: 1.4707104491918286
Energy: 1.483197559980657

minimum gb energy = 1.4551692583555342 eV
minimum distance =  2.28960807604344 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 1.6595806669993602
Energy: 1.401875094226568
Energy: 1.84115937240285
Energy: 1.4018750942298217
Energy: 1.4263422161614492
Energy: 1.4693808953596559
Energy: 1.3760543420152387
Energy: 1.4693808953607406
Energy: 1.3894950941773716
Energy: 1.4073515114102826
Energy: 1.712203074099179
Energy: 1.4073515114135362
Energy: 1.4069009685338276
Energy: 1.4685028806136189
Energy: 1.389748624182194
Energy: 1.4685028806136189
Energy: 1.3870069462937618
Energy: 1.4849800804971942
Energy: 1.770907018119
Energy: 1.4849800804961097
Energy: 1.3813209267471152
Energy: 1.4095101252374667
Energy: 1.3876875170115226
Energy: 1.4095101252363818
Energy: 1.3928440398406567
Energy: 1.4859134265682943
Energy: 1.443069478242555
Energy: 1.4859134265682943
Energy: 1.3928660491299987
Energy: 1.4091263111744605
Energy: 1.4289897319608158
Energy: 1.4091263111766297
Energy: 1.4166874877223365
Energy: 1.4047191253113094
Energy: 1.3994743549323794
Energy: 1.4047191253113094
Energy: 1.417574547035929
Energy: 1.6590087324830665
Energy: 1.4692426124865816
Energy: 1.6590087324830665
Energy: 1.3925318443235908
Energy: 1.4092995484403692
Energy: 1.399968474431197
Energy: 1.4092995484447073
Energy: 1.39367000289269
Energy: 1.485482825360029
Energy: 1.6183155933873286
Energy: 1.4854828253621981
Energy: 1.3810932164600862
Energy: 1.4096127475059879
Energy: 1.3849190261098765
Energy: 1.4096127475049034
Energy: 1.3810517254706125
Energy: 1.4020108119395567
Energy: 1.4821192233137253
Energy: 1.4020108119395567
Energy: 1.400893698341328
Energy: 1.4698574071373662
Energy: 1.389084476422194
Energy: 1.4698574071341126
Energy: 1.3894536752076818
Energy: 1.4075068943173998
Energy: 1.7109546617109648
Energy: 1.4075068943163151
Energy: 1.6204095726811183
Energy: 1.4151190210838047
Energy: 1.3792531543925226
Energy: 1.4151190210848892
Energy: 1.6595806669993602
Energy: 1.401875094226568
Energy: 1.841337086235737
Energy: 1.4018750942157228
Energy: 1.4263422161777168
Energy: 1.4693808953607406
Energy: 1.3760543420130695
Energy: 1.4693808953596559
Energy: 1.3894950941773716
Energy: 1.4073515114135362
Energy: 1.7122030741002636
Energy: 1.4073515114157051
Energy: 1.4069009685359966
Energy: 1.4685028806136189
Energy: 1.3897486241811094
Energy: 1.4685028806147036
Energy: 1.387006946292677
Energy: 1.4849800804993636
Energy: 1.7709070181200846
Energy: 1.4849800804982791
Energy: 1.3813209267481998
Energy: 1.4095101252363818
Energy: 1.387687517012607
Energy: 1.4095101252363818
Energy: 1.3928440398406567
Energy: 1.4859134265704632
Energy: 1.4430694782458082
Energy: 1.485913426571548

minimum gb energy = 1.3760543420130695 eV
minimum distance =  2.30067325950206 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 1.3616471343314187
Energy: 1.3624980414844496
Energy: 1.9321245095562964
Energy: 1.3624980414844496
Energy: 1.6938310365376748
Energy: 1.3544587274339823
Energy: 1.3492814069340082
Energy: 1.3544587274326416
Energy: 1.345382929771919
Energy: 1.362175089034486
Energy: 1.8230091420370946
Energy: 1.362175089036497
Energy: 1.4226247385163597
Energy: 1.341282753354379
Energy: 1.3433128600116482
Energy: 1.3412827533610823
Energy: 1.3488582681993766
Energy: 1.4122560972537652
Energy: 1.6156631005345838
Energy: 1.412256097253095
Energy: 1.3532388101623638
Energy: 1.3430563416419519
Energy: 1.3455960258107553
Energy: 1.3430563416453032
Energy: 1.3553640161931573
Energy: 1.4081384191295667
Energy: 1.4235864088093988
Energy: 1.4081384191302373
Energy: 1.3446955752930494
Energy: 1.6555922559094733
Energy: 1.3560058513821371
Energy: 1.6555922559114842
Energy: 1.3701906359207194
Energy: 1.6490134966667265
Energy: 1.3623943736028916
Energy: 1.6490134966680674
Energy: 1.3742561427817606
Energy: 1.6481587978130983
Energy: 1.3479494171442947
Energy: 1.6481587978137686
Energy: 1.3456496271350809
Energy: 1.6441668922554
Energy: 1.3513133160635453
Energy: 1.6441668922594217
Energy: 1.3495117749741452
Energy: 1.3989223468607292
Energy: 1.3647459571541687
Energy: 1.3989223468634104
Energy: 1.3514016490655976
Energy: 1.6476353900130267
Energy: 1.3544595952101088
Energy: 1.6476353900136969
Energy: 1.361443994712175
Energy: 1.4116015584292452
Energy: 1.3746943945872814
Energy: 1.4116015586014554
Energy: 1.3628930028441961
Energy: 1.6401371024625895
Energy: 1.368472191736852
Energy: 1.6401371024599085
Energy: 1.345432773802384
Energy: 1.3624955871298705
Energy: 1.801555712507717
Energy: 1.3624955871292
Energy: 1.3642080519967066
Energy: 1.637656782812811
Energy: 1.3537167949312863
Energy: 1.6376567828114705
Energy: 1.3404697423560676
Energy: 1.363518030419132
Energy: 1.364721516087461
Energy: 1.3635180304198025
Energy: 1.59489988733936
Energy: 1.4017516799471765
Energy: 1.3478506273446398
Energy: 1.4017516799525391
Energy: 1.3423931678127172
Energy: 1.3634637451468654
Energy: 1.698666858156405
Energy: 1.3634637451475358
Energy: 1.3462675416090528
Energy: 1.3522284611363269
Energy: 1.3571821479266861
Energy: 1.352228461134316
Energy: 1.3396219090888044
Energy: 1.6526166505668278
Energy: 1.634959373397206
Energy: 1.6526166505688387
Energy: 1.6194520725859782
Energy: 1.3429152231512826
Energy: 1.343787373949432
Energy: 1.3429152231532933
Energy: 1.3449593586486892
Energy: 1.4094757664573123
Energy: 1.628426647071325
Energy: 1.4094757664586528
Energy: 1.380009908093021
Energy: 1.364697813585133
Energy: 1.3418756776640195
Energy: 1.364697813585133
Energy: 1.358017989853497
Energy: 1.412654763004748
Energy: 1.391513448108869
Energy: 1.4126547630060884
Energy: 1.6618088811720395
Energy: 1.6477811829559952
Energy: 1.346335605721816
Energy: 1.6477811829546547
Energy: 1.372023684675215
Energy: 1.64362712030465
Energy: 1.3583163629711794
Energy: 1.6436271203092812
Energy: 1.374197535665413
Energy: 1.4110711626673642
Energy: 1.34806327620565
Energy: 1.4110711626660235
Energy: 1.3386126554077127
Energy: 1.6464788347194952
Energy: 1.3965126134909243
Energy: 1.6464788347201655
Energy: 1.3539210409227107
Energy: 1.4108112884952568
Energy: 1.3495642707544344
Energy: 1.410811288493916
Energy: 1.3412611052048649
Energy: 1.645490013089752
Energy: 1.342648428477472
Energy: 1.6454900130917631
Energy: 1.3466179280795099
Energy: 1.6481578112012796
Energy: 1.6721707360509592
Energy: 1.648157811199939
Energy: 1.4061646207974308
Energy: 1.647690713775922
Energy: 1.3453672808228772
Energy: 1.6476907137739107
Energy: 1.34880958090828
Energy: 1.363374640523529
Energy: 1.3784889936256084
Energy: 1.363374640523529
Energy: 1.4196506192696472
Energy: 1.409233568006937
Energy: 1.3538829487837598
Energy: 1.4092335680062666
Energy: 1.343992397040079
Energy: 1.3426978402117808
Energy: 1.3563662517463615
Energy: 1.3426978402198246
Energy: 1.3526653398638795
Energy: 1.4129362502952039
Energy: 1.3575668779283618
Energy: 1.412936250293193

minimum gb energy = 1.3386126554077127 eV
minimum distance =  2.29382961393909 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 1.2060310505183462
Energy: 1.2075801364790861
Energy: 2.3844118689640816
Energy: 1.2075801364773324
Energy: 1.2080098728154225
Energy: 1.2149096928793768
Energy: 1.2131887370339645
Energy: 1.2149096928793768
Energy: 1.2123691731901904
Energy: 1.305647502615656
Energy: 2.3838940248461973
Energy: 1.3056475026734944
Energy: 1.2199930446105773
Energy: 1.2146899867135177
Energy: 1.2132871074634979
Energy: 1.2146899867135177
Energy: 1.2135817306981143
Energy: 1.2902303293453272
Energy: 1.2104607561533878
Energy: 1.2902303293453272
Energy: 1.213823877460909
Energy: 1.207430411453608
Energy: 1.2088139142620775
Energy: 1.2074304114553616
Energy: 1.2122690175266138
Energy: 1.3051465205492738
Energy: 1.2149296232446591
Energy: 1.305146520531735
Energy: 1.2560268202476668
Energy: 1.3051992836109834
Energy: 1.2134645566054438
Energy: 1.305199283654791
Energy: 1.2140765334591612
Energy: 1.2915933932949701
Energy: 1.2215051676135975
Energy: 1.2915933932949701
Energy: 1.2182623502553873
Energy: 1.286709535660438
Energy: 1.2090754220828899
Energy: 1.286709535674469
Energy: 1.2125788090121883
Energy: 1.2157437317709456
Energy: 1.2165873105078036
Energy: 1.2157437317709456
Energy: 1.207118422344236
Energy: 1.3053025306680635
Energy: 1.2138277520150167
Energy: 1.3053025306628019
Energy: 1.2069765033645554
Energy: 1.209304708869679
Energy: 1.2214355827202827
Energy: 1.2093047088679252
Energy: 1.209324235030455
Energy: 1.288840886897705
Energy: 1.2090781599789329
Energy: 1.2888408868959509
Energy: 1.2225534637962552
Energy: 1.2090244877586827
Energy: 1.2071014692203765
Energy: 1.2090244877586827

minimum gb energy = 1.2060310505183462 eV
minimum distance =  2.31212107009736 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 1.1243165883720323
Energy: 1.1151743820764681
Energy: 1.8043439103497994
Energy: 1.1151743821815236
Energy: 1.1483013685115533
Energy: 1.1217691668710221
Energy: 1.120255488053621
Energy: 1.121769166864406
Energy: 1.1154874266508248
Energy: 1.1151944679811785
Energy: 1.8643736502420214
Energy: 1.1151944679870593
Energy: 1.1270438770450977
Energy: 1.1220704245476514
Energy: 1.1182174366610247
Energy: 1.1220704245373596
Energy: 1.11931961432211
Energy: 1.1715174259121626
Energy: 1.1248443491477373
Energy: 1.1715174259056134
Energy: 1.1344920817857322
Energy: 1.1223635412449244
Energy: 1.1212936833583962
Energy: 1.122363541241249
Energy: 1.118794256425379
Energy: 1.172208649126936
Energy: 1.168075708507387
Energy: 1.1722086491284063
Energy: 1.1334393525898703
Energy: 1.1226381801930498
Energy: 1.1211158657985503
Energy: 1.1226381801856984
Energy: 1.122645792654352
Energy: 1.1715922180272864
Energy: 1.4020092672063411
Energy: 1.171592218014789
Energy: 1.4513527831431872
Energy: 1.1772491748404352
Energy: 1.1180264306432286
Energy: 1.1772491748374947
Energy: 1.1240670174797633
Energy: 1.177667226113175
Energy: 1.131552215140382
Energy: 1.1776672261139103
Energy: 1.6464890632395188
Energy: 1.1776832909696102
Energy: 1.116324878731679
Energy: 1.1776832909666697
Energy: 1.1321583431654711
Energy: 1.1206866498748154
Energy: 1.1323212922703907
Energy: 1.1206866498814316
Energy: 1.746978059238706
Energy: 1.1776194658569545
Energy: 1.1172421693048404
Energy: 1.177619465853279
Energy: 1.123294283105188
Energy: 1.11560951287638
Energy: 1.1267928273879564
Energy: 1.1156095128852017
Energy: 1.1515495051851738
Energy: 1.1784041928421856
Energy: 1.1204503018083627
Energy: 1.1784041928568878
Energy: 1.1430655473427171
Energy: 1.115492146036775
Energy: 1.1207755734374016
Energy: 1.1154921460478018
Energy: 1.130357201403301
Energy: 1.170844691389134
Energy: 1.1261798389018027
Energy: 1.17084469139722
Energy: 1.1432400587850264
Energy: 1.1209131315774863
Energy: 1.1271863734442467
Energy: 1.1209131315635859
Energy: 1.1432580932221508
Energy: 1.121059717456303
Energy: 1.127978668369569
Energy: 1.1210597174533625
Energy: 1.1304710006945502
Energy: 1.1708641791938013
Energy: 1.1257219647804746
Energy: 1.1708641791901253
Energy: 1.143303472699045
Energy: 1.1153893016430385
Energy: 1.1203696186765872
Energy: 1.1153893016378926
Energy: 1.1517759379292491
Energy: 1.1780681140305282
Energy: 1.1209614072239864
Energy: 1.1780681140187663
Energy: 1.1221175029505965
Energy: 1.1155996347081072
Energy: 1.132251192035296
Energy: 1.1155996347044315
Energy: 1.7055016042788023
Energy: 1.1780074828369054
Energy: 1.1182627756662173
Energy: 1.1780074828347002
Energy: 1.1314538545333608
Energy: 1.1204597496417539
Energy: 1.1613315166399085
Energy: 1.120459749641019
Energy: 1.6466564222939555
Energy: 1.1774144188360582
Energy: 1.117219629098772
Energy: 1.1774144188316473
Energy: 1.1232364869477167
Energy: 1.1775842082427104
Energy: 1.161447675957777
Energy: 1.1775842082412402
Energy: 1.4514578378559384
Energy: 1.1769974674326007
Energy: 1.1181472722428638
Energy: 1.176997467446568
Energy: 1.1246044045769494
Energy: 1.1719310972802108
Energy: 1.6660965807066326
Energy: 1.1719310972824162
Energy: 1.133780493243967
Energy: 1.1224459936945748
Energy: 1.1205725841870775
Energy: 1.1224459936953097
Energy: 1.1233470839580089
Energy: 1.1716774436588822
Energy: 1.3947349487044298
Energy: 1.1716774436662332
Energy: 1.1342643026489887
Energy: 1.1223835405961289
Energy: 1.1206840190591645
Energy: 1.1223835406034801
Energy: 1.1233629103952218
Energy: 1.1715859996335292
Energy: 1.1488823189716857
Energy: 1.171585999646026
Energy: 1.1275793950386757
Energy: 1.1221250563792167
Energy: 1.118075777519602
Energy: 1.1221250563652494

minimum gb energy = 1.1151743820764681 eV
minimum distance =  2.31749748897325 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 1.2936013878343167
Energy: 1.0170750796077606
Energy: 1.0520688035520156
Energy: 1.0170750796077606
Energy: 1.247329803270269
Energy: 1.0063720050121203
Energy: 1.0162600883329929
Energy: 1.0063720050121203
Energy: 1.0064122621920537
Energy: 1.1010867695072433
Energy: 1.5546399168073723
Energy: 1.1010867695072433
Energy: 1.2445000947286942
Energy: 1.0064156450556494
Energy: 1.008074112393862
Energy: 1.0064156450543846
Energy: 1.0068942256659765
Energy: 1.0066747682934778
Energy: 1.017516043477077
Energy: 1.0066747682909483
Energy: 1.0402862132216448
Energy: 1.0067078475574145
Energy: 1.2849569471518443
Energy: 1.0067078475574145
Energy: 1.0037999976270535
Energy: 1.0360598970606418
Energy: 1.7105631497931288
Energy: 1.0360598970593768
Energy: 1.0006377708662229
Energy: 1.0081200870194773
Energy: 1.0108545462093197
Energy: 1.0081200870207419
Energy: 1.017805308871336
Energy: 1.0068150106329334
Energy: 1.4847579306916823
Energy: 1.0068150106316687
Energy: 1.5545177387730973
Energy: 1.1043262117701982
Energy: 1.2849478001959147
Energy: 1.1043262117676687
Energy: 1.0150486973296242
Energy: 1.0382499824408098
Energy: 1.2448588005362777
Energy: 1.0382499824395448
Energy: 1.577398498699461
Energy: 1.0066143675299997
Energy: 1.0078182198690744
Energy: 1.006614367528735
Energy: 1.287207928203785
Energy: 1.007056379381109
Energy: 1.0175618919299547
Energy: 1.0070563793836387
Energy: 1.7108027047617993
Energy: 1.0237787521663233
Energy: 1.006226830825567
Energy: 1.0237787521650585
Energy: 1.29545370067618
Energy: 1.0244503726000704
Energy: 1.0034374441327247
Energy: 1.0244503725988054
Energy: 1.2849015977681286
Energy: 1.0065002282338615
Energy: 1.0192106878187184
Energy: 1.0065002282338615
Energy: 1.2876239721013083
Energy: 1.1035986230144745
Energy: 1.018989273369312
Energy: 1.1035986230119452
Energy: 1.2772802930112532
Energy: 1.1310066889760724
Energy: 1.0062386174713436
Energy: 1.131006688973543
Energy: 1.0088030025503378
Energy: 1.0053666791650016
Energy: 1.009091457256336
Energy: 1.0053666791662663
Energy: 1.0044426221451561
Energy: 1.0959278563135644
Energy: 1.2886560047547493
Energy: 1.0959278570581563

minimum gb energy = 1.0006377708662229 eV
minimum distance =  2.31649543494668 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 1.0885367891143682
Energy: 0.86678894321926
Energy: 1.3969668716664856
Energy: 0.866788943217285
Energy: 1.413861016280181
Energy: 0.8722924745073706
Energy: 0.8668992266470242
Energy: 0.8722924745063829
Energy: 1.0718585215659497
Energy: 0.8649230117411557
Energy: 1.3263009545530506
Energy: 0.8649230117411557
Energy: 1.0622096431271648
Energy: 0.8703628452667289
Energy: 0.8697420944338927
Energy: 0.8703628452647535
Energy: 0.8664114884540838
Energy: 0.8646686928292329
Energy: 0.8829979284108506
Energy: 0.8646686928292329
Energy: 1.071164151306869
Energy: 0.8643470298928787
Energy: 0.8666978730865094
Energy: 0.8643470298988044
Energy: 0.8648409693707975
Energy: 0.8605405269831972
Energy: 1.0666329842241242
Energy: 0.86054052698616
Energy: 0.8936666400593576
Energy: 0.8812667001025226
Energy: 1.0738442334589198
Energy: 0.8812667000995597
Energy: 0.8658659834452446
Energy: 0.872106269745681
Energy: 1.4470573993450961
Energy: 0.8721062697506189
Energy: 0.8688870399507949
Energy: 0.8625712169484925
Energy: 0.8763953935327063
Energy: 0.8625712169159465
Energy: 0.8636895898374428
Energy: 0.8607331125940149
Energy: 1.6343287722354911
Energy: 0.8607331125950027
Energy: 1.3085436307050955
Energy: 0.8736754223396627
Energy: 1.0738331249238824
Energy: 0.8736754223406502
Energy: 0.8711446144046647
Energy: 0.8711607716211843
Energy: 1.468109659604403
Energy: 0.8711607716231594
Energy: 1.306032138628851
Energy: 0.8614907809628118
Energy: 0.8669794925395917
Energy: 0.8614907809637995
Energy: 0.8678689851063516
Energy: 0.8609572921039049
Energy: 1.0710440951701525
Energy: 0.8609572921078553
Energy: 1.4598237040660038
Energy: 0.9578785346202603
Energy: 0.8653399534531951
Energy: 0.9578785346212478
Energy: 1.0773382919626022
Energy: 0.8741630698649853
Energy: 0.8809421196452187
Energy: 0.8741630698689357
Energy: 1.4655062412842566
Energy: 0.8650056991521972
Energy: 0.8633842700361278
Energy: 0.8650056991541722
Energy: 1.093604587477779
Energy: 0.868503931819633
Energy: 0.8764112729114816
Energy: 0.868503931819633
Energy: 1.7908279358124344
Energy: 0.9511428324683916
Energy: 0.8657686203446425
Energy: 0.9511428324742723
Energy: 1.0770890194133604
Energy: 0.8737111092737645
Energy: 0.8854738755737905
Energy: 0.8737111092767273
Energy: 1.0806867437672512
Energy: 0.8708427343909884
Energy: 0.870210559617283
Energy: 0.8708427343890133
Energy: 0.8680209466999584
Energy: 0.8605553312325768
Energy: 1.3019655489642956
Energy: 0.8605553312325768
Energy: 1.0665661621330662
Energy: 0.951445329421597
Energy: 0.8691918046129342
Energy: 0.9514453294225845
Energy: 0.8663565416476555
Energy: 0.9531929906534363
Energy: 1.477244170420773
Energy: 0.9531929906514611
Energy: 0.8686000632148453
Energy: 0.8740821035316293
Energy: 1.0775187389543937
Energy: 0.8740821035355797

minimum gb energy = 0.8605405269831972 eV
minimum distance =  2.31956020986931 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 1.4387017329505114
Energy: 0.7619848197632699
Energy: 0.8190378529828442
Energy: 0.761984819760841
Energy: 1.4154306986261125
Energy: 0.7609769523751178
Energy: 0.7649987902870714
Energy: 0.7609769523783566
Energy: 0.7613040649362279
Energy: 0.762236696735314
Energy: 0.8220167710546437
Energy: 0.7622366967336947
Energy: 1.096456262665078
Energy: 0.7615468912005724
Energy: 0.7648892004793351
Energy: 0.7615468911981432
Energy: 0.7620348541108393
Energy: 0.7672487985002613
Energy: 1.2805285636096215
Energy: 0.7672487983763815
Energy: 0.7755036711517341
Energy: 0.7612077986204175
Energy: 0.7655330858497151
Energy: 0.761207798626895
Energy: 0.7643091326697238
Energy: 0.7610289388610478
Energy: 0.774241677647603
Energy: 0.7610289388618575
Energy: 0.7856856533815709
Energy: 0.7624991217389794
Energy: 0.7632999441700697
Energy: 0.7624991217381697
Energy: 0.7664426008091518
Energy: 0.7718265484262719
Energy: 1.0946680911870617
Energy: 0.7718265484230332
Energy: 0.7908230484214391
Energy: 0.7623808418808349
Energy: 0.7624038108832478
Energy: 0.7623808418824543
Energy: 0.7638460889538522
Energy: 0.7606006982096035
Energy: 1.6840622783698982
Energy: 0.7606006982112227
Energy: 0.7862988521013787
Energy: 0.7619571298592844
Energy: 1.4382288816885047
Energy: 0.7619571298609036
Energy: 0.7670536429500623
Energy: 1.1119538735206902
Energy: 1.6836622196352065
Energy: 1.1119538735223093
Energy: 1.1532658423151443
Energy: 0.827003496807848
Energy: 0.7627661617902505
Energy: 0.8270034967965127
Energy: 0.7641532089964271
Energy: 0.7611422137602495
Energy: 1.4216372761947573
Energy: 0.7611422137610591
Energy: 1.1414084409469278
Energy: 0.7626164672221604
Energy: 0.7632992394116638
Energy: 0.7626164672229699
Energy: 0.7665503909782246
Energy: 1.1145716056137986
Energy: 1.101188998550113
Energy: 1.1145716056113697
Energy: 1.1208381814992954
Energy: 0.8285986765885843
Energy: 0.7649426871680128
Energy: 0.8285986765861554
Energy: 0.7651925061015046
Energy: 0.762456907776151
Energy: 0.782145312236665
Energy: 0.7624569077777703
Energy: 1.0945809660292722
Energy: 0.762908818447876
Energy: 0.7689419409373452
Energy: 0.762908818447876
Energy: 0.7649456348427969
Energy: 1.115983820641663
Energy: 0.7993338783673783
Energy: 1.1159838206424728
Energy: 1.6808309172591962
Energy: 1.4379168159034674
Energy: 0.7649391440252589
Energy: 1.4379168159058966
Energy: 1.4404030158563652
Energy: 0.7617529453937865
Energy: 0.7835598909942304
Energy: 0.7617529453929768
Energy: 1.4148064167554841
Energy: 1.1152163413492482
Energy: 0.7678672868021955
Energy: 1.1152163413492482
Energy: 0.7653235515082315
Energy: 0.8230498906351971
Energy: 0.7987075008972098
Energy: 0.8230498906343873
Energy: 1.417926863493549
Energy: 1.4400416799585494
Energy: 0.7654309852227266
Energy: 1.4400416799577398
Energy: 0.7662359130156463
Energy: 0.7629159958765633
Energy: 1.142661641044891
Energy: 0.762915995874944
Energy: 0.7711239915400344
Energy: 1.1160599721032105
Energy: 0.7687402019154331
Energy: 1.1160599721032105
Energy: 0.7667157120638732
Energy: 0.8234900753075867
Energy: 1.1217996853241416
Energy: 0.8234900753075867
Energy: 0.7851969366338083
Energy: 1.130582635399988
Energy: 0.7668886873379298
Energy: 1.1305826353991781
Energy: 0.7678693199980912
Energy: 0.7639759535263309
Energy: 1.0920416551856373
Energy: 0.7639759535077084
Energy: 0.7874838732183534
Energy: 1.11687481553078
Energy: 0.7680551631607198
Energy: 1.1168748155299701

minimum gb energy = 0.7606006982096035 eV
minimum distance =  2.30956706127352 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 1.2520182817309706
Energy: 0.6890191272817118
Energy: 0.7481788274656291
Energy: 0.6890191272885708
Energy: 1.4844705114055385
Energy: 0.6958232212562021
Energy: 0.6880682517579209
Energy: 0.6958232212610035
Energy: 0.6877749794724606
Energy: 0.6854144497318776
Energy: 1.67987710212565
Energy: 0.6854144497339354
Energy: 1.2537862154404749
Energy: 0.6877034899707657
Energy: 0.6883984447870446
Energy: 0.6877034899652783
Energy: 0.685054436321298
Energy: 0.6880978968474619
Energy: 1.2177538761993532
Energy: 0.6880978968447183
Energy: 0.9789162874520083
Energy: 0.696918234699786
Energy: 0.6869513684953712
Energy: 0.6969182346949846
Energy: 0.6867408164583237
Energy: 0.6869759835261459
Energy: 0.7056190835524038
Energy: 0.6869759835227163
Energy: 0.705455087049282
Energy: 0.686585476475409
Energy: 0.6871156449995275
Energy: 0.6865854764740371
Energy: 0.6879859204348668
Energy: 0.6867510649543613
Energy: 0.9800135381898004
Energy: 0.6867510649146411
Energy: 0.7181293552185911
Energy: 0.6973957405998412
Energy: 0.6853971769690561
Energy: 0.697395740580636
Energy: 0.686352475999153
Energy: 0.6976020941847375
Energy: 1.257789686359697
Energy: 0.6976020941847375
Energy: 0.7143110473985099
Energy: 0.6849617030872047
Energy: 0.6879801717003747
Energy: 0.6849617030872047
Energy: 0.6893000783444497
Energy: 0.6895432967869993
Energy: 1.4838417185970416
Energy: 0.6895432967959162
Energy: 0.7147567202965652
Energy: 0.6860164475042044
Energy: 1.2521145449083515
Energy: 0.6860164475035185
Energy: 0.6867500128713288
Energy: 0.6952728210313497
Energy: 1.7139552347125078
Energy: 0.6952728212253364
Energy: 1.0243870627458802
Energy: 0.6849896297657191
Energy: 0.6883041222679928
Energy: 0.6849896297650333
Energy: 0.6880551402991986
Energy: 0.6895508838284098
Energy: 1.487338605763986
Energy: 0.6895508838277238
Energy: 1.020153646501364
Energy: 0.6913815198237937
Energy: 0.6845697215192551
Energy: 0.6913815198292809
Energy: 0.6862383902523773
Energy: 0.6966264671145255
Energy: 1.259706913288607
Energy: 0.6966264671062946
Energy: 1.0033911091245813
Energy: 0.6854681874635947
Energy: 0.6872364460405627
Energy: 0.6854681874587935
Energy: 0.6886976236645503
Energy: 0.6971563302723022
Energy: 0.9846124059640561
Energy: 0.6971563302702445
Energy: 0.9769428595893765
Energy: 0.686371307120673
Energy: 0.6894305594451152
Energy: 0.6863713071309615
Energy: 0.6866329149613856
Energy: 0.6954959892429746
Energy: 0.7146560861299667
Energy: 0.6954959892704108
Energy: 1.518785224910656
Energy: 0.6861471848766079
Energy: 0.6870386197530303
Energy: 0.6861471848292803
Energy: 0.6898584901125255
Energy: 0.6981116375638889
Energy: 0.7252789715630572
Energy: 0.6981116375577158
Energy: 1.4800041697560697
Energy: 0.6862618356571354
Energy: 0.6899714015123173
Energy: 0.686261835652334
Energy: 1.2542771208930446
Energy: 0.68585712283914
Energy: 0.7157687561094537
Energy: 0.6858571228021011
Energy: 1.7129026019100149
Energy: 0.6958379550758975
Energy: 0.6870809541283813
Energy: 0.695837955072468
Energy: 0.6903454712563399
Energy: 0.6914681749137984
Energy: 0.7242148226166012
Energy: 0.6914681749590682
Energy: 1.2510218859914317
Energy: 1.2794349229023663
Energy: 0.690669324125111
Energy: 1.279434922904424
Energy: 0.6873103653239852
Energy: 1.2785015819116703
Energy: 1.0190158634378297
Energy: 1.2785015819116703
Energy: 1.2589506687807421
Energy: 0.6938233200430698
Energy: 0.6869121223239878
Energy: 0.6938233200403262
Energy: 0.6886600014632757
Energy: 1.008532583743509
Energy: 1.007251091363339
Energy: 1.0085325837428234
Energy: 0.6968575755512245
Energy: 0.6952434666497755
Energy: 0.6908677160229927
Energy: 0.6952434666504614
Energy: 0.6911884844743096
Energy: 1.278226252603806
Energy: 0.9817687944825388
Energy: 1.2782262526010624
Energy: 0.7142678620276615
Energy: 0.6947593913331647
Energy: 0.6880961303517348
Energy: 0.6947593913324788
Energy: 0.6886505000685973
Energy: 0.7418148143951634
Energy: 1.5152094264085165
Energy: 0.741814814397907

minimum gb energy = 0.6845697215192551 eV
minimum distance =  2.31662309748154 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 1.1022887703628055
Energy: 0.6067601901927074
Energy: 0.6858680945294511
Energy: 0.6067601902040103
Energy: 1.491232826929321
Energy: 0.6070852825348698
Energy: 0.5960052158148654
Energy: 0.6070852825485251
Energy: 1.085062865303183
Energy: 0.6055169354250037
Energy: 1.5917585540066999
Energy: 0.6055169354261936
Energy: 1.2961023548353579
Energy: 0.6072773480836882
Energy: 0.5966016820398284
Energy: 0.6072773480872304
Energy: 0.6063137976342757
Energy: 0.5946522398413371
Energy: 0.6211106529912381
Energy: 0.5946522398413371
Energy: 1.1001099133174324
Energy: 0.6057989454987812
Energy: 0.596150788136957
Energy: 0.6057989454940221
Energy: 0.5939862209102406
Energy: 0.6149256524147811
Energy: 0.630544366639717
Energy: 0.6149256524135912
Energy: 0.8640955930723897
Energy: 0.606322669935879
Energy: 0.5960734985158075
Energy: 0.6063226699317147
Energy: 0.5955706222912786
Energy: 0.5975199967657369
Energy: 0.8640920661487669
Energy: 0.5975199967669266
Energy: 0.6308988264764146
Energy: 0.6160212251850268
Energy: 0.593989098228494
Energy: 0.6160212251862164
Energy: 0.5969293685441
Energy: 0.6053045533788918
Energy: 1.1000390969240035
Energy: 0.6053045533586658
Energy: 0.6173904307949682
Energy: 0.6092835573677946
Energy: 0.6064824898406075
Energy: 0.6092835573874258
Energy: 0.5960725184686517
Energy: 0.5980113725806442
Energy: 1.2950645730317438
Energy: 0.5980113725824289
Energy: 0.6346312704432078
Energy: 0.6060833983417476
Energy: 1.0857315405642796
Energy: 0.6060833983411527
Energy: 0.5975215055235529
Energy: 0.6062814437698816
Energy: 1.6967649381973406
Energy: 0.606281443768097
Energy: 0.6169251263534931
Energy: 0.6075139225369884
Energy: 1.1024192063155682
Energy: 0.6075139225363934
Energy: 0.5957994331172974
Energy: 0.59821910730939
Energy: 1.6969953690060948
Energy: 0.5982191072903535
Energy: 0.905130315373929
Energy: 0.6055759215598843
Energy: 1.0857830046424324
Energy: 0.6055759215598843
Energy: 0.5971933419409446
Energy: 0.6064189613566308
Energy: 1.4911745355459927
Energy: 0.6064189613661489
Energy: 0.8817413374799257
Energy: 0.609799009473048
Energy: 0.6062546257194026
Energy: 0.6097990095961356
Energy: 0.5955010387331111
Energy: 0.5972027853492796
Energy: 1.2933745961836802
Energy: 0.5972027853504694
Energy: 0.8699289436072523
Energy: 0.6052659555640867
Energy: 0.5942502264684938
Energy: 0.6052659555706305
Energy: 0.597333459809709
Energy: 0.6056283879912607
Energy: 1.0940911346399869
Energy: 0.6056283879924506
Energy: 0.843628022713783
Energy: 0.6147441044295363
Energy: 0.5963473773862538
Energy: 0.6147441044283465
Energy: 0.5954554460957815
Energy: 0.604864837132291
Energy: 0.8559961973550194
Energy: 0.6048648371328859
Energy: 1.3353575950270722
Energy: 0.6055940460490149
Energy: 0.5988225806055323
Energy: 0.6055940460502047
Energy: 0.6081617628795238
Energy: 0.6068001551854854
Energy: 0.617747830653588
Energy: 0.6068001551842956
Energy: 1.322834799747634
Energy: 0.614335725283386
Energy: 0.5960356011103952
Energy: 0.6143357253083712
Energy: 1.0870002552118991
Energy: 0.6060237912076688
Energy: 0.6341429492192753
Energy: 0.6060237912076688
Energy: 1.696532695829463
Energy: 0.6068889149974531
Energy: 0.5987715747258495
Energy: 0.6068889150022122
Energy: 1.1038514790939409
Energy: 0.6047885237104832
Energy: 0.6171091688336475
Energy: 0.6047885237086985
Energy: 1.490353506617212
Energy: 0.6144782834976589
Energy: 0.5965101149015143
Energy: 0.6144782835059873
Energy: 1.08691433593477
Energy: 0.6061221442957081
Energy: 0.6336514824049785
Energy: 0.6061221442980876
Energy: 1.495753492564856
Energy: 0.606869600381286
Energy: 0.59878030470135
Energy: 0.606869600381286
Energy: 0.6075768604587317
Energy: 0.6056971190216769
Energy: 0.8811075440815807
Energy: 0.6056971190204871
Energy: 1.0846481848629446
Energy: 0.6141293485658816
Energy: 0.5957549998382003
Energy: 0.6141293485557685
Energy: 0.5950607033247305
Energy: 0.6054783065571736
Energy: 0.8684684978633601
Energy: 0.6054783065583634
Energy: 1.0940286133733053
Energy: 0.6050395492325396
Energy: 0.5996629544893423
Energy: 0.6050395492331343
Energy: 0.5969228042230249
Energy: 0.6062111207575763
Energy: 0.8442363672012634
Energy: 0.6062111207540068
Energy: 0.5970238064883792
Energy: 0.6241187393311132
Energy: 0.5971357604714743
Energy: 0.6241187393323031
Energy: 0.5977076279978597
Energy: 0.6056904723529872
Energy: 1.3438966087895663
Energy: 0.6056904723571517
Energy: 0.6176131855644748
Energy: 0.6057698899264514
Energy: 0.6098453057961412
Energy: 0.605769889927641
Energy: 0.5972518435522264
Energy: 0.605657895321645
Energy: 1.319458584322743
Energy: 0.6056578953133167

minimum gb energy = 0.5939862209102406 eV
minimum distance =  2.32126319707794 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.019851131200867445
Energy: 0.020532994926870607
Energy: 1.04603680497046
Energy: 0.020532994926870607
Energy: 1.0479248379753476
Energy: 0.16909232187205614
Energy: 0.1698104886812791
Energy: 0.16909232187027767
Energy: 0.019851131200867445
Energy: 0.020532994926870607
Energy: 1.0460368049682245
Energy: 0.020532994926870607
Energy: 1.0479248379802764
Energy: 0.16909232187159884
Energy: 0.16981048867950063
Energy: 0.16909232187027767
Energy: 0.019851131200867445
Energy: 0.020532994926413282
Energy: 1.0460368049695963
Energy: 0.020532994926413282
Energy: 1.0479248379766688
Energy: 0.16909232187159884
Energy: 0.16981048867950063
Energy: 0.16909232187068418

minimum gb energy = 0.019851131200867445 eV
minimum distance =  2.51341909396963 Angstroms
sigma value = 1