Model name: model_name=EAM_Dynamo_DeluigiPasianotValencia_2021_FeNiCrCoCu__MO_657255834688_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.520000764727593
cohesive_energy=4.450350029950939
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[6.53213822388336e-20, 1.42254058979592e-19, 2.41100346414222e-19, 3.3853671841093195e-19, 4.1388868768458594e-19, 4.67882040250386e-19, 5.07933251747118e-19, 5.40064904141988e-19, 5.66620981850538e-19, 5.88830354351046e-19, 6.075726166155779e-19, 6.2375940714888e-19, 6.38198222974488e-19, 6.51454632444204e-19, 6.63626368332702e-19, 6.7456442821302e-19, 6.841294227179999e-19, 6.92273286548622e-19, 6.990280632375659e-19, 7.043985593147339e-19, 7.083815704268579e-19, 7.11044387992566e-19, 7.1251678831921205e-19, 7.1296860213e-19, 7.125087774360419e-19, 7.110331727561279e-19, 7.084152161361718e-19, 7.04440215907218e-19, 6.987060257341319e-19, 6.90715970860374e-19, 6.798436002220499e-19, 6.653086537984019e-19, 6.46321258508868e-19, 6.22179660987756e-19, 5.92335916826238e-19, 5.5644395587137e-19, 5.14446099764328e-19, 4.66276659263118e-19, 4.11680888282934e-19, 3.5014929465416396e-19, 2.81425530115368e-19, 2.11176493421004e-19, 1.515617439171516e-19, 1.228393631817702e-19, 1.7032739796053998e-19, 4.12057399791924e-19, 1.163337249594132e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01810388629001541
Energy: 1.544706004082131
Energy: 0.01888849331871771
Energy: 0.018414502846305577
Energy: 0.7636022019450823
Energy: 0.01855848208512584
Energy: 1.544706004081837
Energy: 0.1624357556716948
Energy: 0.1620732871643198
Energy: 0.16162162913456435
Energy: 0.16223453669934695
Energy: 0.16175087872600774
Energy: 0.018888493318386948
Energy: 0.1620732871643198
Energy: 0.16200299535224483
Energy: 0.018595004407533262
Energy: 0.16216196047543877
Energy: 0.1618362013198373
Energy: 0.018414502846305577
Energy: 0.16162162913456435
Energy: 0.018595004407202496
Energy: 0.01848893115361515
Energy: 0.1624299313127053
Energy: 0.018532819446047837
Energy: 0.7636022019463686
Energy: 0.16223453669967774
Energy: 0.1621619604757695
Energy: 0.1624299313127053
Energy: 0.16176725547497253
Energy: 0.16231101685884383
Energy: 0.01855848208512584
Energy: 0.16175087872567698
Energy: 0.1618362013198373
Energy: 0.018532819446047837
Energy: 0.16231101685913787
Energy: 0.018513206087377887

minimum gb energy = 0.01810388629001541 eV
minimum distance =  2.48643246872183 Angstroms
sigma value = 1


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

Energy: 2.0259260157311427
Energy: 1.4229409527033234
Energy: 1.3513507586088171
Energy: 1.286267429254997
Energy: 1.323574440738924
Energy: 1.3558262765392295
Energy: 1.8845049415228687
Energy: 1.3393075465631612
Energy: 1.3417726494530429
Energy: 1.3619287380786522
Energy: 1.339854963538483
Energy: 1.360461688417161
Energy: 1.8968194290696445
Energy: 1.2974756387797837
Energy: 1.2964653613308745
Energy: 1.335141331179148
Energy: 1.2980297986584615
Energy: 1.2907927046526142
Energy: 2.1013875987360615
Energy: 1.2824235204945114
Energy: 1.288590000796563
Energy: 1.2894493821957167
Energy: 1.2936333715498638
Energy: 1.2887363824163556
Energy: 1.8856193922927929
Energy: 1.3512409425785956
Energy: 1.3508532560521034
Energy: 1.3605595007399913
Energy: 1.3500866615089884
Energy: 1.3507412295737944
Energy: 1.8835817862217745
Energy: 1.3522892922019156
Energy: 1.3511935227161502
Energy: 1.3346124695806796
Energy: 1.3512083786485634
Energy: 1.3359448380608767
Energy: 1.879249932944544
Energy: 1.3337236728844954
Energy: 1.3338560905438257
Energy: 1.333329663609362
Energy: 1.3337173819931507
Energy: 1.333535157309003
Energy: 1.805043439800862
Energy: 1.3510163439660146
Energy: 1.350877733381228
Energy: 1.289214626565711
Energy: 1.351709914778353
Energy: 1.3353053184269446
Energy: 1.4667420146639376
Energy: 1.3348955193276115
Energy: 1.3356926893939047
Energy: 1.348800636946644
Energy: 1.3335596140404042
Energy: 1.3486519917984454
Energy: 1.4668779318564291
Energy: 1.363016792583355
Energy: 1.3624222747249002
Energy: 1.350816503974654
Energy: 1.3633076895172418
Energy: 1.3508928216016942
Energy: 1.4838751089099675
Energy: 1.3097531468203492
Energy: 1.3086942887561315
Energy: 1.4103807458531166
Energy: 1.3089025297819017
Energy: 1.2624093666337601
Energy: 1.339305595355242
Energy: 1.3045344558124221
Energy: 1.2894181273898457
Energy: 1.3397866970441874
Energy: 1.3502553410827953
Energy: 1.2587575443122954
Energy: 1.3390908025525239
Energy: 1.3346981837815994
Energy: 1.3600486262570601
Energy: 1.3392645407686206
Energy: 1.3741264363286227
Energy: 1.2983423834519245
Energy: 1.5356070074802821
Energy: 1.2889225231240962
Energy: 1.2891169630844377
Energy: 1.293418446499056
Energy: 1.2902709132373116
Energy: 1.281348888246377
Energy: 1.3717577312190397
Energy: 1.3631127127469693
Energy: 1.389699619353082
Energy: 1.3425224860537044
Energy: 1.3616506786536746
Energy: 1.3428097414420839
Energy: 1.3713569438215223
Energy: 1.2901441295052851
Energy: 1.289569364500084
Energy: 1.3189499244108145
Energy: 1.2908137843109473
Energy: 1.291116561624213
Energy: 1.6555450603692836
Energy: 1.3325955065025432
Energy: 1.3322584300595386
Energy: 1.305895636245382
Energy: 1.334173770788959
Energy: 1.2894057346604315
Energy: 1.6577422236896635
Energy: 1.353688046372887
Energy: 1.3519427676768982
Energy: 1.3515474059198496
Energy: 1.3526194065991861
Energy: 1.3516388310535374
Energy: 1.6566081977910627
Energy: 1.3525581933304416
Energy: 1.3509622939362207
Energy: 1.351245933607205
Energy: 1.351506563008213
Energy: 1.3505710058199998
Energy: 1.9892354191086368
Energy: 1.3526622068419494
Energy: 1.3514136884446868
Energy: 1.351128952504986
Energy: 1.3516709015952315
Energy: 1.3507571654641772
Energy: 2.0246585969692292
Energy: 1.2898908178045105
Energy: 1.3094187582237424
Energy: 1.3103184013454805
Energy: 1.3529635437350624
Energy: 1.3095237931555255
Energy: 1.9659619423309111
Energy: 1.320357011684981
Energy: 1.3210086352766783
Energy: 1.3314808760065648
Energy: 1.3201568389311018
Energy: 1.2900152016930309
Energy: 1.9631820882447066
Energy: 1.307305445851611
Energy: 1.3065241774292549
Energy: 1.374380154704255
Energy: 1.3075578141511237
Energy: 1.3136491019887298

minimum gb energy = 1.2587575443122954 eV
minimum distance =  2.31347401707272 Angstroms
sigma value = 33


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

Energy: 2.538886739805874
Energy: 1.5083830933432694
Energy: 1.3414034679710567
Energy: 1.3874653144734912
Energy: 1.3178376282486226
Energy: 1.5024921023157292
Energy: 1.9862838390238733
Energy: 1.3674188190529528
Energy: 1.3225711066984387
Energy: 1.44114858781955
Energy: 1.3670204710611176
Energy: 1.3221682964603616
Energy: 1.5086611792967175
Energy: 1.3554529861648343
Energy: 1.3844858759926413
Energy: 1.476781544267856
Energy: 1.3555679121171886
Energy: 1.4531847668819984
Energy: 2.0997597081624453
Energy: 1.5313359304544714
Energy: 1.3891496428466414
Energy: 1.39928955150338
Energy: 1.6087920862818916
Energy: 1.3997083988139036
Energy: 1.9007726536402199
Energy: 1.5850331402549114
Energy: 1.39393460212454
Energy: 1.3967448685251982
Energy: 1.3964133645030727
Energy: 1.5833619103112069
Energy: 2.0443567903433006
Energy: 1.5517274937128562
Energy: 1.340195847785592
Energy: 1.4485396912515291
Energy: 1.3740940201759586
Energy: 1.5533284994896128
Energy: 2.0643903382499507
Energy: 1.5453664054473468
Energy: 1.5451461379300175
Energy: 1.5528809293533956
Energy: 1.5327462288291906
Energy: 1.5525169953423603
Energy: 1.9039139136276066
Energy: 1.4722886027175814
Energy: 1.472149933415252
Energy: 1.407771968006393
Energy: 1.4812322505654416
Energy: 1.4728710006629786
Energy: 1.65782021282473
Energy: 1.473391205121896
Energy: 1.5741789353771578
Energy: 1.5810748583359953
Energy: 1.480731313756477
Energy: 1.5722133030868828
Energy: 1.658841405915928
Energy: 1.5711214580932515
Energy: 1.572208115669061
Energy: 1.5731022267194503
Energy: 1.5746351974861306
Energy: 1.5748008136444422
Energy: 1.6675324845181607
Energy: 1.3729763646955024
Energy: 1.3648999677661637
Energy: 1.4784614107736107
Energy: 1.36797865990664
Energy: 1.3646664488042433
Energy: 1.5380945882348827
Energy: 1.4194250694802408
Energy: 1.5178727641147127
Energy: 1.5325793943947443
Energy: 1.475869903631141
Energy: 1.4998818359527772
Energy: 1.533319399710463
Energy: 1.5670545376751572
Energy: 1.5303665764611496
Energy: 1.531120926682212
Energy: 1.5619939385143786
Energy: 1.5309803886040116
Energy: 1.7053291021699948
Energy: 1.398588142597394
Energy: 1.3995553043376134
Energy: 1.6761366397268185
Energy: 1.399471789438077
Energy: 1.39869843526751
Energy: 1.646426785790161
Energy: 1.5964099510437906
Energy: 1.5770194630057617
Energy: 1.560038507456719
Energy: 1.5859778894855505
Energy: 1.5782994621203903
Energy: 1.6522458889062672
Energy: 1.4960269739181546
Energy: 1.5393180894999867
Energy: 1.574209056238782
Energy: 1.5484057873024066
Energy: 1.5374185695436988
Energy: 1.5760984853942324
Energy: 1.3262136047926307
Energy: 1.5564538578381317
Energy: 1.5452714576771718
Energy: 1.5546791244655787
Energy: 1.3216990960577695
Energy: 1.7855719659963023
Energy: 1.5153362449522618
Energy: 1.5921807688919132
Energy: 1.4806374868014738
Energy: 1.591294598712433
Energy: 1.4730039553578753
Energy: 1.7956205714438416
Energy: 1.4199703412848095
Energy: 1.4211103207453446
Energy: 1.473540140847933
Energy: 1.42030725823764
Energy: 1.4114230536145473
Energy: 1.5752592691328051
Energy: 1.3803525075263272
Energy: 1.381023401468954
Energy: 1.608540906800565
Energy: 1.3830032022486451
Energy: 1.3595046808815467
Energy: 1.5740859180830171
Energy: 1.2566527634815823
Energy: 1.3652943727234859
Energy: 1.3660101919196945
Energy: 1.3856107146938241
Energy: 1.2457102186113038
Energy: 1.5746553753433532
Energy: 1.2590484762336362
Energy: 1.256326536242737
Energy: 1.477006433086583
Energy: 1.3040691114159328
Energy: 1.2571361200827396
Energy: 1.5747762693583511
Energy: 1.3218464863194583
Energy: 1.340490047822198
Energy: 1.4229039640538925
Energy: 1.340526032389075
Energy: 1.390794000305584
Energy: 2.110486438236174
Energy: 1.4643721287351714
Energy: 1.5015522700532598
Energy: 1.3997348980550126
Energy: 1.4103966929418927
Energy: 1.473862899006718
Energy: 1.5750140650034357
Energy: 1.3645012075116003
Energy: 1.544985510250563
Energy: 1.5876653252965263
Energy: 1.5451675653893822
Energy: 1.4003961504893525
Energy: 1.9098151148075726
Energy: 1.372207245395228
Energy: 1.5470904466104047
Energy: 1.6086522072625469
Energy: 1.5809116463459174
Energy: 1.3719061168030924
Energy: 2.090135525252522
Energy: 1.5117637312263499
Energy: 1.5314247473966893
Energy: 1.5473488876359984
Energy: 1.5477665073780713
Energy: 1.544638368959524
Energy: 1.7428083254014433
Energy: 1.4735968561320048
Energy: 1.4736221649352284
Energy: 1.588787973131542
Energy: 1.4727385707770793
Energy: 1.5886239583439703
Energy: 1.6555664023747074
Energy: 1.4720421707372937
Energy: 1.4736710412283356
Energy: 1.579246158011362
Energy: 1.471983363161172
Energy: 1.5711246289129535
Energy: 1.6568424678323619
Energy: 1.5822616511205922
Energy: 1.5815608637019243
Energy: 1.5726196496984175
Energy: 1.584389450667648
Energy: 1.5728541041785544
Energy: 1.6668318043245396
Energy: 1.3644429986969147
Energy: 1.3645537302087414
Energy: 1.4984218477107556
Energy: 1.362551605665731
Energy: 1.3646071032949103
Energy: 1.536193040263251
Energy: 1.36152640500209
Energy: 1.3647425119620507
Energy: 1.5332539788486799
Energy: 1.4206733404656022
Energy: 1.5017567987413334
Energy: 1.5351741774235834
Energy: 1.5683293039892012
Energy: 1.540281764845937
Energy: 1.5332222463343543
Energy: 1.5691337299104293
Energy: 1.5400440864828242
Energy: 1.5354159121980004
Energy: 1.3996068369935402
Energy: 1.4001094539231829
Energy: 1.5309112072093927
Energy: 1.3989407207612643
Energy: 1.4765918143002845
Energy: 1.6348273601600047
Energy: 1.5942825174551503
Energy: 1.5610314264828165
Energy: 1.526136601477224
Energy: 1.5975543516170427
Energy: 1.559448734105404
Energy: 1.6369700806314487
Energy: 1.5540022530398296
Energy: 1.447160944045635
Energy: 1.457720592293637
Energy: 1.6191235974456277
Energy: 1.5492948087508636
Energy: 1.6357330975313362
Energy: 1.578937159689751
Energy: 1.335807025364711
Energy: 1.3354145566725844
Energy: 1.3272761723446955
Energy: 1.4570458025624913
Energy: 1.7961997420456361
Energy: 1.5760644114750935
Energy: 1.3952589317432904
Energy: 1.4805636614474644
Energy: 1.600092921046194
Energy: 1.5768279642106908
Energy: 1.7843477524479703
Energy: 1.4161949064739197
Energy: 1.4090198148866813
Energy: 1.4808688470276552
Energy: 1.4092487147059118
Energy: 1.4732685789500963
Energy: 1.8940843961081772
Energy: 1.4117713746228853
Energy: 1.3816292149233624
Energy: 1.4130523316932169
Energy: 1.4123874303465613
Energy: 1.4120375974537753
Energy: 2.1235044458292913
Energy: 1.3234642748117773
Energy: 1.286663695256574
Energy: 1.28747669156912
Energy: 1.322714023638908
Energy: 1.3919490689940095

minimum gb energy = 1.2457102186113038 eV
minimum distance =  2.28512977077576 Angstroms
sigma value = 51


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

Energy: 2.106310605475628
Energy: 1.4447273772203346
Energy: 1.4877223675083446
Energy: 1.3795365111383073
Energy: 1.5051190078704062
Energy: 1.3869815115454718
Energy: 1.6016336911355864
Energy: 1.364401760299507
Energy: 1.364607447698809
Energy: 1.4103692064958357
Energy: 1.3643506483855405
Energy: 1.364987433369097
Energy: 1.9329432116232712
Energy: 1.3665388718642102
Energy: 1.3621867013558788
Energy: 1.3600099329102546
Energy: 1.3665658740917142
Energy: 1.3663673754011199
Energy: 1.9123872138358897
Energy: 1.3414133064315792
Energy: 1.3377651098460972
Energy: 1.357130643546952
Energy: 1.4093670723448724
Energy: 1.3607062405468031
Energy: 1.7651728497301418
Energy: 1.4314138774694727
Energy: 1.4312045515276957
Energy: 1.4087965786438759
Energy: 1.4311635550677178
Energy: 1.4298780988904272
Energy: 1.6009764550521655
Energy: 1.4321597006589981
Energy: 1.4318183232688297
Energy: 1.4310734352693022
Energy: 1.4325881768955187
Energy: 1.429927277381432
Energy: 1.6007598280649715
Energy: 1.408718810904899
Energy: 1.4072270308348782
Energy: 1.4310495708038986
Energy: 1.4096157271195517
Energy: 1.4074796161004548
Energy: 1.5969896579254939
Energy: 1.2929428113552288
Energy: 1.2887646761412577
Energy: 1.4109447438711433
Energy: 1.2904535828133283
Energy: 1.289325209626233
Energy: 1.367453364017892
Energy: 1.29375674695344
Energy: 1.2887351976523618
Energy: 1.3667541409912753
Energy: 1.2886984291548482
Energy: 1.3418049448766947
Energy: 1.3644371543224785
Energy: 1.370491381576215
Energy: 1.3650884555367366
Energy: 1.365664646517108
Energy: 1.3855333287467304
Energy: 1.3646454644098915
Energy: 1.4048544653919184
Energy: 1.3416749098403882
Energy: 1.339919045983169
Energy: 1.4046984727605303
Energy: 1.3353448409625714
Energy: 1.3065487642818565
Energy: 1.4165574406160177
Energy: 1.3945630424124689
Energy: 1.3649143620943163
Energy: 1.3655640731720395
Energy: 1.3996298641719163
Energy: 1.3648697116982074
Energy: 1.414448123286083
Energy: 1.36013964153854
Energy: 1.3598157159618351
Energy: 1.389161432977439
Energy: 1.339959079440679
Energy: 1.3871681166594685
Energy: 1.4154664936334245
Energy: 1.3608725453338264
Energy: 1.3602233743172454
Energy: 1.3660228708756157
Energy: 1.3620069653828637
Energy: 1.3603243196614085
Energy: 1.7171165302564992
Energy: 1.3462853238430794
Energy: 1.3476426606527225
Energy: 1.415941553337502
Energy: 1.3720840056925883
Energy: 1.3398118617193504
Energy: 1.7168240874987364
Energy: 1.3674217009600937
Energy: 1.3676994279687762
Energy: 1.41486345249489
Energy: 1.3921858931577165
Energy: 1.3957083030157715
Energy: 1.7707863750832007
Energy: 1.391989214325177
Energy: 1.3919829356378346
Energy: 1.4043856866939786
Energy: 1.3922355162309086
Energy: 1.3915395666248347
Energy: 2.1049448775983937
Energy: 1.36459431552055
Energy: 1.3684988711633492
Energy: 1.2904055123209415
Energy: 1.364744754428702
Energy: 1.3689371740592777

minimum gb energy = 1.2886984291548482 eV
minimum distance =  2.35119408914926 Angstroms
sigma value = 19


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

Energy: 1.7747962032026359
Energy: 1.5520782185710313
Energy: 1.2989946202380782
Energy: 1.5167927037829232
Energy: 1.2395873599575338
Energy: 1.2990964434028633
Energy: 1.5963529196449373
Energy: 1.2627524384848
Energy: 1.262827862450236
Energy: 1.3111343537038824
Energy: 1.2623516085390811
Energy: 1.2633688207507119
Energy: 1.5122920720758994
Energy: 1.2635784796312355
Energy: 1.2636854826168966
Energy: 1.3119390642560351
Energy: 1.2635206396977083
Energy: 1.2632887958550703
Energy: 1.5030207248543626
Energy: 1.2628352327874341
Energy: 1.2630579872701264
Energy: 1.3084337581937129
Energy: 1.2625285811464382
Energy: 1.2632389578441963
Energy: 1.5136057470762188
Energy: 1.262259380735035
Energy: 1.3117927248473258
Energy: 1.3135657983173123
Energy: 1.2620059173828886
Energy: 1.3126243407863445
Energy: 1.5126664434383565
Energy: 1.2253208948322205
Energy: 1.309952659436883
Energy: 1.3130773478192632
Energy: 1.2251880684726235
Energy: 1.311532868165879
Energy: 1.5141412116624469
Energy: 1.312506349196992
Energy: 1.3107652710289086
Energy: 1.3137595513996654
Energy: 1.2385794174145213
Energy: 1.3127646784057732
Energy: 1.4328641421838686
Energy: 1.2270863781115822
Energy: 1.2267459879014138
Energy: 1.435491702447751
Energy: 1.2260601168244378
Energy: 1.2254710616402285
Energy: 1.26224726320087
Energy: 1.225816615469678
Energy: 1.2259236143119256
Energy: 1.2627385270951283
Energy: 1.211336914324637
Energy: 1.225268582994547
Energy: 1.262223408913321
Energy: 1.2635062016137697
Energy: 1.2635159727441698
Energy: 1.2625133447215258
Energy: 1.3124264788904734
Energy: 1.2630422911417036
Energy: 1.2635340891678621
Energy: 1.308677346095418
Energy: 1.308274815733738
Energy: 1.2633977471509488
Energy: 1.3086477872804494
Energy: 1.2635273148555553
Energy: 1.5134626613404456
Energy: 1.3125523960298484
Energy: 1.3122144534011342
Energy: 1.2624652985920992
Energy: 1.3130815208059152
Energy: 1.2630995960344127
Energy: 1.2252688161504381
Energy: 1.3120491737078046
Energy: 1.3125446278647595
Energy: 1.2251875866758952
Energy: 1.3138407061422515
Energy: 1.313372062655969
Energy: 1.515181553562214
Energy: 1.3136039516891602
Energy: 1.3127839977528686
Energy: 1.2628845492702727
Energy: 1.313823216874999
Energy: 1.3124035490180848
Energy: 1.7808887275646543
Energy: 1.2626670811955423
Energy: 1.263114140721026
Energy: 1.2118935742830572
Energy: 1.262505129749126
Energy: 1.2256348430551325
Energy: 1.7791146062437175
Energy: 1.2625317108162857
Energy: 1.2253958557240492
Energy: 1.2278221555166302
Energy: 1.2624907979418323
Energy: 1.2266128730483588
Energy: 1.514522038341744
Energy: 1.262137045962517
Energy: 1.262446325751827
Energy: 1.3113903822618562
Energy: 1.2616658156375753
Energy: 1.2628997205938397
Energy: 1.4997220401640858
Energy: 1.2634119304200233
Energy: 1.263565349920529
Energy: 1.2970082212372744
Energy: 1.263264035651498
Energy: 1.2633725032208085
Energy: 1.4998415873546362
Energy: 1.2634879820999754
Energy: 1.2637642053071092
Energy: 1.296169218756351
Energy: 1.2633986376106847
Energy: 1.2637707425359745
Energy: 1.5143332686644924
Energy: 1.2256587295443522
Energy: 1.3116672323479484
Energy: 1.3126452850764367
Energy: 1.2249326546166028
Energy: 1.3104790609309458
Energy: 1.5078952834852002
Energy: 1.311951932873907
Energy: 1.3121373889486545
Energy: 1.3138978285338192
Energy: 1.2624701991252205
Energy: 1.3127559118699383
Energy: 1.5124098840134483
Energy: 1.312350959666356
Energy: 1.3116587837841687
Energy: 1.3127884099531328
Energy: 1.2388767189897347
Energy: 1.3117183561274985
Energy: 1.438614620563466
Energy: 1.2262408534904337
Energy: 1.2261255219095606
Energy: 1.4381743855932012
Energy: 1.2269004033152193
Energy: 1.2259606871123174
Energy: 1.26263829820526
Energy: 1.2626715094574157
Energy: 1.2633618114602663
Energy: 1.2623803077944675
Energy: 1.224521971299939
Energy: 1.2630046441638996
Energy: 1.2633653887679457
Energy: 1.263827781765038
Energy: 1.2636030786529449
Energy: 1.263433674345165
Energy: 1.3119062594987494
Energy: 1.2634148396678155
Energy: 1.4367831959991226
Energy: 1.29694309998585
Energy: 1.2965400914016048
Energy: 1.4366663680012837
Energy: 1.3079994298554725
Energy: 1.2635140561335358
Energy: 1.5127813657247582
Energy: 1.312232903341494
Energy: 1.3118692703654107
Energy: 1.2627540899220209
Energy: 1.313591140070577
Energy: 1.3120484361785527
Energy: 1.2248865101504003
Energy: 1.3121155107384042
Energy: 1.311620640736014
Energy: 1.2249732861583442
Energy: 1.3125752989756359
Energy: 1.3097145569594582
Energy: 1.4407887324818143
Energy: 1.3120615405976448
Energy: 1.3122720455840975
Energy: 1.2392480847439393
Energy: 1.3128887656836865
Energy: 1.3111278048977042
Energy: 1.7792410776721472
Energy: 1.2625642894708056
Energy: 1.2252947404786467
Energy: 1.2255925353942911
Energy: 1.2619284841654859
Energy: 1.2263442590050655

minimum gb energy = 1.211336914324637 eV
minimum distance =  2.36864911913309 Angstroms
sigma value = 27


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

Energy: 1.5160720853157401
Energy: 1.654718873687737
Energy: 1.4845236881630202
Energy: 1.375577817218265
Energy: 1.2967162019966925
Energy: 1.4839872896072073
Energy: 1.4978107923210242
Energy: 1.2953831942690857
Energy: 1.2953084564221773
Energy: 1.1811047265315582
Energy: 1.2949138808124399
Energy: 1.2957154992984226
Energy: 1.3581632910001578
Energy: 1.2852578368532803
Energy: 1.2852809653965844
Energy: 1.1816266819257313
Energy: 1.285280350190744
Energy: 1.2850416787049719
Energy: 1.3572779109438762
Energy: 1.2851341931022338
Energy: 1.285193377642884
Energy: 1.181844037520428
Energy: 1.350994339747069
Energy: 1.2606499858089018
Energy: 1.4974421158295377
Energy: 1.1275276619283718
Energy: 1.1797191523487593
Energy: 1.28611132557906
Energy: 1.1268621359733484
Energy: 1.1802359195871612
Energy: 1.2845039588393092
Energy: 1.1278208972256376
Energy: 1.1268867148728343
Energy: 1.284506888266727
Energy: 1.127237942110368
Energy: 1.157618551014316
Energy: 1.3008324852545423
Energy: 1.1803238212481595
Energy: 1.2085129791950184
Energy: 1.300976173436915
Energy: 1.1829967498575964
Energy: 1.3005828591117246
Energy: 1.2965831591723416
Energy: 1.2102345336877696
Energy: 1.2548643024636361
Energy: 1.2965548279320955
Energy: 1.209844864755282
Energy: 1.2553676392507676
Energy: 1.3556977007712685
Energy: 1.2088790603835613
Energy: 1.1810464425307443
Energy: 1.295171981375881
Energy: 1.1750520597590945
Energy: 1.2064533813085447
Energy: 1.3565358854203329
Energy: 1.216224383519728
Energy: 1.2417605244369814
Energy: 1.217472747070577
Energy: 1.2181088703312717
Energy: 1.2160702341150118
Energy: 1.3574791059523554
Energy: 1.2938619266126834
Energy: 1.296207495127793
Energy: 1.2171376215109264
Energy: 1.2944245731861042
Energy: 1.2443506907287798
Energy: 1.3569771626307934
Energy: 1.286100488784317
Energy: 1.2060311499625027
Energy: 1.18344635355198
Energy: 1.2854771738047708
Energy: 1.2061018661555072

minimum gb energy = 1.1268621359733484 eV
minimum distance =  2.35259813847051 Angstroms
sigma value = 9


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

Energy: 2.383978778349219
Energy: 1.5678542894440348
Energy: 1.255634900409877
Energy: 1.2278622949180316
Energy: 1.489508089907395
Energy: 1.23022470986302
Energy: 1.0789062092312747
Energy: 1.1225557049109323
Energy: 1.1222128655372618
Energy: 1.1118923505400287
Energy: 1.12146776485282
Energy: 1.1299278176305174
Energy: 1.155678366617644
Energy: 1.1185556020803982
Energy: 1.1185141294148733
Energy: 1.1397063193239025
Energy: 1.1226420807014732
Energy: 1.1184557879945753
Energy: 1.157556123435151
Energy: 1.074366078009884
Energy: 1.0746069782730105
Energy: 1.1177467677046242
Energy: 1.1375065183340631
Energy: 1.0872566013235598
Energy: 1.3511671541177004
Energy: 1.1197366183014332
Energy: 1.1048249652006485
Energy: 1.1788996521596535
Energy: 1.119384216557847
Energy: 1.1744320212133434
Energy: 1.1795053581851265
Energy: 1.1295438166102219
Energy: 1.1032810857982498
Energy: 1.1796303053328805
Energy: 1.0797783360762327
Energy: 1.17107464164122
Energy: 1.1714046975932242
Energy: 1.0862227781954
Energy: 1.0853275497217443
Energy: 1.172627185534094
Energy: 1.1430195831645493
Energy: 1.17228614853929
Energy: 1.1739076825327197
Energy: 1.1193699815420397
Energy: 1.086812484576573
Energy: 1.1736141151235586
Energy: 1.1156104943064222
Energy: 1.1725686009466694
Energy: 1.3777967485387184
Energy: 1.1503064360338529
Energy: 1.171638654525693
Energy: 1.170308439933473
Energy: 1.1496426546333969
Energy: 1.2105604170852284
Energy: 1.059855054026017
Energy: 1.1482258125288396
Energy: 1.1483111956441816
Energy: 1.0784775698133329
Energy: 1.170299212927236
Energy: 1.1359975071184452
Energy: 1.0594610932633108
Energy: 1.1733100541146333
Energy: 1.1732688197122305
Energy: 1.1152463969666246
Energy: 1.1736761690836055
Energy: 1.2110717407241811
Energy: 1.155302400614379
Energy: 1.1793149516382342
Energy: 1.178270850276435
Energy: 1.0978058154527248
Energy: 1.174439519045231
Energy: 1.209413688892277
Energy: 2.0967807335915847
Energy: 1.16304560837645
Energy: 1.1182357274402643
Energy: 1.1186288985288169
Energy: 1.2622942524551828
Energy: 1.3216971001918847
Energy: 1.2508143295706886
Energy: 1.1730891476983458
Energy: 1.207267924156479
Energy: 1.0974038792177294
Energy: 1.1752742087835357
Energy: 1.1303353540022252
Energy: 1.123171635577495
Energy: 1.1533911705653723
Energy: 1.1533012228744108
Energy: 1.1220291288292408
Energy: 1.15391936606207
Energy: 1.1144169085898916
Energy: 1.1247379288581143
Energy: 1.0747655296817644
Energy: 1.0798917388443523
Energy: 1.1235605352049296
Energy: 1.144270312798788
Energy: 1.12153371139416
Energy: 1.127154520046515
Energy: 1.0957592378528451
Energy: 1.1181839153389084
Energy: 1.1271097217169046
Energy: 1.0952446560223543
Energy: 1.1226000718956048
Energy: 1.1574688963632196
Energy: 1.1146280422994228
Energy: 1.209244201283304
Energy: 1.1280746719382113
Energy: 1.115199024503736
Energy: 1.180416296112259
Energy: 1.1560374430123954
Energy: 1.1123541265260715
Energy: 1.075646428345451
Energy: 1.1184461421994165
Energy: 1.1407693483422934
Energy: 1.1011762867915154
Energy: 1.1568498531773135
Energy: 1.1132369238817938
Energy: 1.1154564773073208
Energy: 1.1128888102097676
Energy: 1.112594782553789
Energy: 1.0610894958667936
Energy: 1.1562483917535185
Energy: 1.115520595862759
Energy: 1.1201330984818325
Energy: 1.1270139774513914
Energy: 1.1165839429788218
Energy: 1.0839964589278956
Energy: 1.2509383640986385
Energy: 1.1234678688038813
Energy: 1.1802022540735133
Energy: 1.1251205945697451
Energy: 1.1226390692943138
Energy: 1.213266534616143
Energy: 1.2456554062264298
Energy: 1.1226300543901608
Energy: 1.1229409036345293
Energy: 1.1215091751373514
Energy: 1.1220438423925858
Energy: 1.1886921381902524
Energy: 1.1554950730595237
Energy: 1.12320936840584
Energy: 1.1183133796770008
Energy: 1.1464919677444119
Energy: 1.124426617268022
Energy: 1.1309878668608322
Energy: 1.5289097122798252
Energy: 1.1174338584841186
Energy: 1.1404229736058547
Energy: 1.1012865222881778
Energy: 1.1176057467908695
Energy: 1.1037101814758767
Energy: 1.1550151845469023
Energy: 1.0974313544679557
Energy: 1.0976906857976851
Energy: 1.1768793743758978
Energy: 1.097320583576006
Energy: 1.144726711105788
Energy: 1.1390235879478479
Energy: 1.1762612428244617
Energy: 1.1787909585581762
Energy: 1.1395307371264674
Energy: 1.1413496034650312
Energy: 1.1104441170530246
Energy: 1.1809539564230733
Energy: 1.086620017928498
Energy: 1.0882148277945032
Energy: 1.1804039275173057
Energy: 1.0974171841540625
Energy: 1.1780424622597867
Energy: 1.172445145126715
Energy: 1.1185734414333548
Energy: 1.1288335015704265
Energy: 1.1724891596508313
Energy: 1.1186327988746667
Energy: 1.1765392654886542
Energy: 1.153430134440105
Energy: 1.1190853270954413
Energy: 1.0864972829293507
Energy: 1.2112542281445207
Energy: 1.115675439933448
Energy: 1.1467619437664098
Energy: 1.0596921379486735
Energy: 1.148667699443316
Energy: 1.1829846816729375
Energy: 1.1131643336650736
Energy: 1.1484145974225983
Energy: 1.1469571931138307
Energy: 1.796974739143849
Energy: 1.1732693669579273
Energy: 1.1733370609843454
Energy: 1.0784689926477666
Energy: 1.1730539086801521
Energy: 1.1131740586464993
Energy: 1.3855648669003389
Energy: 1.1714282513517875
Energy: 1.1709851667883744
Energy: 1.1431327812385412
Energy: 1.175161551311539
Energy: 1.1714325633171674
Energy: 1.1611629837654698
Energy: 1.176677659674766
Energy: 1.1772188029608095
Energy: 1.112582158173384
Energy: 1.1767520036407282
Energy: 1.1126711168851415
Energy: 1.1531864716677864
Energy: 1.178423574262702
Energy: 1.1793571709811876
Energy: 1.1190057941678013
Energy: 1.1784700721300072
Energy: 1.1185352415166998
Energy: 1.1563139287319049
Energy: 1.1478724743589008
Energy: 1.1247035662016436
Energy: 1.1432426178460375
Energy: 1.15080500875668
Energy: 1.064819446600044
Energy: 1.1251842623091342
Energy: 1.1409269672979243
Energy: 1.09311504534858
Energy: 1.1271981101631026
Energy: 1.1383084932223582
Energy: 1.1194236289656774
Energy: 1.1211384435923135
Energy: 1.1160309908383579
Energy: 1.1111754558630238
Energy: 1.1211554972844182
Energy: 1.1124735001418273
Energy: 1.1216876009229886
Energy: 1.1227571320716188
Energy: 1.1797387090565972
Energy: 1.2102834154255373
Energy: 1.1293563870254735
Energy: 1.151270604167321
Energy: 1.1672892631094633
Energy: 1.1557345784197084
Energy: 1.1155991737223805
Energy: 1.1120237935738746
Energy: 1.121113243481807
Energy: 1.111073046962777
Energy: 1.097181357931581
Energy: 1.1547433261543534
Energy: 1.1155643767527814
Energy: 1.0911521279791696
Energy: 1.1119503242963362
Energy: 1.1156836553600724
Energy: 1.1130979404521855
Energy: 1.1563982902804097
Energy: 1.1134121690610606
Energy: 1.1148299748199277
Energy: 1.1133660104517262
Energy: 1.1128934392087815
Energy: 1.084862022132034
Energy: 1.2442995888759611
Energy: 1.1219117891056916
Energy: 1.1215911254408548
Energy: 1.1212262427559936
Energy: 1.1218967674585358
Energy: 1.08992405214532

minimum gb energy = 1.0594610932633108 eV
minimum distance =  2.32737979387159 Angstroms
sigma value = 57


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

Energy: 0.5564682590852978
Energy: 0.8596790642519659
Energy: 0.572788241370239
Energy: 0.5576728206189568
Energy: 0.6348146827592074
Energy: 0.5580164705195552
Energy: 0.9225081348721652
Energy: 0.588252351985113
Energy: 0.5900864908060096
Energy: 0.6223632887244911
Energy: 0.6265976858347833
Energy: 0.5937860718471614
Energy: 0.6940808597422989
Energy: 0.6326186125364276
Energy: 0.6332497103319066
Energy: 0.6245455307159502
Energy: 0.6318580898228697
Energy: 0.6337717566083118
Energy: 0.6950974253656625
Energy: 0.6335100539218539
Energy: 0.6339813715604153
Energy: 0.6262986110657021
Energy: 0.6911725349654667
Energy: 0.6333266915896242
Energy: 0.6870826160589352
Energy: 0.5584382707036377
Energy: 0.5887318024125366
Energy: 0.6883247649213685
Energy: 0.5577697213419284
Energy: 0.591940618467264
Energy: 0.631006380721579
Energy: 0.5578100403067265
Energy: 0.5584427863882311
Energy: 0.5913125027882271
Energy: 0.5578889965668262
Energy: 0.588312792187375
Energy: 0.621460769657691
Energy: 0.5875325331157297
Energy: 0.5900762023783999
Energy: 0.6222059262703917
Energy: 0.587967975898248
Energy: 0.6274211638857503
Energy: 0.634623958539587
Energy: 0.6309774138981609
Energy: 0.690643940736673
Energy: 0.6349009772079914
Energy: 0.6311453746067165
Energy: 0.6319274063432246
Energy: 0.6858336664711654
Energy: 0.6284572154507873
Energy: 0.6287542734127078
Energy: 0.630707645239515
Energy: 0.6244572782011003
Energy: 0.6329676308729828
Energy: 0.557141224639399
Energy: 0.6292641355837822
Energy: 0.5901897834181357
Energy: 0.5574670815391218
Energy: 0.6238273001926647
Energy: 0.5889541956235834
Energy: 0.5571457927246617
Energy: 0.5893865989957902
Energy: 0.5909883806905938
Energy: 0.5575686803719275
Energy: 0.593275893113134
Energy: 0.5897437359237646
Energy: 0.6871949760871972
Energy: 0.6268049918017494
Energy: 0.6359411371358161
Energy: 0.6249668035881821
Energy: 0.6245332721535394
Energy: 0.5931440919918888
Energy: 0.6956364049264068
Energy: 0.6965082007714163
Energy: 0.6918431529355229
Energy: 0.6907571507803065
Energy: 0.6956325431433416
Energy: 0.6916325649788587
Energy: 0.6865884893714684
Energy: 0.6262557013242044
Energy: 0.629652202764764
Energy: 0.6883621274344252
Energy: 0.6236034434151801
Energy: 0.593217130197339
Energy: 0.6946067508995829
Energy: 0.5575229072593244
Energy: 0.5578139425962299
Energy: 0.6273598337155524
Energy: 0.5602064631814464
Energy: 0.5591007286500841
Energy: 0.6262010146081449
Energy: 0.6337363192526492
Energy: 0.5936475053625889
Energy: 0.6272269359007693
Energy: 0.5583506774150996
Energy: 0.5909599188915983
Energy: 0.6301147184055729
Energy: 0.6342583022205415
Energy: 0.63109110751022
Energy: 0.6305676532143902
Energy: 0.6247353709266956
Energy: 0.6332545764228749
Energy: 0.6906547148439082
Energy: 0.6344932162351886
Energy: 0.6895865520666397
Energy: 0.6914044645350624
Energy: 0.6288718476672367
Energy: 0.6336821664646499
Energy: 0.5576386116168731
Energy: 0.5893659191472551
Energy: 0.5914608131520358
Energy: 0.5579520132604057
Energy: 0.6890717683424197
Energy: 0.6271674208905601

minimum gb energy = 0.5564682590852978 eV
minimum distance =  2.38785414600508 Angstroms
sigma value = 11


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

Energy: 1.8803927829569929
Energy: 1.438583990556176
Energy: 1.2711286538760678
Energy: 1.2582799631977764
Energy: 1.1013766294935643
Energy: 1.2704047374980632
Energy: 0.9183215326452391
Energy: 0.9178672359219592
Energy: 0.9669881693263837
Energy: 0.9376131448601007
Energy: 0.9248412112663733
Energy: 0.9587610014346528
Energy: 0.9219108674183691
Energy: 0.9432914396037047
Energy: 0.9323706686131589
Energy: 0.9231433681239168
Energy: 0.9179107084253749
Energy: 0.9473592431914821
Energy: 0.9223973385771275
Energy: 0.9568841816349009
Energy: 0.961145180116543
Energy: 0.9221741352815411
Energy: 0.9215014998507305
Energy: 0.9178124622133269
Energy: 0.9185814056478101
Energy: 1.0689062267868927
Energy: 1.0031697780712645
Energy: 0.9185095187040889
Energy: 1.069745212219078
Energy: 0.956605481175134
Energy: 1.2525878880921866
Energy: 1.001942121237073
Energy: 0.9913593911499874
Energy: 0.9192702698002553
Energy: 1.0232068776791698
Energy: 0.9809492744029963
Energy: 0.9900741569288782
Energy: 0.9470576462666856
Energy: 0.9394399948740813
Energy: 0.9191966883796764
Energy: 0.9345506518892214
Energy: 0.9316438160325909
Energy: 0.9403043814102618
Energy: 1.0327921869800942
Energy: 1.0346909751254405
Energy: 0.9415978458263828
Energy: 1.0313635772103023
Energy: 1.0341667746179548
Energy: 1.2536140283970048
Energy: 0.9246474242472499
Energy: 0.9547905690271749
Energy: 0.9354758762256123
Energy: 0.920599162865268
Energy: 1.0271398993447576
Energy: 1.5999821141628416
Energy: 0.9268450106610379
Energy: 1.0128562649499384
Energy: 1.137178376677598
Energy: 0.9543066642948103
Energy: 0.9910433313227971
Energy: 1.6125664809748068
Energy: 1.0051235355515231
Energy: 0.9923137043071033
Energy: 1.067931561031153
Energy: 0.976959950804747
Energy: 1.0013478010369568
Energy: 1.3788633816331537
Energy: 0.9011034168112223
Energy: 0.9301787115676704
Energy: 1.0790248026677416
Energy: 0.897299472224516
Energy: 0.9548031398191127
Energy: 1.1779718778105386
Energy: 0.8917510834318678
Energy: 0.9837783690746287
Energy: 1.178695455057997
Energy: 0.9001617849907368
Energy: 0.933504296473806
Energy: 1.0666414188386755
Energy: 1.0619803358256066
Energy: 1.0696083050224245
Energy: 1.0660896777909838
Energy: 0.9987394314181226
Energy: 1.0695565870152761
Energy: 1.0680715630107527
Energy: 1.2111923830246492
Energy: 1.212521437872909
Energy: 1.0666634811082643
Energy: 1.2091027648389243
Energy: 1.0709824704161828
Energy: 1.5843747727680972
Energy: 1.0261933811733246
Energy: 1.0692930992748235
Energy: 1.0674201813947333
Energy: 1.0671395786849318
Energy: 1.0696692815625721
Energy: 1.3694022056432231
Energy: 1.2728794121119986
Energy: 1.1894754294640681
Energy: 1.2897887107145585
Energy: 1.272982498011802
Energy: 0.9199271367109457
Energy: 1.6608023153627662
Energy: 0.9863315835708671
Energy: 0.9938588239274908
Energy: 0.944714520254204
Energy: 1.070055398694497
Energy: 1.0701598947061293
Energy: 1.5937727221327536
Energy: 0.9350637659388509
Energy: 0.9477762082154286
Energy: 0.9200458052842242
Energy: 1.1702187151891552
Energy: 1.002859959967698
Energy: 1.154647277088128
Energy: 1.2111456110185552
Energy: 1.047659852572178
Energy: 1.1291775562330417
Energy: 1.2174078580755072
Energy: 1.0383845433880676
Energy: 1.58490270972146
Energy: 1.0347186080888278
Energy: 1.0050069044392411
Energy: 0.9239453447945474
Energy: 1.131531044335278
Energy: 1.0012903349279954
Energy: 1.3904947104032903
Energy: 1.2585399082130702
Energy: 1.2594201712524478
Energy: 1.39051902963329
Energy: 1.1071035792198116
Energy: 0.9502270659119546
Energy: 0.9216429436120914
Energy: 1.0151187329179563
Energy: 0.9897666498199242
Energy: 0.9222005553200002
Energy: 0.9361475111512049
Energy: 1.0014253144323535
Energy: 1.0304371035842042
Energy: 0.9354535338027781
Energy: 0.9332925497714742
Energy: 1.027412781113203
Energy: 0.9268120879497127
Energy: 0.9200627987633747
Energy: 1.0477476491999071
Energy: 0.9309894229057571
Energy: 0.9303262283374335
Energy: 0.947968310607851
Energy: 0.9227800030100082
Energy: 0.9483598865357344
Energy: 1.553937384357961
Energy: 0.9763693614543433
Energy: 0.9477731402455525
Energy: 1.1933517960314584
Energy: 0.9195757394326932
Energy: 0.9195323543458528

minimum gb energy = 0.8917510834318678 eV
minimum distance =  2.35092713436998 Angstroms
sigma value = 41


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

Energy: 1.8030231415775932
Energy: 1.4267879347544437
Energy: 1.0434347066470386
Energy: 1.4466297838598123
Energy: 1.237638328841551
Energy: 1.4462490380782722
Energy: 0.9997145405009319
Energy: 1.005744021646852
Energy: 1.0243391135070286
Energy: 1.0096642884022466
Energy: 1.000433461781496
Energy: 1.022747278298964
Energy: 1.0008077687243193
Energy: 1.0070152638121461
Energy: 1.0029166719115736
Energy: 1.0010862922473245
Energy: 1.00316107567295
Energy: 1.001278169672988
Energy: 1.0018217319071852
Energy: 1.0273193066869772
Energy: 1.023822931166237
Energy: 1.00220828981197
Energy: 1.0020031936156255
Energy: 1.0033683921022278
Energy: 1.0000760259470698
Energy: 1.1314665614587192
Energy: 1.0481315648036658
Energy: 1.0006464245116344
Energy: 1.1278670809279117
Energy: 1.0239299115599154
Energy: 1.4398979798896931
Energy: 1.0513871271966932
Energy: 1.153564280088524
Energy: 1.000994801930603
Energy: 1.0272992452156127
Energy: 1.0354915332784012
Energy: 1.113146207509152
Energy: 1.0048300984054146
Energy: 1.0014046334569717
Energy: 1.000879896738598
Energy: 1.0366955538984894
Energy: 1.023520430737925
Energy: 1.0353351753498616
Energy: 1.178617417621424
Energy: 1.1779380985274306
Energy: 1.0411657805569845
Energy: 1.1790895587543124
Energy: 0.9878950358186463
Energy: 1.437811552971311
Energy: 1.1069587542053447
Energy: 1.106510784417354
Energy: 1.040203304314976
Energy: 1.1280348431746867
Energy: 1.024078801039211
Energy: 1.3703580790171346
Energy: 1.1311771199621756
Energy: 1.1579136591944277
Energy: 1.2858629856102763
Energy: 1.1312421417529501
Energy: 1.045743667616773
Energy: 1.370149744861667
Energy: 1.044123189851403
Energy: 1.0507510130700857
Energy: 1.0032246262283335
Energy: 1.0083559370469728
Energy: 1.023907813066654
Energy: 1.6495034815398577
Energy: 0.9636224046932519
Energy: 0.9609954526253165
Energy: 1.2566788545233791
Energy: 0.9624861908673319
Energy: 1.0262947982511357
Energy: 1.1299148913990504
Energy: 0.9617104691123204
Energy: 0.9614695829953955
Energy: 1.1299604375867127
Energy: 0.96199725343019
Energy: 1.0515121295353977
Energy: 1.1271941012535398
Energy: 1.0444244404807297
Energy: 1.0229812402746743
Energy: 1.0136241716676324
Energy: 1.036616445939912
Energy: 1.0227264368854452
Energy: 1.1858347900550368
Energy: 1.1334024963290825
Energy: 1.1927651696644423
Energy: 1.1860804317409905
Energy: 1.2063662407859468
Energy: 1.1889401960821273
Energy: 0.9998440316910228
Energy: 1.002973045906288
Energy: 1.0233788847946377
Energy: 1.0362436569293845
Energy: 1.001105794083733
Energy: 1.0022084715740713
Energy: 1.7033062529123142
Energy: 1.0326127861733632
Energy: 0.9609952384476601
Energy: 1.4471350307450594
Energy: 1.5327421135946555
Energy: 1.3894943972401101
Energy: 1.035973724315239
Energy: 1.032680806322606
Energy: 1.024396988532118
Energy: 1.039014259321189
Energy: 1.0006118332256455
Energy: 1.0134212378103407
Energy: 1.0018676968104185
Energy: 1.0049465198364418
Energy: 1.0039003704036955
Energy: 1.0015300417008406
Energy: 1.001194934517533
Energy: 1.0024948798062767
Energy: 1.0003158483860453
Energy: 1.018495643699992
Energy: 1.0013324327517124
Energy: 1.000890007698187
Energy: 1.0019887116110417
Energy: 1.0019578887629894
Energy: 0.9994304973355748
Energy: 1.0031288892452155
Energy: 1.0279313991167407
Energy: 0.9999733752993916
Energy: 1.0039124375033939
Energy: 1.0233589205446552
Energy: 1.1451707298812
Energy: 1.2117709067137112
Energy: 1.2115365247438767
Energy: 1.269862617046752
Energy: 1.2104507175071606
Energy: 1.2117446161051981
Energy: 1.4434894785472414
Energy: 1.0021537453423095
Energy: 1.0245426556643982
Energy: 1.0001947850129889
Energy: 1.0038983771845182
Energy: 1.0232893975310164
Energy: 1.0357138335630194
Energy: 1.2082773656580679
Energy: 1.1332241917673278
Energy: 1.0395241617217252
Energy: 1.2106123937979638
Energy: 0.9897197125607711
Energy: 1.112993022785499
Energy: 1.0013103031720674
Energy: 1.0236443054626234
Energy: 1.040492123085199
Energy: 1.0091702377446918
Energy: 1.0256603370906976
Energy: 1.3701233059842757
Energy: 1.0086936644418192
Energy: 1.0331392297599735
Energy: 1.002739522622513
Energy: 1.0088048793443019
Energy: 1.0476955456311927
Energy: 1.369626852168444
Energy: 1.1310461464866077
Energy: 1.0363820477119123
Energy: 1.2861878224814554
Energy: 1.1322218315998323
Energy: 1.0221297481580516
Energy: 1.4386587862062123
Energy: 0.9879550924316148
Energy: 1.1319202618741993
Energy: 1.0086495849404757
Energy: 0.9612187728632668
Energy: 1.0507252026864515
Energy: 1.1311459561711434
Energy: 1.0555369852903584
Energy: 1.173150397328871
Energy: 1.1314209389919276
Energy: 1.444110593647991
Energy: 1.2958701304763498
Energy: 1.125823282652185
Energy: 1.1399798585465264
Energy: 1.111655227397576
Energy: 1.1262625514628306
Energy: 1.1453559897527494
Energy: 1.1301689725508404
Energy: 1.130716844346673
Energy: 1.1332995248299467
Energy: 1.0103806983803536
Energy: 1.1319283480864326
Energy: 1.0231015658200895
Energy: 1.01000186095826
Energy: 1.000000587531939
Energy: 1.0052014801748006
Energy: 1.0255497138105967
Energy: 1.0140300916587737
Energy: 1.001753056623437
Energy: 1.029524250173112
Energy: 1.7036713814114688
Energy: 1.0570266678793534
Energy: 1.0121805878749197
Energy: 1.4513823006123696
Energy: 1.0015318389735044
Energy: 1.0129901175569198

minimum gb energy = 0.9609952384476601 eV
minimum distance =  2.35400529117665 Angstroms
sigma value = 33


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

Energy: 1.3540140172127604
Energy: 1.4278967828025446
Energy: 1.082187377196227
Energy: 1.0712802111986077
Energy: 1.1703669679587558
Energy: 1.2610517475451302
Energy: 1.1078095105653072
Energy: 1.0689069989923599
Energy: 1.0991434733407155
Energy: 1.1093306495602029
Energy: 1.089856997578879
Energy: 1.0982325089032545
Energy: 1.090007868114151
Energy: 1.0678962205125397
Energy: 1.0673235980895632
Energy: 1.0899390941781417
Energy: 1.108211810624799
Energy: 1.067186219116906
Energy: 1.0888494980405115
Energy: 1.1005716101764516
Energy: 1.0657026259626785
Energy: 1.0892247208090873
Energy: 1.1056392118625675
Energy: 1.066101991456633
Energy: 1.0891884106710739
Energy: 1.1163701821591836
Energy: 1.0378868170079398
Energy: 1.0905640819320195
Energy: 1.0876227543819978
Energy: 1.0682060958284847
Energy: 1.1405328118548574
Energy: 1.0391076750819428
Energy: 1.0719092047432766
Energy: 1.0888165992887542
Energy: 1.1106877611558057
Energy: 1.0405063977647382
Energy: 1.1418359581686042
Energy: 1.0762107769956033
Energy: 1.0689367955529914
Energy: 1.0925553285418896
Energy: 1.1093463230696772
Energy: 1.1106109082887703
Energy: 1.134354596126053
Energy: 1.1617602847266806
Energy: 1.0708754804955976
Energy: 1.1639069233990842
Energy: 1.1627883565352921
Energy: 1.0725108540567856
Energy: 1.1410753941106762
Energy: 1.0356060487544807
Energy: 1.0738251034057946
Energy: 1.1855497456821769
Energy: 1.038022504918178
Energy: 1.0734397094206605
Energy: 1.6018430381092594
Energy: 1.0650475546948799
Energy: 1.0684075326544082
Energy: 1.0897026275041335
Energy: 1.1088569931562906
Energy: 1.0650325402251017
Energy: 1.13890546700699
Energy: 1.0768501523028913
Energy: 1.06675883542286
Energy: 1.0879305144472247
Energy: 1.0746259141489838
Energy: 1.071766204827226
Energy: 1.1400869637360784
Energy: 1.034333426626419
Energy: 1.0334433207122788
Energy: 1.0897207730247331
Energy: 1.0333957711085155
Energy: 1.100109166928437
Energy: 1.0906526603300173
Energy: 1.0342008357897312
Energy: 1.0334393723804642
Energy: 1.0889334952667935
Energy: 1.0333731436883993
Energy: 1.1021100461323758
Energy: 1.0952099927036856
Energy: 1.0671832657503864
Energy: 1.0702984226227257
Energy: 1.0967468165712162
Energy: 1.1636813663957994
Energy: 1.069254267036888
Energy: 1.0346748367635952
Energy: 1.0658884248147238
Energy: 1.065644667871359
Energy: 1.1089248174831687
Energy: 1.0661138026691308
Energy: 1.0677023258018241
Energy: 1.0894743879751283
Energy: 1.0879311668804172
Energy: 1.0650454799138567
Energy: 1.147975260417828
Energy: 1.0925318217116404
Energy: 1.0655058748473807
Energy: 1.59229450187025
Energy: 1.1651646611332183
Energy: 1.3916632621804557
Energy: 1.4676204394402725
Energy: 1.1671064313785298
Energy: 1.0412054678868843
Energy: 1.1403670525763263
Energy: 1.1168571049309444
Energy: 1.0371461400743698
Energy: 1.096189433144827
Energy: 1.1623059046420552
Energy: 1.037285122334603
Energy: 1.08746438151896
Energy: 1.1635881887221549
Energy: 1.0386771717569887
Energy: 1.0363447187755062
Energy: 1.1363475780783627
Energy: 1.0664067988826358
Energy: 1.0388798271498783
Energy: 1.105380103863269
Energy: 1.0359976018851695
Energy: 1.0390184533269275
Energy: 1.1379161875334565
Energy: 1.0660701996408688
Energy: 1.0376287618033135
Energy: 1.0371464336598093
Energy: 1.0392195240848048
Energy: 1.0364953410100228
Energy: 1.1090819686147453
Energy: 1.0728346994529663
Energy: 1.0738262718805567
Energy: 1.1094915163132777
Energy: 1.1093183256240067
Energy: 1.1674939976330587
Energy: 1.038377264622926
Energy: 1.3891757364146367
Energy: 1.0877486264817096
Energy: 1.1411010695622068
Energy: 1.099444094672601
Energy: 1.0374219659315214
Energy: 1.090752689731775
Energy: 1.0374922019681772
Energy: 1.1374828151113126
Energy: 1.4360656785241865
Energy: 1.1483238413358132
Energy: 1.047064122481088
Energy: 1.4365373682897036
Energy: 1.1741657155605285
Energy: 1.1391334146085932
Energy: 1.0686037265542787
Energy: 1.1000386244205593
Energy: 1.0358761040797002
Energy: 1.0883934325093592
Energy: 1.0658971734522025
Energy: 1.0889724162783039
Energy: 1.1074570209685397
Energy: 1.0669338501678423
Energy: 1.0894709053568332
Energy: 1.0921021828975415
Energy: 1.0671761577335561
Energy: 1.0895720711182135
Energy: 1.0663015027958214
Energy: 1.1002631771770581
Energy: 1.089817312826909
Energy: 1.0899223282528594
Energy: 1.068881733799601
Energy: 1.087847584925453
Energy: 1.0735616421178225
Energy: 1.0689445415317513
Energy: 1.0889810778094708
Energy: 1.0984773373063548
Energy: 1.0980003836644596
Energy: 1.434137106864524
Energy: 1.038681352332312
Energy: 1.1107241979612814
Energy: 1.4345222069538035
Energy: 1.3835316790286072
Energy: 1.0662034484033218
Energy: 1.1399388095703935
Energy: 1.0742880530593641
Energy: 1.0725299127316001
Energy: 1.0893726543176274
Energy: 1.1109214808878245
Energy: 1.0662689285136866
Energy: 1.1333879795837354
Energy: 1.1662047583806139
Energy: 1.0708451612225252
Energy: 1.164555942894707
Energy: 1.1654401354928672
Energy: 1.0688623639242063
Energy: 1.1437266659739784
Energy: 1.0742257153371917
Energy: 1.0733392209442862
Energy: 1.125140600045481
Energy: 1.039815304493316
Energy: 1.0731106018171304
Energy: 1.1396642622969293
Energy: 1.0752859357821036
Energy: 1.0741453861907662
Energy: 1.0882487453998355
Energy: 1.0381688588804017
Energy: 1.06682452252291
Energy: 1.1395447873271283
Energy: 1.1122994316689154
Energy: 1.075771685625964
Energy: 1.0879641218614873
Energy: 1.0374619447595177
Energy: 1.066521780707862
Energy: 1.1400651986766843
Energy: 1.1076446318624205
Energy: 1.0338305285033202
Energy: 1.0876187522717913
Energy: 1.0425749188241364
Energy: 1.0362873822163143
Energy: 1.0888657661774364
Energy: 1.0343454817542768
Energy: 1.034306235415318
Energy: 1.1653774861496422
Energy: 1.0370174952892643
Energy: 1.035257193350385
Energy: 1.090740087023858
Energy: 1.1124494305838135
Energy: 1.0671325282772672
Energy: 1.092109954566545
Energy: 1.0671523562976857
Energy: 1.0660024958141714
Energy: 1.0799073042188467
Energy: 1.066368501552883
Energy: 1.068106560691826
Energy: 1.07973792974568
Energy: 1.1092803540233527
Energy: 1.0672212397009566
Energy: 1.0910684973261036
Energy: 1.10992400818255
Energy: 1.0668770939771934
Energy: 1.1169240963070088
Energy: 1.0960661738850535
Energy: 1.067857087727604
Energy: 1.5921958226705675
Energy: 1.0905349750073374
Energy: 1.1273655678827648
Energy: 1.471099336719756
Energy: 1.0906916351126636
Energy: 1.0399830968788712
Energy: 1.5919767985449977
Energy: 1.1182510730205601
Energy: 1.117309958968435
Energy: 1.0870960919033006
Energy: 1.163603960705269
Energy: 1.036766400030163
Energy: 1.096208584417521
Energy: 1.161734242494032
Energy: 1.0356178830274216
Energy: 1.1097304753811381
Energy: 1.1344418338865108
Energy: 1.0741095216722647
Energy: 1.0385670852340005
Energy: 1.163550745299503
Energy: 1.0365384782917189
Energy: 1.0385297590998357
Energy: 1.165055318731536
Energy: 1.0375017461303657
Energy: 1.035846217263922
Energy: 1.1691433915718572
Energy: 1.0728062447001274
Energy: 1.0368922354213679
Energy: 1.1802397758156395
Energy: 1.072842151383789
Energy: 1.1620737227799833
Energy: 1.1094402640837835
Energy: 1.1090726286630175
Energy: 1.1623091364304416
Energy: 1.3854506400256277
Energy: 1.1632377801782179
Energy: 1.0886824603139962
Energy: 1.143155644794048
Energy: 1.1013233846079555
Energy: 1.0723286809332306
Energy: 1.0933919088827961
Energy: 1.0678044321587319
Energy: 2.0559319284737367
Energy: 1.1439214672076925
Energy: 1.0337831816387608
Energy: 1.033425780371016
Energy: 1.4356438087283143
Energy: 1.034948921627259

minimum gb energy = 1.0333731436883993 eV
minimum distance =  2.34623191190316 Angstroms
sigma value = 67


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

Energy: 1.5711588450025444
Energy: 1.4882111924673171
Energy: 1.1452030634342742
Energy: 1.1434805511131692
Energy: 1.1887479692212568
Energy: 1.1484610196515046
Energy: 1.1760054489201388
Energy: 1.1384755683932533
Energy: 1.13704375320376
Energy: 1.176179000657369
Energy: 1.1730969348006326
Energy: 1.136329533874838
Energy: 1.1775006614583263
Energy: 1.1130680370162835
Energy: 1.1424227979472013
Energy: 1.1395606237066527
Energy: 1.1128536298346159
Energy: 1.1426998942441067
Energy: 1.1743102858318324
Energy: 1.13680549135115
Energy: 1.137982802469975
Energy: 1.174474695518149
Energy: 1.1397521714427425
Energy: 1.138131313428332
Energy: 1.1731255166466836
Energy: 1.1393603498822726
Energy: 1.1401439847944106
Energy: 1.1735103427406872
Energy: 1.1387085295779822
Energy: 1.140904495224378
Energy: 1.1811123990832042
Energy: 1.1587675136453657
Energy: 1.1445657564029201
Energy: 1.1810706101749158
Energy: 1.159357380325942
Energy: 1.1784728864065488
Energy: 1.2338256399282892
Energy: 1.1381437370342182
Energy: 1.1364543768851747
Energy: 1.2345123089558474
Energy: 1.1729014415403518
Energy: 1.1355426800085515

minimum gb energy = 1.1128536298346159 eV
minimum distance =  2.36847610991984 Angstroms
sigma value = 3


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

Energy: 2.1404751733492464
Energy: 1.472857498882655
Energy: 1.2986513554998813
Energy: 1.2568350435007067
Energy: 1.9966214638276465
Energy: 1.2874961956490256
Energy: 1.2217278122553221
Energy: 1.2473011341381068
Energy: 1.2478689922104713
Energy: 1.256020016143965
Energy: 1.4389352988895165
Energy: 1.2311692330928832
Energy: 1.2798119567372535
Energy: 1.2255660862711453
Energy: 1.2247379636473086
Energy: 1.2611374789738032
Energy: 1.2254430186959826
Energy: 1.2326516046001175
Energy: 1.231632278318764
Energy: 1.2319872183841725
Energy: 1.2313970499093418
Energy: 1.2328541084186537
Energy: 1.2250705280671517
Energy: 1.2314772899498976
Energy: 1.2400828930050907
Energy: 1.2274835479434
Energy: 1.22947012211072
Energy: 1.2403397297241199
Energy: 1.2734877186165305
Energy: 1.229747535231763
Energy: 1.2257964600156595
Energy: 1.2259514902587836
Energy: 1.2294049083990157
Energy: 1.227038316800141
Energy: 1.2817574662992348
Energy: 1.2291269697266243
Energy: 1.2262830124480546
Energy: 1.3578266597641455
Energy: 1.2967656146071582
Energy: 1.256073888725559
Energy: 1.315145404432085
Energy: 1.294097384700862
Energy: 1.5853160929070471
Energy: 1.429378711457814
Energy: 1.3669884648530386
Energy: 1.227975565173472
Energy: 1.322344150555944
Energy: 1.2565081805383802
Energy: 1.2276064641706663
Energy: 1.2265347431163542
Energy: 1.287266356712553
Energy: 1.2603844931701547
Energy: 1.2356335779141778
Energy: 1.25277904203902
Energy: 1.4377294880072649
Energy: 1.249643776953697
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Energy: 1.2274317083186026
Energy: 1.300349736020822
Energy: 1.2913570487734853
Energy: 1.2274103719191196
Energy: 1.2777581656456445
Energy: 1.2924759276184319
Energy: 1.2522157752165757
Energy: 1.2841835564999193
Energy: 1.3191336427653813
Energy: 1.2286272033120256
Energy: 1.2280571927264872
Energy: 1.3119601575641908
Energy: 1.2344658223140808
Energy: 1.2278115575710187
Energy: 1.2863358886278307
Energy: 1.2275224322988716
Energy: 1.2286290480001274
Energy: 1.2228535380943948
Energy: 1.2257534915817767
Energy: 1.2287033066853088
Energy: 1.323640815599086
Energy: 1.2345212355479396
Energy: 1.2259345880642742
Energy: 1.3444488575594074
Energy: 1.230061915478442
Energy: 1.2262649122568516
Energy: 1.3445426908246683
Energy: 1.235375981599758
Energy: 1.393116994063544
Energy: 1.227651904458289
Energy: 1.2344949177504534
Energy: 1.2315645580087382
Energy: 1.3096672648792165
Energy: 1.2323124753077221
Energy: 1.228513078542588
Energy: 1.2780761804633336
Energy: 1.2515457767804525
Energy: 1.2251933236248436
Energy: 1.4433315584214241
Energy: 1.2812629161593252
Energy: 1.257415253203127
Energy: 1.4442369248838276
Energy: 1.2257904586027437
Energy: 1.349134461141846
Energy: 1.3414163038521012
Energy: 1.222718307564001
Energy: 1.2743919489957447
Energy: 1.289283575542441
Energy: 1.228774068630963
Energy: 1.2866116513140609
Energy: 1.5873372379197237
Energy: 1.2705441157911121
Energy: 1.2742170709191065
Energy: 1.2255190226168833
Energy: 1.2398532535080935
Energy: 1.2499489792409397
Energy: 1.4648956194374156
Energy: 1.2757656118363905
Energy: 1.2764153836094223
Energy: 1.227245762024169
Energy: 1.2681291796368446
Energy: 1.2468847691355478
Energy: 1.2628406171459416
Energy: 1.2836992759896113
Energy: 1.2916402149241453
Energy: 1.291746150951695
Energy: 1.2845470388858127
Energy: 1.2883100271041426
Energy: 1.2635044329730911
Energy: 1.3512901437691058
Energy: 1.2708113600930782
Energy: 1.2707283192099632
Energy: 1.2866569340794567
Energy: 1.273136314952168
Energy: 1.2720199479030327
Energy: 1.2790565184470646
Energy: 1.2943464975155496
Energy: 1.2743836779025552
Energy: 1.2346475402189736
Energy: 1.2859763640724406
Energy: 1.2689109384758246
Energy: 1.228769894062066
Energy: 1.2268875779303987
Energy: 1.266211419241299
Energy: 1.2282060184606178
Energy: 1.260390026214237
Energy: 1.2309972561983202
Energy: 1.2225402956083455
Energy: 1.222828468806343
Energy: 1.2623002512904928
Energy: 1.2741176836113826
Energy: 1.2232157841690456
Energy: 1.592657838410763
Energy: 1.391230921829182
Energy: 1.264790863307425
Energy: 1.2240206177899904
Energy: 1.3747675341473469
Energy: 1.2921305354882062
Energy: 1.2253286227779792
Energy: 1.3910756015946155
Energy: 1.3249293303875065
Energy: 1.2250833881400263
Energy: 1.377290170124202
Energy: 1.2866027392941362
Energy: 1.2351032861524938
Energy: 1.2228080083397774
Energy: 1.2236645880489325
Energy: 1.226801569156816
Energy: 1.251187656751836
Energy: 1.2250288044862312
Energy: 1.2426029979156974
Energy: 1.2259605227432577
Energy: 1.2253057785595356
Energy: 1.242753518624417
Energy: 1.2267397127364132
Energy: 1.2445078339252638
Energy: 1.238063067539087
Energy: 1.2730031904273125
Energy: 1.2632670309876266
Energy: 1.2407956431475482
Energy: 1.2543473357159367
Energy: 1.2450488181285853
Energy: 1.2370906807294928
Energy: 1.2678361605919655
Energy: 1.2460063706713729
Energy: 1.2470113340069013
Energy: 1.3290392683130658
Energy: 1.2454442489082578
Energy: 1.2479466144692195
Energy: 1.29798463570015
Energy: 1.288899982303133
Energy: 1.277632390207585
Energy: 1.3708918038009679
Energy: 1.2641607712924567
Energy: 1.4850959072774403
Energy: 1.3408696728531093
Energy: 1.3186442836930863
Energy: 1.2261356247165172
Energy: 1.3361254569537668
Energy: 1.2495160446600873
Energy: 1.2683617191555472
Energy: 1.3393196029607621
Energy: 1.3566565430911275
Energy: 1.254697147877376
Energy: 1.3489895815717978
Energy: 1.2553293094761224
Energy: 1.3572741730829256
Energy: 1.2538638502422152
Energy: 1.2956743024893083
Energy: 1.362679974679003
Energy: 1.255187487547096
Energy: 1.2939090752859388
Energy: 1.3195877555193625
Energy: 1.2473911095206254
Energy: 1.2395854717760812
Energy: 1.320691783528062
Energy: 1.2270736632958723
Energy: 1.3005094457056305
Energy: 1.3195380120333668
Energy: 1.2308867043343388
Energy: 1.2311577074113784
Energy: 1.3135667293894022
Energy: 1.2887834678945087
Energy: 1.2292963315440997
Energy: 1.2864828175269971
Energy: 1.2289175819497804
Energy: 1.2291775568187846
Energy: 1.2269549991401447
Energy: 1.2260433770096368
Energy: 1.2284350531658148
Energy: 1.3323567648358514
Energy: 1.2250652451230104
Energy: 1.2247904966327259
Energy: 1.3521628601903328
Energy: 1.2311103153072551
Energy: 1.2261529561713471
Energy: 1.3408816045008376
Energy: 1.2274856244737165
Energy: 1.2275170293962745
Energy: 1.226800957482507
Energy: 1.2280389900837771
Energy: 1.2278714362991316
Energy: 1.3493381346207278
Energy: 1.228497832246234
Energy: 1.2275112532062382
Energy: 1.3138285361305633
Energy: 1.2527254394025649
Energy: 1.2256171823380915
Energy: 1.4009724564708372
Energy: 1.22214513339424
Energy: 1.2220354065016417
Energy: 1.4008488164629689
Energy: 1.249479320543788
Energy: 1.2835733647025631
Energy: 1.5567494431469817
Energy: 1.2646278701729112
Energy: 1.2511593853453529
Energy: 1.4569203173342538
Energy: 1.2252762788624085
Energy: 1.3597961712114226
Energy: 1.2570460869536286
Energy: 1.233533524907401
Energy: 1.2270332180948271
Energy: 1.2318704136213592
Energy: 1.227134303246899
Energy: 1.2258110602957888
Energy: 1.841744271076677
Energy: 1.248009491522092
Energy: 1.2384310812909323
Energy: 1.27175643325994
Energy: 1.2464991387043547
Energy: 1.2387249867932044
Energy: 1.2610309901396086
Energy: 1.2707551506983283
Energy: 1.272295929622785
Energy: 1.2773066086953495
Energy: 1.2609010185884526
Energy: 1.2726619203491882
Energy: 1.2542075010049476
Energy: 1.2621312581232895
Energy: 1.257638737731212
Energy: 1.2581376500081793
Energy: 1.2723016336768902
Energy: 1.2578581087700187
Energy: 1.2468402286059919
Energy: 1.2591546848455955
Energy: 1.2607930950771433
Energy: 1.2480855456289874
Energy: 1.2703985259385155
Energy: 1.261761788308113
Energy: 1.2489512349765592
Energy: 1.2246954525797196
Energy: 1.2332613044303378
Energy: 1.249522618225286
Energy: 1.225107739865059
Energy: 1.269192142533786
Energy: 1.2306255999517592
Energy: 1.225608285612507
Energy: 1.2252727123292508
Energy: 1.3816700728401792
Energy: 1.2263435794938173
Energy: 1.2344825660414718
Energy: 1.2218648657175375
Energy: 1.3012370879587412
Energy: 1.279140384430928
Energy: 1.3014770740232162
Energy: 1.3365002286388077
Energy: 1.2874922703650011

minimum gb energy = 1.2217278122553221 eV
minimum distance =  2.31525819226432 Angstroms
sigma value = 81


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

Energy: 2.2094876246702704
Energy: 1.4665023663428252
Energy: 1.2136363284024079
Energy: 1.2138401131888397
Energy: 1.4338948028143328
Energy: 1.2135821145951373
Energy: 1.2262016701791731
Energy: 1.271693007643026
Energy: 1.2721350284874422
Energy: 1.2494236937795877
Energy: 1.2069360638122066
Energy: 1.2828919603632658
Energy: 1.2499896788107956
Energy: 1.205301687862143
Energy: 1.2037631833927498
Energy: 1.248507289552368
Energy: 1.247851016489743
Energy: 1.2394591059122018
Energy: 1.2416636149920737
Energy: 1.2715449689870875
Energy: 1.2405024398313458
Energy: 1.2418580545641666
Energy: 1.2569585233116005
Energy: 1.2425722410358464
Energy: 1.2444614531000937
Energy: 1.2750162878333953
Energy: 1.275798008384805
Energy: 1.2445547211745218
Energy: 1.2800137386355064
Energy: 1.2790047837901133
Energy: 1.2884555394316843
Energy: 1.275348924592758
Energy: 1.2747878280330605
Energy: 1.3000412937481725
Energy: 1.2828033729528803
Energy: 1.2746186719194155
Energy: 1.2414391255250337
Energy: 1.2906919857829642
Energy: 1.242829315834939
Energy: 1.2545364186534549
Energy: 1.2507947764441854
Energy: 1.2422545317692146
Energy: 1.271747832864901
Energy: 1.3900743315902775
Energy: 1.3894244865764833
Energy: 1.1927595343592696
Energy: 1.3823413081751543
Energy: 1.2956257508761295
Energy: 1.2228853489940292
Energy: 1.2489113794604454
Energy: 1.2412286951668157
Energy: 1.2689896978967175
Energy: 1.2077917826039013
Energy: 1.287144964748157
Energy: 1.2629763049394656
Energy: 1.163459481339965
Energy: 1.1627033718635287
Energy: 1.2645627549796647
Energy: 1.1565540186071823
Energy: 1.161528772853757
Energy: 1.2312679670957212
Energy: 1.1636455260832903
Energy: 1.1625069758777886
Energy: 1.2698866242733435
Energy: 1.1979224989786883
Energy: 1.2017659632255921
Energy: 1.2298317641482286
Energy: 1.2026167177684977
Energy: 1.1973117248935659
Energy: 1.256374745611381
Energy: 1.2034303373447452
Energy: 1.1960667837014247
Energy: 1.231337030800503
Energy: 1.2673504944534622
Energy: 1.3106586744605184
Energy: 1.2297375577036505
Energy: 1.2623640787424604
Energy: 1.2690119050149558
Energy: 1.2293589061527994
Energy: 1.2801598817603896
Energy: 1.2794065703056425
Energy: 1.274026324595585
Energy: 1.2764535171585498
Energy: 1.2807184506441358
Energy: 1.2917863874138364
Energy: 1.2850265479711036
Energy: 1.2866897560824397
Energy: 1.2871376828551777
Energy: 1.2843840877540562
Energy: 1.2867902989656792
Energy: 1.26632302021568
Energy: 1.2841910404288626
Energy: 1.2855371280544798
Energy: 1.26592959029172
Energy: 1.2136951665580853
Energy: 1.286166084373451
Energy: 1.4232453293063765
Energy: 1.1970981286479412
Energy: 1.212204794610593
Energy: 1.4231329887841038
Energy: 1.192330166124193
Energy: 1.2570187916657674
Energy: 1.2130331001384633
Energy: 1.2120146906493698
Energy: 1.258551946592077
Energy: 1.2091834834385522
Energy: 1.2372842183338928
Energy: 1.257695545075201
Energy: 1.163419386466954
Energy: 1.215303760846194
Energy: 1.1635789703915906
Energy: 1.16014360108086
Energy: 1.2848521455295319
Energy: 1.1635910166220482
Energy: 1.163538106566837
Energy: 1.215035448396368
Energy: 1.1651735951088384
Energy: 1.1584615259830322
Energy: 1.2625871441415961
Energy: 1.1650821933811604
Energy: 1.2137873801205732
Energy: 1.2128517058151653
Energy: 1.2564938424196817
Energy: 1.2085335710784455
Energy: 1.236490059896642
Energy: 1.26626736774425
Energy: 1.2623168820546222
Energy: 1.204815078181132
Energy: 1.2627597083983604
Energy: 1.2626336110560088
Energy: 1.2057752472137557
Energy: 1.3396829082519082
Energy: 1.2581975660566596
Energy: 1.3098676976672532
Energy: 1.2818314928622618
Energy: 1.2597388471705935
Energy: 1.2134029046862844
Energy: 1.2746546085514499
Energy: 1.2650112858680727
Energy: 1.3210150748459943
Energy: 1.2833229470172933
Energy: 1.2813400107548871
Energy: 1.3208602871049944
Energy: 1.281832378483789
Energy: 1.2619289482346834
Energy: 1.289448244731236
Energy: 1.2827279001243077
Energy: 1.2930049293613504
Energy: 1.2833658631196372
Energy: 1.2825860409208887
Energy: 1.2715194799791831
Energy: 1.4632136307708754
Energy: 1.3607490495437276
Energy: 1.2694309531573302
Energy: 1.463186487175309
Energy: 1.3040075733059888
Energy: 1.2452653089018917
Energy: 1.3013282132429178
Energy: 1.3023450207722724
Energy: 1.2824558383540363
Energy: 1.4094262655789402
Energy: 1.2392785172368586
Energy: 1.2254165106982418
Energy: 1.1629923420058448
Energy: 1.1984133179541656
Energy: 1.2751385537020923
Energy: 1.212628359357596
Energy: 1.2312539614572102
Energy: 1.239052548890588
Energy: 1.1620247280607205
Energy: 1.1610347892137445
Energy: 1.2411870294275085
Energy: 1.163251368297644
Energy: 1.1606227582437094
Energy: 1.2268614809486946
Energy: 1.2022208708579438
Energy: 1.2488403392004275
Energy: 1.2756762635982035
Energy: 1.2070717195560279
Energy: 1.2004636014863965
Energy: 1.2288353366773626
Energy: 1.3380205649801555
Energy: 1.336606446986851
Energy: 1.2076720383028994
Energy: 1.346928904943625
Energy: 1.2032413547272314
Energy: 1.2282569795545208
Energy: 1.2462306729909578
Energy: 1.198640420625748
Energy: 1.2362419065722194
Energy: 1.2419590178570228
Energy: 1.1979259133924616
Energy: 1.2510710006052315
Energy: 1.2628757547813236
Energy: 1.267116285634232
Energy: 1.2855703568519738
Energy: 1.2501620036635834
Energy: 1.2673892879904736
Energy: 1.2509705950758427
Energy: 1.2752680006305506
Energy: 1.275208151149005
Energy: 1.2869753785412414
Energy: 1.2754172535018429
Energy: 1.2724506293854336
Energy: 1.4418355740860274
Energy: 1.2783307025169335
Energy: 1.2834882177079392
Energy: 1.4429162051985962
Energy: 1.2686092927468282
Energy: 1.2834682649864415
Energy: 1.4531404302538962
Energy: 1.1918805082702504
Energy: 1.192128129260274
Energy: 1.4526552686948566
Energy: 1.1919874369865553
Energy: 1.342087545066181
Energy: 1.2413943864549435
Energy: 1.2703843159365562
Energy: 1.2809645537511154
Energy: 1.2490022090355006
Energy: 1.2065977451229892
Energy: 1.2816011872641502
Energy: 1.1929541161680433
Energy: 1.2788821337080856
Energy: 1.2134582450339495
Energy: 1.2106892524649804
Energy: 1.279350163340629
Energy: 1.2121064346368615

minimum gb energy = 1.1565540186071823 eV
minimum distance =  2.3137698463428 Angstroms
sigma value = 43


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

Energy: 2.1825235452383103
Energy: 1.4992423480079282
Energy: 1.316551170765468
Energy: 1.269073203317388
Energy: 1.5841964018753334
Energy: 1.2690429897372733
Energy: 1.2123067600615198
Energy: 1.2076158405530066
Energy: 1.2611248497645502
Energy: 1.2264257835202519
Energy: 1.2075608137250446
Energy: 1.2126149663503083
Energy: 1.2070302539049949
Energy: 1.184239283760539
Energy: 1.1842691262798126
Energy: 1.3164257771043386
Energy: 1.1841861979443995
Energy: 1.2145623980599647
Energy: 1.2130028483638815
Energy: 1.1840255566028195
Energy: 1.2129905337779143
Energy: 1.2135597840744914
Energy: 1.2734217923741618
Energy: 1.2127965204931694
Energy: 1.2131511150552794
Energy: 1.245513567982378
Energy: 1.261569439427898
Energy: 1.2134452187101175
Energy: 1.252674664959971
Energy: 1.2526200892756338
Energy: 1.2155514783975467
Energy: 1.2530934967452627
Energy: 1.263978754147122
Energy: 1.2584375588242873
Energy: 1.2392490378910042
Energy: 1.261953326095145
Energy: 1.2120777114277528
Energy: 1.2120332630901702
Energy: 1.2126479137428012
Energy: 1.2123628700795508
Energy: 1.2127448718347162
Energy: 1.2135254306024876
Energy: 1.2392962155155387
Energy: 1.217268475503916
Energy: 1.2170372265276301
Energy: 1.1907365768906464
Energy: 1.217392140866146
Energy: 1.2181826948722723
Energy: 1.2038301328417003
Energy: 1.2132404595920125
Energy: 1.2136230789170006
Energy: 1.2038578587720332
Energy: 1.2131286766800928
Energy: 1.212812544563606
Energy: 1.5252876700553972
Energy: 1.2141107519965813
Energy: 1.213524388442203
Energy: 1.4170274583725422
Energy: 1.2136959772525326
Energy: 1.313089189362996
Energy: 1.1929411216897376
Energy: 1.2481006387188809
Energy: 1.249831014438947
Energy: 1.2042158804059058
Energy: 1.2646795528354022
Energy: 1.2745231686094454
Energy: 1.2216112592492592
Energy: 1.212372296776318
Energy: 1.212533006991495
Energy: 1.2166547069060598
Energy: 1.2121512917763904
Energy: 1.2125841844460086
Energy: 1.2196032791477363
Energy: 1.2167873195234273
Energy: 1.2392078706600993
Energy: 1.1854284068601904
Energy: 1.292342343839276
Energy: 1.2385706522300337
Energy: 1.1920945504513953
Energy: 1.2132634158081048
Energy: 1.289362723020163
Energy: 1.2038892553449878
Energy: 1.2128748993131733
Energy: 1.2280933109944185
Energy: 1.1934463097511567
Energy: 1.2020761563595093
Energy: 1.2022294381829555
Energy: 1.202573395475476
Energy: 1.2023474447081057
Energy: 1.2185653458210228
Energy: 1.191664985756179
Energy: 1.2011808290103427
Energy: 1.2055073442911497
Energy: 1.1909827268926212
Energy: 1.2307599315501099
Energy: 1.1905362325729172
Energy: 1.192757725622143
Energy: 1.2133323790169708
Energy: 1.2103375416844548
Energy: 1.1937061077632178
Energy: 1.214925537585283
Energy: 1.2100629508200857
Energy: 1.1923250823802147
Energy: 1.1952190621649137
Energy: 1.2091179912164811
Energy: 1.2188437092350923
Energy: 1.2034228031066603
Energy: 1.2087111889837165
Energy: 1.2044406322892494
Energy: 1.1949134546044768
Energy: 1.1939915837486321
Energy: 1.3404757177487776
Energy: 1.1945480978484821
Energy: 1.2119996580686876
Energy: 1.2036081783425607
Energy: 1.195201703961643
Energy: 1.1943630876914375
Energy: 1.2252263605097773
Energy: 1.3589588456368875
Energy: 1.2124027412749014
Energy: 1.1918757633564647
Energy: 1.2164841810366096
Energy: 1.1941772571096576
Energy: 1.2155693103988892
Energy: 1.2187642696008487
Energy: 1.2094941859939914
Energy: 1.3643567488533084
Energy: 1.2437592127292605
Energy: 1.2385167112914086
Energy: 1.3633293322290656
Energy: 1.186874441309522
Energy: 1.3969246873399663
Energy: 1.2428505979823388
Energy: 1.1926038581475558
Energy: 1.1935370118769322
Energy: 1.2153949614817814
Energy: 1.2160795402003723
Energy: 1.2807932898776841
Energy: 1.2583514504661448
Energy: 1.1955298390734468
Energy: 1.1941683509417462
Energy: 1.2114163203046615
Energy: 1.2093299371071005
Energy: 1.2098185043594676
Energy: 1.242953548512097
Energy: 1.192111995685977
Energy: 1.191757378980448
Energy: 1.2487335299901523
Energy: 1.1924102410541808
Energy: 1.208554080222709
Energy: 1.2654252375924284
Energy: 1.1921604261793703
Energy: 1.2177369561293394
Energy: 1.2165330643279568
Energy: 1.1918852427873419
Energy: 1.2171425688397948
Energy: 1.265987464916531
Energy: 1.2005757142007902
Energy: 1.2003681472314391
Energy: 1.2127755855690672
Energy: 1.2082486202882672
Energy: 1.2167993403706623
Energy: 1.2940764148771717
Energy: 1.2675006231505028
Energy: 1.3034436428585465
Energy: 1.2122023385267435
Energy: 1.2111717155230837
Energy: 1.2123136835170556
Energy: 1.2593332609378023
Energy: 1.2135845298097756
Energy: 1.213960911503152
Energy: 1.2595781519537546
Energy: 1.1907625406771984
Energy: 1.2130237152582797
Energy: 1.2128661941739054
Energy: 1.1996474071196042
Energy: 1.268358666835985
Energy: 1.2255741118691201
Energy: 1.2041603891348684
Energy: 1.212598627543417
Energy: 1.188532459828455
Energy: 1.418408585644422
Energy: 1.3144922860733657
Energy: 1.2383032925353292
Energy: 1.4185517365895737
Energy: 1.358380128189416

minimum gb energy = 1.1840255566028195 eV
minimum distance =  2.29335773336231 Angstroms
sigma value = 57


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

Energy: 1.4435673177059003
Energy: 1.3756291205253142
Energy: 1.2741586993982132
Energy: 1.1861727526350148
Energy: 1.3321298415524392
Energy: 1.274126866950426
Energy: 1.1930997658062015
Energy: 1.2353180234486107
Energy: 1.2350029969072467
Energy: 1.2278252196249142
Energy: 1.2073368645923432
Energy: 1.2214606191195871
Energy: 1.1978707232101782
Energy: 1.134528228122274
Energy: 1.134059294220383
Energy: 1.1969666759774524
Energy: 1.1329016730599353
Energy: 1.1140531013789765
Energy: 1.1978165047456524
Energy: 1.132442764080686
Energy: 1.1326577061428444
Energy: 1.196463818404772
Energy: 1.1494246834151132
Energy: 1.19307069607253
Energy: 1.218595127876459
Energy: 1.1767969980866007
Energy: 1.192720099406924
Energy: 1.2184159116805533
Energy: 1.1990748540632385
Energy: 1.1768661061507713
Energy: 1.1160336170374827
Energy: 1.1624575967554143
Energy: 1.1805686717421409
Energy: 1.1742835817643806
Energy: 1.1971005195860343
Energy: 1.1858887632652686
Energy: 1.2097402411453222
Energy: 1.1963276584572782
Energy: 1.195842003740308
Energy: 1.2094175011168038
Energy: 1.1974267331969968
Energy: 1.1958470333232538
Energy: 1.215956546659039
Energy: 1.198095967691499
Energy: 1.2028107048707437
Energy: 1.172069951251599
Energy: 1.1989895963345818
Energy: 1.1943894181384718
Energy: 1.2089663620054434
Energy: 1.2347708097567196
Energy: 1.2174428929746204
Energy: 1.2093979456694577
Energy: 1.2487477314408397
Energy: 1.216877557350712
Energy: 1.447890160858422
Energy: 1.192312025312893
Energy: 1.1904638576049613
Energy: 1.4495274818755617
Energy: 1.1908919476878745
Energy: 1.1916122388550718
Energy: 1.1926644304720746
Energy: 1.193783229666642
Energy: 1.333180145848702
Energy: 1.2095099766856023
Energy: 1.241036832910042
Energy: 1.1998189589966017
Energy: 1.1176046977236058
Energy: 1.2353779335065478
Energy: 1.1990805475940316
Energy: 1.1210021117091615
Energy: 1.2095974180370064
Energy: 1.2623463930609784
Energy: 1.1168318032580027
Energy: 1.1945428239128761
Energy: 1.2656142837175421
Energy: 1.2619574888597076
Energy: 1.2091668441179226
Energy: 1.262228595616574
Energy: 1.194276740875825
Energy: 1.2364183020253219
Energy: 1.1978867115862755
Energy: 1.208879326023698
Energy: 1.2089744455111933
Energy: 1.2158522516798036
Energy: 1.195603754306654
Energy: 1.1155787350961643
Energy: 1.1627229965928112
Energy: 1.1955383224881684
Energy: 1.1140092419840721
Energy: 1.1621318079972782
Energy: 1.198218656409279
Energy: 1.178688783261185
Energy: 1.202347258832711
Energy: 1.1990956694977715
Energy: 1.2360197982915813
Energy: 1.2003007657846387
Energy: 1.219782291935044
Energy: 1.2023374907155633
Energy: 1.1758092160735005
Energy: 1.2200318459016724
Energy: 1.1817242178466576
Energy: 1.174501943129533
Energy: 1.2194550286131776
Energy: 1.2042128483120924
Energy: 1.1957325382217983
Energy: 1.202048703733635
Energy: 1.1992280376806455
Energy: 1.1784865441393215
Energy: 1.229606748859504
Energy: 1.192954268489142
Energy: 1.1940789009947754
Energy: 1.2025108150468973
Energy: 1.193043379840469
Energy: 1.2159070277952182
Energy: 1.2301868439471564
Energy: 1.1986346755044253
Energy: 1.214970506559948
Energy: 1.2480779000735798
Energy: 1.1939013929998796
Energy: 1.2152491987599396
Energy: 1.2082631488213387
Energy: 1.2494765588390158
Energy: 1.2183995787211153
Energy: 1.2091915550698524
Energy: 1.2477407270594565
Energy: 1.201055063775365
Energy: 1.3310077554208108
Energy: 1.1915736138828688
Energy: 1.1941098812149409
Energy: 1.3307787985014432
Energy: 1.1910489358043934
Energy: 1.214993662997339
Energy: 1.1971693623558224
Energy: 1.2487375252350743
Energy: 1.2367787464373536
Energy: 1.225149130384153
Energy: 1.2241938717802503
Energy: 1.235076182077673
Energy: 1.1168587869120143
Energy: 1.1957297615257545
Energy: 1.265784424693487
Energy: 1.263370511654682
Energy: 1.1953147210998851
Energy: 1.2621850961746734

minimum gb energy = 1.1140092419840721 eV
minimum distance =  2.31288998157153 Angstroms
sigma value = 17


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

Energy: 1.939344537421084
Energy: 1.3902853410046643
Energy: 1.393856522636316
Energy: 1.1577631159718313
Energy: 1.2438039132150538
Energy: 1.1549097412378482
Energy: 1.3943343424063355
Energy: 1.2264984574615359
Energy: 1.2389351940220552
Energy: 1.2584558743469842
Energy: 1.227299853103887
Energy: 1.1531973694642825
Energy: 1.5196916956022477
Energy: 1.1258430758478681
Energy: 1.1164134942961186
Energy: 1.2266138843117649
Energy: 1.1269750619812804
Energy: 1.1004019884115952
Energy: 1.2243993130355837
Energy: 1.1139473553287087
Energy: 1.1004378652725937
Energy: 1.224492944711815
Energy: 1.0844086832138988
Energy: 1.2245171439754947
Energy: 1.0836770862158154
Energy: 1.120320475888294
Energy: 1.1316472421244212
Energy: 1.0847342433827323
Energy: 1.1202440282129633
Energy: 1.1241907793225834
Energy: 1.1016407269121702
Energy: 1.0695766208096642
Energy: 1.1317711514242927
Energy: 1.1196074657512536
Energy: 1.0684410410751102
Energy: 1.1206389246924722
Energy: 1.1789918683670673
Energy: 1.0680523399545914
Energy: 1.0669853897214665
Energy: 1.1785732918762826
Energy: 1.0681320243047145
Energy: 1.0976188396276956
Energy: 1.069648920361291
Energy: 1.1253251357536624
Energy: 1.1687873239772812
Energy: 1.123262786999089
Energy: 1.125115071194644
Energy: 1.165671627880065
Energy: 1.0718777199810028
Energy: 1.1238969787537496
Energy: 1.128104245216871
Energy: 1.0682880375834864
Energy: 1.1215851077193417
Energy: 1.0672075980317761
Energy: 1.0679151090145127
Energy: 1.1320782011206307
Energy: 1.1326900368030774
Energy: 1.068114601331299
Energy: 1.1310618541475224
Energy: 1.1203400916780586
Energy: 1.2725810810531415
Energy: 1.1238975419494783
Energy: 1.132221725114732
Energy: 1.1201469519937057
Energy: 1.2267232640437669
Energy: 1.120779020171577
Energy: 1.241915828692417
Energy: 1.2247096763856118
Energy: 1.2244036311839381
Energy: 1.2229596036766608
Energy: 1.2256773777423962
Energy: 1.2244833453487802
Energy: 1.2224727930908659
Energy: 1.226747578208789
Energy: 1.2392848757646098
Energy: 1.131117682232241
Energy: 1.226319688523883
Energy: 1.238761402879236
Energy: 1.2444082800890073
Energy: 1.2258427150051021
Energy: 1.2265754953753234
Energy: 1.227032873070689
Energy: 1.2259865779773231
Energy: 1.150417519707644
Energy: 1.3825798469864068
Energy: 1.224471062938461
Energy: 1.2341824597696607
Energy: 1.2373554174326158
Energy: 1.2253078994141695
Energy: 1.276339413965336
Energy: 1.3935679874740259
Energy: 1.2582007663194905
Energy: 1.1793279110442971
Energy: 1.2264103805284192
Energy: 1.2589287971540715
Energy: 1.2257227185732316
Energy: 1.2101551064458476
Energy: 1.2274461645647343
Energy: 1.3471317073381575
Energy: 1.2722438116566985
Energy: 1.228088269503721
Energy: 1.3470406403990391

minimum gb energy = 1.0669853897214665 eV
minimum distance =  2.31417376411555 Angstroms
sigma value = 17


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

Energy: 2.050855536108727
Energy: 1.3282733412932217
Energy: 1.129314154337754
Energy: 1.1254974949110095
Energy: 1.23382398151836
Energy: 1.1405344647503957
Energy: 1.422189129179523
Energy: 1.196300133236298
Energy: 1.190141348314514
Energy: 1.196556674180751
Energy: 1.2016346699919518
Energy: 1.130618934996189
Energy: 1.444206874460459
Energy: 1.0438394204591595
Energy: 1.069353225481176
Energy: 1.1969900262909938
Energy: 1.0429997678529865
Energy: 1.0864917839852002
Energy: 1.202172691643906
Energy: 1.0762474591970526
Energy: 1.0878481391685881
Energy: 1.202838984576541
Energy: 1.0169900031499188
Energy: 1.0834893648103243
Energy: 1.0503998608138263
Energy: 1.0673367743696465
Energy: 1.0559391519404036
Energy: 1.0510743704427423
Energy: 1.067260527474853
Energy: 1.0539707987949505
Energy: 1.0834750749882727
Energy: 1.0341253181217283
Energy: 1.014661461344966
Energy: 1.0392829028045314
Energy: 1.034507579463522
Energy: 1.0347067967435204
Energy: 0.9668137266295534
Energy: 1.0339034253262218
Energy: 1.0337665954592146
Energy: 1.0087807299195766
Energy: 1.0386536760973284
Energy: 1.0291662425231
Energy: 0.9675701187485582
Energy: 1.0157705907026682
Energy: 1.0260363390305292
Energy: 1.0321003758585285
Energy: 1.0170047897345933
Energy: 1.025288021663343
Energy: 0.9700973068851643
Energy: 1.024917322962338
Energy: 1.0074133031087618
Energy: 0.970551563399438
Energy: 0.9864310843320113
Energy: 0.9679885651954695
Energy: 0.968389801141418
Energy: 1.0214548248827116
Energy: 1.0209396169538423
Energy: 0.9687001528096458
Energy: 1.0212308530474945
Energy: 1.0209283340344608
Energy: 0.9834192197019354
Energy: 0.9682371358161216
Energy: 1.0204519329624593
Energy: 1.0221244621322745
Energy: 0.9684592291416672
Energy: 1.0205531475994276
Energy: 0.9716808419779466
Energy: 0.9687340003109851
Energy: 0.9685819259834089
Energy: 0.9736646121931778
Energy: 0.974751025338538
Energy: 1.007651703072639
Energy: 1.0330000750314878
Energy: 1.0095565615897695
Energy: 1.0254024709775365
Energy: 1.0262097036632924
Energy: 1.072505015286544
Energy: 1.0257666579809608
Energy: 1.034841375752266
Energy: 1.0327001279867785
Energy: 1.0328506557960608
Energy: 1.0352353997912638
Energy: 1.0079076661363222
Energy: 1.0342585577090468
Energy: 1.0342568995405748
Energy: 1.0070354173427305
Energy: 1.0429140389804503
Energy: 1.034365173687674
Energy: 1.031243510134467
Energy: 1.067817862584393
Energy: 1.209718095889328
Energy: 1.066404798230405
Energy: 1.0535997348765833
Energy: 1.0670338228787088
Energy: 1.0526997712460122
Energy: 1.0662611719009114
Energy: 0.9684315235000857
Energy: 1.1979640724944116
Energy: 1.197713892151491
Energy: 0.9717328063233496
Energy: 1.197692361128843
Energy: 1.033123661123775
Energy: 1.054526472187306
Energy: 1.1972018407004248
Energy: 1.1998954303318314
Energy: 1.05434375036301
Energy: 1.1967276500282984
Energy: 1.0665118521639079
Energy: 1.3400234332387704
Energy: 1.1981269215381727
Energy: 1.1326462077964674
Energy: 1.1980182413812333
Energy: 1.0868811188299008
Energy: 1.05466069251117
Energy: 1.4452326867241057
Energy: 1.0760294421967262
Energy: 1.0768551258188548
Energy: 1.196045092500111
Energy: 1.0758535573088805
Energy: 1.1987780273404136
Energy: 1.4547367678504122
Energy: 1.1968560396271986
Energy: 1.1899871371825275
Energy: 1.2024132744499323
Energy: 1.196779195995277
Energy: 1.1966047732611012
Energy: 0.9817158765535094
Energy: 1.1985686530499804
Energy: 1.3066365875864705
Energy: 1.0699074430861335
Energy: 1.19740332126693
Energy: 1.0851736345717438
Energy: 0.9884408933150124
Energy: 1.1998651626911967
Energy: 1.2014157491154032
Energy: 0.9903132004148714
Energy: 1.2032079706532768
Energy: 1.3057891999608522
Energy: 1.4497391155512904
Energy: 1.0823814191531003
Energy: 1.1882016863207725
Energy: 1.1992130630555942
Energy: 0.9810324699630939
Energy: 1.1962076355573323
Energy: 1.197504571611287
Energy: 1.0467088632925419
Energy: 1.0933532568844377
Energy: 1.197503918431689
Energy: 1.0469991735433593
Energy: 1.0879237586406718
Energy: 1.198796608655083
Energy: 1.0653543230148357
Energy: 1.0679838145125509
Energy: 1.1992791719241218
Energy: 1.0655108614699804
Energy: 1.1223633927903223
Energy: 1.0834330195037034
Energy: 1.0353193965505836
Energy: 1.0374218068724192
Energy: 1.0383161727386805
Energy: 1.0748831138313095
Energy: 1.034344508883403
Energy: 0.9564558375141312
Energy: 1.0340732129080124
Energy: 1.0339286191017663
Energy: 1.037107087765124
Energy: 1.0367818691644823
Energy: 1.033911929078264
Energy: 1.1871431697194077
Energy: 1.0325032758707766
Energy: 1.032401989097145
Energy: 1.032599889385477
Energy: 1.0337624646846237
Energy: 1.0315597838995945
Energy: 0.9683569523578175
Energy: 1.0160365760083756
Energy: 1.0260106783550804
Energy: 0.9682050250760699
Energy: 1.016623439801245
Energy: 1.0243873968209234
Energy: 0.9749486864393211
Energy: 1.0217883794383245
Energy: 1.0297585948517283
Energy: 0.9767701488541762
Energy: 1.021747257537742
Energy: 1.0030669588438426
Energy: 0.9700599393328687
Energy: 1.0213838198185077
Energy: 1.0206909939635262
Energy: 1.0468047223806787
Energy: 1.0220313650705155
Energy: 1.0205191537107847
Energy: 1.067073922539832
Energy: 0.9680680347778504
Energy: 0.9682074042678526
Energy: 1.0681565683257632
Energy: 0.9693708451950399
Energy: 0.9678097961655471
Energy: 1.0348939200216571
Energy: 1.0252707675730603
Energy: 1.0364200276823612
Energy: 1.0275192034179192
Energy: 0.9674243732308753
Energy: 1.0353423674802504
Energy: 1.0343167141487475
Energy: 1.0368031915773304
Energy: 1.0355360081732956
Energy: 1.0344070951170334
Energy: 1.034200400682749
Energy: 1.0361110577303783
Energy: 1.0342317494211763
Energy: 1.0296114885761414
Energy: 1.0661293526368392
Energy: 1.0343665507448265
Energy: 1.0298088269916985
Energy: 1.0341444157228992
Energy: 1.3444784171730348
Energy: 1.0524831496162543
Energy: 1.0529028697880372
Energy: 1.0349781279504564
Energy: 1.052416155161243
Energy: 1.0665096934291802
Energy: 0.9665247507976718
Energy: 1.1970727228462017
Energy: 1.1973369614204157
Energy: 1.0510893915366748
Energy: 1.199612740348984
Energy: 1.065712750505844
Energy: 1.1968910480887633
Energy: 1.198045903656638
Energy: 1.033278775127529
Energy: 1.0717626304811945
Energy: 1.1973247717961928
Energy: 1.0351394767937012
Energy: 1.3840576556680524
Energy: 1.1968114327749944
Energy: 1.1968878837682837
Energy: 1.1999150161392418
Energy: 1.2019966834765128
Energy: 1.1113580467492574
Energy: 1.3417830927593812
Energy: 1.0707849811480916
Energy: 1.1997396146055805
Energy: 1.1978723050498092
Energy: 1.0761230620990805
Energy: 1.196487734346591
Energy: 1.449079841188636
Energy: 1.1139921775703783
Energy: 1.1884407032226012
Energy: 1.2002404358763807
Energy: 1.0519656161271729
Energy: 1.196411997595364
Energy: 0.9901123150054244
Energy: 1.2001170092999522
Energy: 1.201741019838772
Energy: 0.9818487349878271
Energy: 1.2022266746287016
Energy: 1.3056414412112345

minimum gb energy = 0.9564558375141312 eV
minimum distance =  2.30907254220998 Angstroms
sigma value = 57


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

Energy: 1.1597931388380684
Energy: 1.2411845117445617
Energy: 1.0986040397644619
Energy: 0.98446402375756
Energy: 1.5673109299951828
Energy: 1.0773997770254293
Energy: 1.2826543999559639
Energy: 1.1963473073857303
Energy: 1.0112880435590121
Energy: 1.1700343399654214
Energy: 1.1922611938244552
Energy: 1.013606810049837
Energy: 1.3670927601721399
Energy: 0.9749951056462239
Energy: 0.9751971473473474
Energy: 1.1642713545337344
Energy: 0.9741378243466755
Energy: 1.0429795852607389
Energy: 1.1572869024529417
Energy: 0.9741918360220263
Energy: 1.0358726085529726
Energy: 1.157262380275455
Energy: 0.9953656775650064
Energy: 1.0550533055312854
Energy: 0.9953379185932624
Energy: 1.0196299457779678
Energy: 1.0113388226479498
Energy: 1.0655637052710452
Energy: 1.0067249344498768
Energy: 0.9924741122742932
Energy: 0.9495894465920725
Energy: 1.0043763826158905
Energy: 0.9728752830671576
Energy: 0.9443170094703591
Energy: 1.0040164250976846
Energy: 0.9744782843122823
Energy: 1.1592479540808494
Energy: 1.014338573740208
Energy: 1.0039424340925789
Energy: 0.9695922995626283
Energy: 1.0110632507906194
Energy: 0.9689426077393982
Energy: 1.2320883211642069
Energy: 0.940341988597488
Energy: 0.9400693759807264
Energy: 1.0155764672562113
Energy: 0.9405287865569232
Energy: 0.955187754260509
Energy: 0.9289520321426255
Energy: 0.9548903087208158
Energy: 0.9256477002206471
Energy: 0.9309076405128495
Energy: 0.9352251131065183
Energy: 0.9252922082590841
Energy: 0.9251132688518606
Energy: 0.9464191958186717
Energy: 0.9442892923868967
Energy: 0.9252459994310381
Energy: 0.9874977001087213
Energy: 0.9421340169008119
Energy: 0.8992715712734192
Energy: 0.8917947171570061
Energy: 0.9347425028638313
Energy: 0.9323371109827595
Energy: 0.8917055466716378
Energy: 0.9351183985400373
Energy: 0.9303467801706414
Energy: 0.9024228035468448
Energy: 0.8910939197521089
Energy: 0.9320601356787562
Energy: 0.899380907479731
Energy: 0.9420634963050596
Energy: 0.8902535208126308
Energy: 0.9512739003151823
Energy: 0.988341681006675
Energy: 0.9311491619299207
Energy: 0.9382389366075674
Energy: 0.9491634827835098
Energy: 0.8928027000478971
Energy: 0.9389285812067687
Energy: 0.891131744618585
Energy: 0.8949713331986182
Energy: 0.9365241874780368
Energy: 0.8914167224110267
Energy: 0.8915906311267645
Energy: 0.9386875879564327
Energy: 0.9358984439449368
Energy: 0.8918573747986092
Energy: 0.9412694940459994
Energy: 0.9348568808962694
Energy: 1.0046682151799482
Energy: 0.9259583577055158
Energy: 0.9586864623311375
Energy: 0.9615129485746722
Energy: 0.9403040861675201
Energy: 0.9619379621626941
Energy: 0.9463104467417985
Energy: 0.9259035656415842
Energy: 0.9255759304611126
Energy: 0.9456482093964218
Energy: 0.9360678960001027
Energy: 0.9520317652466748
Energy: 0.8951382989463582
Energy: 0.9561508677799261
Energy: 0.967727717590565
Energy: 0.944308525906189
Energy: 0.9563245905703366
Energy: 0.9555041920608337
Energy: 1.005843204741785
Energy: 0.9705898431626797
Energy: 1.0033834503701882
Energy: 1.0067915559512837
Energy: 0.9688108196835536
Energy: 1.003959448427263
Energy: 1.2759355170431919
Energy: 0.9895040172408109
Energy: 0.988976056620033
Energy: 1.0322575257824034
Energy: 0.9618385750279993
Energy: 1.0106029112388006
Energy: 1.2764817174253775
Energy: 1.02211469163761
Energy: 1.020316210800338
Energy: 1.0169400562193593
Energy: 1.0196801365437407
Energy: 1.0211369617781354
Energy: 1.00004925545716
Energy: 1.1554770902265776
Energy: 1.0039884708738729
Energy: 0.960423778968884
Energy: 1.1686685687641503
Energy: 1.0029763896031612
Energy: 1.0221725723452604
Energy: 1.1653320195161543
Energy: 1.1396719744578407
Energy: 1.0231693019231443
Energy: 1.1613326280965042
Energy: 1.1525737967232932
Energy: 1.3082562548110246
Energy: 1.020274465181239
Energy: 0.991652637099418
Energy: 1.1901788729236005
Energy: 1.0218639738924575
Energy: 1.0218482381150231
Energy: 1.373617403313574
Energy: 1.003950529845251
Energy: 1.0214037793403503
Energy: 1.1550694038234002
Energy: 1.0048023353077573
Energy: 1.1436540670216144
Energy: 1.3611016519934636
Energy: 1.1544554497534762
Energy: 1.1362581289015183
Energy: 1.162652174742736
Energy: 1.1642284816298363
Energy: 1.0213821346892908
Energy: 1.0566078115980357
Energy: 1.1590342202278876
Energy: 1.0567476473847772
Energy: 0.9807669427679369
Energy: 1.1554297944308178
Energy: 1.0576612473808873

minimum gb energy = 0.8902535208126308 eV
minimum distance =  2.3164067524399 Angstroms
sigma value = 43


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

Energy: 1.016471518712816
Energy: 1.0713958890769306
Energy: 0.9498865902729892
Energy: 0.842325570790924
Energy: 1.2604633915265921
Energy: 0.9218406051231914
Energy: 1.099794855734867
Energy: 0.8962868279453119
Energy: 0.8705276336777196
Energy: 1.0236783264762284
Energy: 0.8965213102033628
Energy: 0.8643299434083443
Energy: 1.1863276488086831
Energy: 0.8235557889301542
Energy: 0.8496605305421575
Energy: 1.0240061946937014
Energy: 0.8253673385909829
Energy: 0.8582997902763674
Energy: 1.0207575205198534
Energy: 0.8492841284884614
Energy: 0.8584662734372555
Energy: 0.9070895955211798
Energy: 0.8638810853984951
Energy: 0.9477975248433884
Energy: 0.9483752250911465
Energy: 0.9056122825746419
Energy: 0.8683546562691733
Energy: 0.9486453465884598
Energy: 0.9069385844232596
Energy: 0.8674378541457715
Energy: 0.8090919510250562
Energy: 0.9046453168706302
Energy: 0.8424166171897296
Energy: 0.8096760316876108
Energy: 0.9040508792151147
Energy: 0.8169515093859301
Energy: 1.0493724308812356
Energy: 0.9045367415799266
Energy: 0.9041976215458433
Energy: 0.8222224318089356
Energy: 0.9048336442705959
Energy: 0.8214710617919916
Energy: 1.0827643164408518
Energy: 0.7948543496488263
Energy: 0.8083099686210865
Energy: 0.8387824427571782
Energy: 0.7953964689763575
Energy: 0.8078984286186034
Energy: 0.8390619822872675
Energy: 0.8077863835745102
Energy: 0.8336333376378049
Energy: 0.8416940142846516
Energy: 0.8605891037231158
Energy: 0.8336317025602721
Energy: 0.8076897784719398
Energy: 0.8113077968581837
Energy: 0.811675671646657
Energy: 0.833993863383745
Energy: 0.8107799119185262
Energy: 0.812749494971428
Energy: 0.7932427374221528
Energy: 0.7919704740394476
Energy: 0.7975173985427483
Energy: 0.7866805610471441
Energy: 0.791659329323044
Energy: 0.7904554663620577
Energy: 0.8343410619650244
Energy: 0.792019689583494
Energy: 0.7915681532308924
Energy: 0.8170486229665289
Energy: 0.7924141283485874
Energy: 0.8112753938482157
Energy: 1.0375081823910788
Energy: 0.819093443165911
Energy: 0.8256684970900334
Energy: 1.037676755425457
Energy: 0.7841601405581786
Energy: 0.8603904740422813
Energy: 0.7686200727400276
Energy: 0.792440444945752
Energy: 0.7678019860882724
Energy: 0.7709509329228897
Energy: 0.7935046163966761
Energy: 0.767742663349225
Energy: 0.7672499560252611
Energy: 0.7869013538092019
Energy: 0.7874724609371907
Energy: 0.7673271157620679
Energy: 0.7857012915818714
Energy: 0.7891880651125514
Energy: 0.760344113918809
Energy: 0.7574915554224576
Energy: 0.7574750228557113
Energy: 0.7838374887732927
Energy: 0.757429512414266
Energy: 0.7822083048327494
Energy: 0.7744203728009682
Energy: 0.7572779038376944
Energy: 0.7570659964856278
Energy: 0.7682195331784316
Energy: 0.7572531776903327
Energy: 0.7882292838995635
Energy: 0.756995799353935
Energy: 0.7868678769343388
Energy: 0.7883446778585054
Energy: 0.7575161688659698
Energy: 0.8422416696905123
Energy: 0.7879813702449052
Energy: 0.7576718117982355
Energy: 0.9039047642073954
Energy: 0.75734152670752
Energy: 0.7588271036571329
Energy: 1.0237534374384551
Energy: 0.7577622173655845
Energy: 1.0188297175540968
Energy: 0.7991548407102584
Energy: 0.7962722102428961
Energy: 0.7589878225457857
Energy: 0.8450328091556274
Energy: 0.7984727334965196
Energy: 0.797981444640878
Energy: 0.7686168470734924
Energy: 0.7681276165001749
Energy: 0.7969935684980299
Energy: 0.7684297152033815
Energy: 0.795780340624875
Energy: 0.7639586943885187
Energy: 0.7680585196858508
Energy: 0.7681492746407367
Energy: 0.7881847285092634
Energy: 0.768231110774154
Energy: 0.7859092041491015
Energy: 0.7912546023629782
Energy: 0.7905109880252952
Energy: 0.7907724555324579
Energy: 0.791360285772931
Energy: 0.7896650474445003
Energy: 0.7891566878941801
Energy: 0.7934468379349708
Energy: 0.9261872336891591
Energy: 0.7916611356434643
Energy: 0.7961003667634108
Energy: 0.8371349046553638
Energy: 0.7918320125840825
Energy: 1.0560123305515672
Energy: 0.8266712089470964
Energy: 0.7975543090745862
Energy: 0.9716176698056718
Energy: 0.7897887955014244
Energy: 0.8393015221883123
Energy: 0.9046505566341674
Energy: 0.8336187001221576
Energy: 0.8336163837853998
Energy: 0.8133633460865523
Energy: 0.8336986999283588
Energy: 0.8108426461066193
Energy: 0.8103859881586831
Energy: 0.8335865472768818
Energy: 0.838622552037895
Energy: 0.7961688523127917
Energy: 0.8333145502797356
Energy: 0.8024045259357587
Energy: 0.9061881729502449
Energy: 0.8373050439337126
Energy: 0.8271698107053829
Energy: 0.9052920443549669
Energy: 0.8373432739513585
Energy: 0.8231404538554101
Energy: 0.9113291318318385
Energy: 0.8280044127695012
Energy: 0.9044943456880321
Energy: 0.9057592315476587
Energy: 0.9051838826544042
Energy: 0.9044231061332464
Energy: 1.1159719352472026
Energy: 0.8091999841099715
Energy: 0.8287971525845049
Energy: 0.9052169354286651
Energy: 0.8090043620741851
Energy: 0.8285255017436938
Energy: 1.1362764344033778
Energy: 0.8962521080037197
Energy: 0.8972713672934598
Energy: 0.8965427908108655
Energy: 0.8963683312819862
Energy: 0.895709660308465
Energy: 0.8388598481041795
Energy: 1.0239850441053278
Energy: 0.878249801825001
Energy: 0.8231446214292968
Energy: 1.0236022208914906
Energy: 0.8371110181788611
Energy: 1.0444592216302984
Energy: 1.0240769927943811
Energy: 0.9992692660535402
Energy: 0.8993022308706105
Energy: 1.0255698487388856
Energy: 0.9523589707266009
Energy: 1.1108786537340363
Energy: 0.8701955842631525
Energy: 0.8750224020911149
Energy: 0.9070180079549595
Energy: 0.9121924861121394
Energy: 1.0233901974466473
Energy: 1.189047781714307
Energy: 0.8486548214888776
Energy: 0.9062056910611831
Energy: 1.0244303010362086
Energy: 0.8451797968567282
Energy: 0.9062353929143766
Energy: 1.1255913112637486
Energy: 1.0243715409260483
Energy: 1.0003990272032068
Energy: 1.0241135943335102
Energy: 1.0242806996264178
Energy: 0.9966753284462525

minimum gb energy = 0.756995799353935 eV
minimum distance =  2.2932393028986 Angstroms
sigma value = 81


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

Energy: 0.08251067228373651
Energy: 0.9700670952576983
Energy: 0.08328282077680847
Energy: 0.0848806172537579
Energy: 0.08415276218249801
Energy: 0.0830791227914544
Energy: 1.0314163792214057
Energy: 0.08434701606587362
Energy: 0.08443500810308821
Energy: 0.1374118138130838
Energy: 0.08614293737926663
Energy: 0.08453634587522636
Energy: 0.13758204868652288
Energy: 0.08292865005339044
Energy: 0.08308861201926933
Energy: 0.136610779667068
Energy: 0.08291102781311283
Energy: 0.13643859812569778
Energy: 0.08623657259652392
Energy: 0.08304871498506242
Energy: 0.08320773706077904
Energy: 0.08725521235800891
Energy: 0.0828559648971571
Energy: 0.13751477439417176
Energy: 0.1364575376612332
Energy: 0.13772918871755183
Energy: 0.13807317874669345
Energy: 0.13807358738097147
Energy: 0.1372001831287022
Energy: 0.13760216582090157
Energy: 0.08383366366190843
Energy: 0.08418879460564435
Energy: 0.08303092193915737
Energy: 0.08272434612949306
Energy: 0.08451188540521959
Energy: 0.08297763963408569
Energy: 0.13789620295774443
Energy: 0.0843268295461276
Energy: 0.08442565336075548
Energy: 0.13731444889393976
Energy: 0.08403314096171591
Energy: 0.08500658802371125
Energy: 0.13730229374241357
Energy: 0.0828692322543838
Energy: 0.08324686177785001
Energy: 0.1373657751668749
Energy: 0.08279821859731082
Energy: 0.13699759548500046
Energy: 0.08637429627529936
Energy: 0.08344778190765632
Energy: 0.13682715034086257
Energy: 0.08624897878095154
Energy: 0.08307563500885444
Energy: 0.13563556386311462
Energy: 0.08296334073519475
Energy: 0.13644528941683
Energy: 0.1369522379313
Energy: 0.0830064994802856
Energy: 0.1366281477705972
Energy: 0.1367393383176096

minimum gb energy = 0.08251067228373651 eV
minimum distance =  2.45788291144993 Angstroms
sigma value = 3


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

Energy: 0.99204468240426
Energy: 1.0754048124291788
Energy: 0.9717778306543061
Energy: 0.9513238949397095
Energy: 0.9602350909122422
Energy: 0.9260665171494571
Energy: 1.0051793342076347
Energy: 0.9877592769828434
Energy: 0.9868444501497736
Energy: 0.9671581411443534
Energy: 0.9926704968682588
Energy: 0.9948836784399319
Energy: 0.9875006191765843
Energy: 0.9474130921092506
Energy: 0.9455362094699561
Energy: 0.9873815662211084
Energy: 0.9465175317378215
Energy: 0.9860496721986958
Energy: 0.9230903556671516
Energy: 0.9490064368453139
Energy: 0.9454613769057921
Energy: 0.9235174428613626
Energy: 0.828230327867545
Energy: 0.9877619932744344
Energy: 0.839337206160671
Energy: 0.9872754946978567
Energy: 0.9953571159716275
Energy: 0.8392584552528889
Energy: 0.9966175860016128
Energy: 0.9944509585087986
Energy: 0.9288361064755928
Energy: 0.9727858761268703
Energy: 0.9651399531222767
Energy: 0.9252426710615157
Energy: 0.9732717387670332
Energy: 0.9241531090919886
Energy: 0.9613192354906892
Energy: 0.8547563942279177
Energy: 0.8560041032278677
Energy: 0.96243762330324
Energy: 0.8638878846357537
Energy: 0.9314467384464268
Energy: 0.9251528642536966
Energy: 0.9358099374020831
Energy: 0.9349572153750911
Energy: 0.9251438323878116
Energy: 0.8990578490146724
Energy: 0.9027228394000063
Energy: 0.9517868972597526
Energy: 0.939062935969075
Energy: 0.9653970328129158
Energy: 0.9696887066632313
Energy: 0.7886571825029653
Energy: 0.9648785704080795
Energy: 0.7999484576124626
Energy: 0.8518842622090662
Energy: 0.8516481156178972
Energy: 0.800177876175938
Energy: 0.8614428099712564
Energy: 0.8518241232274094
Energy: 0.9162813575227939
Energy: 0.943538499756806
Energy: 0.9441298562446396
Energy: 0.907396470805265
Energy: 0.9233797943741421
Energy: 0.9071028593801206
Energy: 0.7988581237091888
Energy: 0.9553800202181824
Energy: 0.9490322129921002
Energy: 0.7982137897891145
Energy: 0.9410458177552399
Energy: 0.7970583727007764
Energy: 0.8023360896599944
Energy: 0.8915266035816161
Energy: 0.9154544496892109
Energy: 0.8029034446256199
Energy: 0.8908913740330372
Energy: 0.8261838184274171
Energy: 0.9079911998056197
Energy: 0.7621494771291699
Energy: 0.9157425046893618
Energy: 0.9171148811073081
Energy: 0.76143325059291
Energy: 0.9195476512278377
Energy: 0.9035523512475039
Energy: 0.7620727912992232
Energy: 0.7607741153768708
Energy: 0.9003197184732668
Energy: 0.7630849992456311
Energy: 0.7598363610430863
Energy: 0.900212816229171
Energy: 0.8967749115845953
Energy: 0.8966592443310457
Energy: 0.8956100199018816
Energy: 0.8928901309791364
Energy: 0.897557632355963
Energy: 0.7411592605107048
Energy: 0.8973115870308176
Energy: 0.8942737296064217
Energy: 0.7412171664551135
Energy: 0.8964291108788666
Energy: 0.7415243188952628
Energy: 0.7416563576930616
Energy: 0.8883725747548851
Energy: 0.8890145524413859
Energy: 0.7418529002633184
Energy: 0.8885635209213869
Energy: 0.8312299196678431
Energy: 0.8881348959543331
Energy: 0.8252743638252553
Energy: 0.8888112877901128
Energy: 0.8879610607183037
Energy: 0.824477083295335
Energy: 0.8886121935458018
Energy: 0.8916421511381882
Energy: 0.7419577030690869
Energy: 0.7421354135215856
Energy: 0.8925446735524047
Energy: 0.7431078214860264
Energy: 0.7417500068317682
Energy: 0.8919889973353197
Energy: 0.8964190470116554
Energy: 0.8970483070035911
Energy: 0.8914259335171697
Energy: 0.8997750486901841
Energy: 0.8960544770111897
Energy: 0.7823078805765817
Energy: 0.8963938567852635
Energy: 0.7625138199905109
Energy: 0.7837430438328856
Energy: 0.8951149955424265
Energy: 0.762774952427206
Energy: 0.7592681882021726
Energy: 0.9257212039894565
Energy: 0.9258920074798659
Energy: 0.7591699499485423
Energy: 0.926750763178357
Energy: 0.9148033966673002
Energy: 0.9039282433870938
Energy: 0.8240676905310255
Energy: 0.8250012449821593
Energy: 0.8993795609830074
Energy: 0.8012276839681908
Energy: 0.899081546119859
Energy: 0.8455589189456486
Energy: 0.7964458143274427
Energy: 0.7959995592816029
Energy: 0.8470333663187082
Energy: 0.8043125609397554
Energy: 0.7961953518810333
Energy: 0.9238071522021477
Energy: 0.9229296812099138
Energy: 0.9217358080519805
Energy: 0.9227191412090409
Energy: 0.8917232733292603
Energy: 0.9438649163445599
Energy: 0.8990225122065546
Energy: 0.9225773982559132
Energy: 0.8752087587577755
Energy: 0.9004667581964879
Energy: 0.8498213255212119
Energy: 0.8545561927387276
Energy: 0.8161639173053314
Energy: 0.9679355288748903
Energy: 0.9682098150675013
Energy: 0.8160049812156507
Energy: 0.9721250412704328
Energy: 0.968503470109636
Energy: 0.9230121062986291
Energy: 0.9256252624863238
Energy: 0.8785090591129924
Energy: 0.916024707769342
Energy: 0.9259341980173426
Energy: 0.8674979209837942
Energy: 0.8562374687124966
Energy: 0.9308341248985716
Energy: 0.9277120524925329
Energy: 0.8561921079467936
Energy: 0.9338210722032017
Energy: 0.9381509187409379
Energy: 0.9337765132222775
Energy: 0.947166719754919
Energy: 0.9463780767167715
Energy: 0.9329886104656107
Energy: 0.9045073064418266
Energy: 0.9456858260244597
Energy: 1.0354392032729411
Energy: 0.9514564552988117
Energy: 0.9674014979709747
Energy: 0.9940540142551769
Energy: 0.806244567171716
Energy: 0.9969390381321255
Energy: 0.8626334774844906
Energy: 0.9222062835439039
Energy: 0.9209908904378301
Energy: 0.8625759786089312
Energy: 0.9269360088749169
Energy: 0.9435688767437805

minimum gb energy = 0.7411592605107048 eV
minimum distance =  2.30392355376575 Angstroms
sigma value = 67


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

Energy: 1.2071903207767922
Energy: 1.234226920604651
Energy: 1.1926649396584983
Energy: 1.1558359358619563
Energy: 1.1924974977546419
Energy: 1.1917348400819059
Energy: 1.2167141021528534
Energy: 1.1827888447033637
Energy: 1.1741985848008651
Energy: 1.173629744304646
Energy: 1.1774426689380002
Energy: 1.1675944042557989
Energy: 1.1980276237137215
Energy: 1.1294543599126499
Energy: 1.164431345691079
Energy: 1.1766218535448563
Energy: 1.1303492371152384
Energy: 1.166643206722764
Energy: 1.104178514448913
Energy: 1.1662313084289182
Energy: 1.1645814807652182
Energy: 1.104690642656748
Energy: 0.9878039266554987
Energy: 1.165069257782346
Energy: 1.0840051667560793
Energy: 1.1829825517285952
Energy: 1.168985800487387
Energy: 1.0844109522213934
Energy: 1.1752561301591524
Energy: 1.1685566758806307
Energy: 1.1167157376223218
Energy: 1.1725908233895044
Energy: 1.1322618114450036
Energy: 0.9997033828624379
Energy: 1.1696464496443764
Energy: 1.1315692379844806
Energy: 1.0915338306392415
Energy: 1.0908995808377044
Energy: 1.0841821416684894
Energy: 1.0850594118920847
Energy: 1.0879605215514894
Energy: 1.0826899197763953
Energy: 1.1367863192125935
Energy: 1.1094621749743407
Energy: 1.1190694457309205
Energy: 1.1012462203129043
Energy: 1.1092033195254132
Energy: 1.1023009175691303
Energy: 1.1221578656463673
Energy: 1.135368969041638
Energy: 1.1398395034457942
Energy: 1.1382748058096246
Energy: 0.9899713869963866
Energy: 1.1392375950990599
Energy: 1.0391567679736646
Energy: 0.9990949595592109
Energy: 0.9899910815722284
Energy: 1.036941562433731
Energy: 0.9930051161703346
Energy: 0.989902453794133
Energy: 1.122553623495968
Energy: 1.1188304748050857
Energy: 1.1191385732058354
Energy: 0.9469335711536739
Energy: 1.1185928307994155
Energy: 1.120981173328826
Energy: 0.9460791012656136
Energy: 1.1182197366386
Energy: 1.116188040469735
Energy: 0.9474126522886556
Energy: 1.118742020280599
Energy: 0.9420979663940368
Energy: 0.953066332750552
Energy: 1.1051314769654554
Energy: 1.11090897745698
Energy: 0.9497104019041561
Energy: 1.1016333984606839
Energy: 0.9472229886912322
Energy: 1.099170305636411
Energy: 1.1022700734289104
Energy: 1.103660227786448
Energy: 1.0220815445835576
Energy: 0.9467566650055831
Energy: 1.1098159372374399
Energy: 1.115191431421903
Energy: 0.9485508029599086
Energy: 0.944000538221222
Energy: 1.1025535922323266
Energy: 0.9444039535941148
Energy: 0.9440491942803049
Energy: 1.1007160777764111
Energy: 1.1229525603787671
Energy: 1.1161573479673634
Energy: 1.1213969569702962
Energy: 0.9413015632562554
Energy: 1.117998684493057
Energy: 1.011834095796804
Energy: 1.095370256153293
Energy: 1.0978066475352735
Energy: 1.0113584395295938
Energy: 1.0942083004674985
Energy: 1.0081038759796324
Energy: 0.9916165197677392
Energy: 1.1367865170662281
Energy: 1.1419175854260721
Energy: 0.9915444234665814
Energy: 1.1347982051137442
Energy: 0.9927377881391254
Energy: 1.0994959692447008
Energy: 1.1201896816901225
Energy: 1.0926239630958199
Energy: 1.126245455524115
Energy: 1.119642889457614
Energy: 1.124800302593438
Energy: 1.08417752741035
Energy: 1.0931237200254067
Energy: 1.0837716008662586
Energy: 1.0843628086642736
Energy: 1.091551007878479
Energy: 1.083611804772944
Energy: 1.1036908614931602
Energy: 1.1349260703361161
Energy: 1.1342046618061792
Energy: 1.10576395274644
Energy: 1.1511245016305378
Energy: 1.1335226840229866
Energy: 1.1976382443659626
Energy: 1.1230028787454989
Energy: 1.1340019426056889
Energy: 1.1778452733081293
Energy: 1.1226565918413425
Energy: 1.135731638976737
Energy: 1.1365784955503135
Energy: 1.0946726553041204
Energy: 1.0856322373260443
Energy: 1.1370879258781648
Energy: 1.0920163666562568
Energy: 1.0824311180312756

minimum gb energy = 0.9413015632562554 eV
minimum distance =  2.29892734136635 Angstroms
sigma value = 33


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

Energy: 1.4348305631923546
Energy: 1.4429323286727034
Energy: 1.4210960924312754
Energy: 1.286431281113484
Energy: 1.4228806334468918
Energy: 1.3603514369692216
Energy: 1.4470591220160793
Energy: 1.2519563790208232
Energy: 1.2913929286974986
Energy: 1.2564868967567753
Energy: 1.305312004574573
Energy: 1.2530808641373279
Energy: 1.4394055988547438
Energy: 1.3442663154334327
Energy: 1.343780970426308
Energy: 1.3028735736574593
Energy: 1.3439846978002647
Energy: 1.3487012074468343
Energy: 1.3246609958885276
Energy: 1.3442294291662316
Energy: 1.3438370255851553
Energy: 1.3262908974767955
Energy: 1.2232618601956844
Energy: 1.3470775955202283
Energy: 1.24900507790677
Energy: 1.2505540216839313
Energy: 1.2527346112659135
Energy: 1.2495784486386272
Energy: 1.3816696642951307
Energy: 1.2481385938146354
Energy: 1.3320469768685264
Energy: 1.3663356378735327
Energy: 1.3671062206871445
Energy: 1.204639074910545
Energy: 1.36653201669896
Energy: 1.2177638298733608
Energy: 1.2495297783341
Energy: 1.3159406395948363
Energy: 1.3169444885108381
Energy: 1.2506177799427107
Energy: 1.317487669413746
Energy: 1.2494513145843933
Energy: 1.2704597329876306
Energy: 1.2494878406401806
Energy: 1.2515082013332819
Energy: 1.2672302598098035
Energy: 1.2371946025313996
Energy: 1.266180017113108
Energy: 1.3216696244535644
Energy: 1.3263533698985561
Energy: 1.3184269425709414
Energy: 1.3332431131368925
Energy: 1.1485823034067797
Energy: 1.3135378480863897
Energy: 1.3276804881415623
Energy: 1.149002872926599
Energy: 1.1490425735511922
Energy: 1.323685121448391
Energy: 1.1530399454178129
Energy: 1.1487170449110782
Energy: 1.3266224496838541
Energy: 1.2513705311160332
Energy: 1.3013220488631958
Energy: 1.213278754290312
Energy: 1.1503304468497437
Energy: 1.33405710517126
Energy: 1.1514722778269872
Energy: 1.2576383886502462
Energy: 1.255612597018053
Energy: 1.1514783981762056
Energy: 1.2382105023912584
Energy: 1.1512502145425765
Energy: 1.1563957372733724
Energy: 1.3080962428266834
Energy: 1.3438791399749812
Energy: 1.156167476341087
Energy: 1.280302960167343
Energy: 1.1556156923895067
Energy: 1.290630459253825
Energy: 1.274621329775158
Energy: 1.224510544883214
Energy: 1.181037011715989
Energy: 1.2720994525617049
Energy: 1.2502323556518962
Energy: 1.1893156570384114
Energy: 1.267619750266587
Energy: 1.2655943188574246
Energy: 1.1894714057297462
Energy: 1.270672407512042
Energy: 1.264308128712329
Energy: 1.2589766632264108
Energy: 1.305895599477874
Energy: 1.3060480700968362
Energy: 1.259199101241117
Energy: 1.1497885574023572
Energy: 1.2549001076587318
Energy: 1.3966661114774108
Energy: 1.3060343944489985
Energy: 1.314253769903581
Energy: 1.398097335625585
Energy: 1.1847547098617768
Energy: 1.3331205342678554
Energy: 1.3960541881802686
Energy: 1.3742562636085063
Energy: 1.371459154475372
Energy: 1.394486295373396
Energy: 1.3782890033253596
Energy: 1.373264604521913
Energy: 1.313572152198572
Energy: 1.4331370309409106
Energy: 1.3054898640407562
Energy: 1.2377483419880406
Energy: 1.4288041614482914
Energy: 1.2358203892570332
Energy: 1.2387590113779485
Energy: 1.3713460328057996
Energy: 1.3733068773310038
Energy: 1.239446177329753
Energy: 1.3886269298112615
Energy: 1.3733877934711873
Energy: 1.4401373507502429
Energy: 1.3437967069335515
Energy: 1.347417690078248
Energy: 1.4402201621389927
Energy: 1.3189103577581807
Energy: 1.3449780146512114
Energy: 1.282233793909815
Energy: 1.3437078126842432
Energy: 1.349235426890431
Energy: 1.281990394949992
Energy: 1.3451643729427505
Energy: 1.349646429854034
Energy: 1.255964727275191
Energy: 1.373989097160523
Energy: 1.3726258077165518
Energy: 1.2557059518237024
Energy: 1.385277384281993
Energy: 1.3708289293248241
Energy: 1.3332133155182657
Energy: 1.3289242168277982
Energy: 1.3354628709251368
Energy: 1.2608168496416958
Energy: 1.3291318354170791
Energy: 1.261663241931747
Energy: 1.2557855395658424
Energy: 1.3207213049109356
Energy: 1.3204797775392618
Energy: 1.2560024470682987
Energy: 1.3210023536877864
Energy: 1.2506468385879264
Energy: 1.2694412994465636
Energy: 1.2517985994357832
Energy: 1.251162384268507
Energy: 1.2706471519673177
Energy: 1.231676499055149
Energy: 1.267612586397057
Energy: 1.3227258428601065
Energy: 1.3162671736663285
Energy: 1.318677475410349
Energy: 1.3249610658314295
Energy: 1.150096166305166
Energy: 1.3111597483836226
Energy: 1.3194355831801097
Energy: 1.148531195345128
Energy: 1.1489363203772835
Energy: 1.3164315600874432
Energy: 1.1541404010811283
Energy: 1.1500012325413225
Energy: 1.3275244201145446
Energy: 1.1492002754695507
Energy: 1.3151178140184099
Energy: 1.2156204329145206
Energy: 1.1499263675936213
Energy: 1.3002222679654503
Energy: 1.1500662982291572
Energy: 1.2887913959781097
Energy: 1.2559824218470956
Energy: 1.1505799272317272
Energy: 1.2714143529141053
Energy: 1.1504411703253379
Energy: 1.1496162602770719
Energy: 1.279069457557053
Energy: 1.1520519969861658
Energy: 1.1502953025015197
Energy: 1.2775758779751012
Energy: 1.1499861858031848
Energy: 1.289509234021993
Energy: 1.3488365442030534
Energy: 1.353894762902654
Energy: 1.251265884027473
Energy: 1.3606475860310747
Energy: 1.2509866747627685
Energy: 1.1897718386376162
Energy: 1.147603342895847
Energy: 1.1442166523901893
Energy: 1.2422334887539153
Energy: 1.2652212020202285
Energy: 1.1402517645012458
Energy: 1.250566239581702
Energy: 1.2515244533437935
Energy: 1.2486164312089687
Energy: 1.2534247667157599
Energy: 1.1502262150582345
Energy: 1.2040938548092353
Energy: 1.4448021017707726
Energy: 1.3062077654011381
Energy: 1.314067152583363
Energy: 1.3397367620817648
Energy: 1.2495160884106493
Energy: 1.3335575968902853
Energy: 1.4470568517843065
Energy: 1.1391127709459912
Energy: 1.1835654838836518
Energy: 1.258847309005654
Energy: 1.1846852871112494
Energy: 1.3022364611773571
Energy: 1.3659520058024084
Energy: 1.2923739270193115
Energy: 1.31543813886496
Energy: 1.1963285005060946
Energy: 1.2911500436522596
Energy: 1.3083715355051455

minimum gb energy = 1.1391127709459912 eV
minimum distance =  2.27000345468952 Angstroms
sigma value = 41


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

Energy: 1.5367825587749249
Energy: 1.6123617480851737
Energy: 1.5437822897971536
Energy: 1.4480641941012622
Energy: 1.3974750894523857
Energy: 1.5458849617172554
Energy: 1.5074889132852562
Energy: 1.4037610627905253
Energy: 1.3978133187140678
Energy: 1.3975424902167533
Energy: 1.401106373880475
Energy: 1.3997991990724983
Energy: 1.5111297301658375
Energy: 1.3539273678318777
Energy: 1.3932202416506765
Energy: 1.5125117736773352
Energy: 1.3543089995742763
Energy: 1.3929136206134494
Energy: 1.3993457003160992
Energy: 1.3512271933231867
Energy: 1.3533487377581404
Energy: 1.4008776175859183
Energy: 1.4251526687938612
Energy: 1.3982218996991547
Energy: 1.2610663115101823
Energy: 1.4047369430513643
Energy: 1.39826612815943
Energy: 1.2612189760169645
Energy: 1.3994958226934626
Energy: 1.3556320595563223
Energy: 1.4084709909530688
Energy: 1.4340729179456735
Energy: 1.4484203004556055
Energy: 1.302211153934196
Energy: 1.4322436053078085
Energy: 1.4324635675840578
Energy: 1.2613746983620673
Energy: 1.3587005390149527
Energy: 1.3560872982873398
Energy: 1.2613259560825014
Energy: 1.4317458907396394
Energy: 1.2615246358232015
Energy: 1.2634883967258363
Energy: 1.2282922964472902
Energy: 1.2620205127715927
Energy: 1.2651860222633804
Energy: 1.3051481364502204
Energy: 1.2628124079352616
Energy: 1.3698473601973344
Energy: 1.4306583357440354
Energy: 1.4240935992153678
Energy: 1.3886284186305171
Energy: 1.2644931354185704
Energy: 1.413202822175612
Energy: 1.3073588563987004
Energy: 1.2701705519146418
Energy: 1.2639792256791653
Energy: 1.4085105819949582
Energy: 1.2637976394085746
Energy: 1.2652905742825187
Energy: 1.4130494669434608
Energy: 1.2630421488363124
Energy: 1.359774784091484
Energy: 1.4304419836358304
Energy: 1.1943506654607188
Energy: 1.3627618557854908
Energy: 1.5271959143796994
Energy: 1.3993346385237135
Energy: 1.3806092514261212
Energy: 1.5087640308979584
Energy: 1.4165146541122189
Energy: 1.3802801005733707
Energy: 1.5083385516697079
Energy: 1.3970598710606716
Energy: 1.2932420714462796
Energy: 1.4063877969157894
Energy: 1.4100670846682952
Energy: 1.3989120386192533
Energy: 1.4365021462797463
Energy: 1.3975156480724285
Energy: 1.4433745097975654
Energy: 1.1927748554865305
Energy: 1.4036526934227405
Energy: 1.444977067964556

minimum gb energy = 1.1927748554865305 eV
minimum distance =  2.31766528471567 Angstroms
sigma value = 11


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

Energy: 2.174672682412855
Energy: 1.5557924977395567
Energy: 1.5757430460612616
Energy: 1.691483280153809
Energy: 1.5155941690684285
Energy: 1.6907656411989918
Energy: 1.7069374185501403
Energy: 1.408873164634381
Energy: 1.4093808468962852
Energy: 1.4925619135236063
Energy: 1.4088322012988117
Energy: 1.4097266785699318
Energy: 1.6319109798322788
Energy: 1.4704590366863988
Energy: 1.443265500916727
Energy: 1.631905691216856
Energy: 1.4468476893449018
Energy: 1.4454779348193325
Energy: 1.5614318648064045
Energy: 1.3903119191888358
Energy: 1.4468485906931465
Energy: 1.512917025976154
Energy: 1.5076143588630828
Energy: 1.4456267593215562
Energy: 1.493189961889903
Energy: 1.41039337624325
Energy: 1.4097955303986731
Energy: 1.4929026882241587
Energy: 1.4124388026839492
Energy: 1.4100874062079478
Energy: 1.4964997381887022
Energy: 1.4310742375083507
Energy: 1.4508360207230182
Energy: 1.4783871875273398
Energy: 1.4303612749896835
Energy: 1.4600385843505617
Energy: 1.4309745713801039
Energy: 1.4522981774714163
Energy: 1.4325731174743352
Energy: 1.4310351696594636
Energy: 1.406684630435575
Energy: 1.4315170884032786
Energy: 1.429549022104997
Energy: 1.513713247446393
Energy: 1.4104751550921666
Energy: 1.4101384511895294
Energy: 1.4885153588880125
Energy: 1.4100971705348557
Energy: 1.4680984150023315
Energy: 1.5540466286977268
Energy: 1.527704417979785
Energy: 1.4153882518230048
Energy: 1.6010461320244382
Energy: 1.396210355948225
Energy: 1.4499278250519834
Energy: 1.554936634328403
Energy: 1.522836571912534
Energy: 1.4165434665287726
Energy: 1.630939215107837
Energy: 1.3960327976343
Energy: 1.4298064733075688
Energy: 1.4542864516407532
Energy: 1.4102922612830606
Energy: 1.4100550268502277
Energy: 1.4388235192002667
Energy: 1.4094040785183441
Energy: 1.4123675103504183
Energy: 1.4968414111927546
Energy: 1.5057544407605974
Energy: 1.4134421222164173
Energy: 1.5244979175259303
Energy: 1.5516766609745896
Energy: 1.408713734417874
Energy: 1.481621515232925
Energy: 1.4844880134714227
Energy: 1.4085756720586464
Energy: 1.491150757208959
Energy: 1.410599835679198
Energy: 1.4470026588697362
Energy: 1.6310630650709967
Energy: 1.597122033052628
Energy: 1.4478842376894827
Energy: 1.6298577498158668
Energy: 1.5194838266981805
Energy: 1.3913556700187073
Energy: 1.4882094988043908
Energy: 1.4896213404355414
Energy: 1.3918118679677578
Energy: 1.4897950267796465
Energy: 1.3929768505561788
Energy: 1.3933916819509804
Energy: 1.4975555415353647
Energy: 1.3934594982081678
Energy: 1.3954887436034977
Energy: 1.4544783599389417
Energy: 1.3922893853265774
Energy: 1.3916462338725195
Energy: 1.4836471419228279
Energy: 1.5067236228384842
Energy: 1.3917524369977885
Energy: 1.4378545630279107
Energy: 1.4832298930586
Energy: 1.511543792329194
Energy: 1.525100138749441
Energy: 1.4924503608685284
Energy: 1.440081892047991
Energy: 1.5277225772050274
Energy: 1.4389045023142784
Energy: 1.4393416063006677
Energy: 1.4352597454836995
Energy: 1.435767362883734
Energy: 1.4392182022080824
Energy: 1.4393384779433727
Energy: 1.447827330282934
Energy: 1.4802762630703483
Energy: 1.4722613642161542
Energy: 1.3928266408961103
Energy: 1.4824701723599203
Energy: 1.469558779664419
Energy: 1.4871734822528708
Energy: 1.5238529890787322
Energy: 1.3920656428352718
Energy: 1.4621402272450734
Energy: 1.5242788686431121
Energy: 1.4505452027640042
Energy: 1.4544510701305764
Energy: 1.4402956080654756
Energy: 1.4350813304143841
Energy: 1.4486040695558466
Energy: 1.4060852905831651
Energy: 1.4615339012397055
Energy: 1.4471316878844391
Energy: 1.4073720094872861
Energy: 1.4817602751175385
Energy: 1.506997823987479
Energy: 1.4710618095699215
Energy: 1.4825296084612358
Energy: 1.4564213406350657
Energy: 1.524549265006666
Energy: 1.4351595162370734
Energy: 1.420499307120662
Energy: 1.4384131789172943
Energy: 1.4348532664643476
Energy: 1.4347361503516407
Energy: 1.523160664874558
Energy: 1.4503675882447344
Energy: 1.4806953865173265
Energy: 1.525326476314331
Energy: 1.4215998699296897
Energy: 1.4805637995994854
Energy: 1.5278837527831193
Energy: 1.4137584855241248
Energy: 1.4822835129381582
Energy: 1.4393579760628101
Energy: 1.3921831858036737
Energy: 1.4638981154484998
Energy: 1.5209003141596171
Energy: 1.3919910038104075
Energy: 1.3915438051408158
Energy: 1.5117852271699823
Energy: 1.3960067354533192
Energy: 1.3926586320315024
Energy: 1.51891760202343
Energy: 1.394208850482196
Energy: 1.468113703221822
Energy: 1.4881871618857252
Energy: 1.392040603053146
Energy: 1.4968328704200968
Energy: 1.6317542080631915
Energy: 1.464109407224212
Energy: 1.5288808479967269
Energy: 1.631404862793259
Energy: 1.4250938891507812
Energy: 1.557998700309732
Energy: 1.7216657241346582
Energy: 1.4089611176790604
Energy: 1.410235980491046
Energy: 1.488140499230365
Energy: 1.4084313192580262
Energy: 1.4835163304495624
Energy: 1.3926240047527594
Energy: 1.4179888169483688
Energy: 1.5432502575559794
Energy: 1.4577534247307133
Energy: 1.4143793577875647
Energy: 1.4850405252130574

minimum gb energy = 1.3903119191888358 eV
minimum distance =  2.2827190648241 Angstroms
sigma value = 57


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

Energy: 1.9435392718545574
Energy: 1.6822487006382585
Energy: 1.595808146691903
Energy: 1.5951499964910334
Energy: 2.1278997616216366
Energy: 1.5953015813308347
Energy: 1.50548918856459
Energy: 1.4276835505591334
Energy: 1.4438674216942007
Energy: 1.4256969653043856
Energy: 1.430275114462834
Energy: 1.420558291712014
Energy: 1.5084540511106408
Energy: 1.5328532567067097
Energy: 1.529951219272821
Energy: 1.5071074460389013
Energy: 1.5328859243563842
Energy: 1.4937903587616421
Energy: 1.4948974887086937
Energy: 1.435636536009954
Energy: 1.4203151092341615
Energy: 1.4968082723130636
Energy: 1.4220389396975532
Energy: 1.4220230701699241
Energy: 1.4249380260224465
Energy: 1.4942365902092243
Energy: 1.4372239647909164
Energy: 1.4246560905966914
Energy: 1.4952444515199184
Energy: 1.4272537934464165
Energy: 1.4244720252720722
Energy: 1.5036969901271868
Energy: 1.5051810465030775
Energy: 1.5436425652131698
Energy: 1.5024914209196665
Energy: 1.4950193649965795
Energy: 1.5046621709197436
Energy: 1.4426266503921112
Energy: 1.483893677031511
Energy: 1.506829000429117
Energy: 1.4418433453940593
Energy: 1.5053530460215034
Energy: 1.5036414354826333
Energy: 1.4359064319254167
Energy: 1.4275589089330976
Energy: 1.4263204599976413
Energy: 1.425019541726364
Energy: 1.4214574649237066
Energy: 1.3901802622705768
Energy: 1.5029895028513693
Energy: 1.5867699730196174
Energy: 1.3903096997903421
Energy: 1.4959266441171515
Energy: 1.5868846827186696
Energy: 1.3902394629654875
Energy: 1.5019344489126818
Energy: 1.5866998096838054
Energy: 1.3906492984008236
Energy: 1.504277301448797
Energy: 1.587013492435639
Energy: 1.5035813851192301
Energy: 1.4312551878846826
Energy: 1.4275504393397214
Energy: 1.4272661591289197
Energy: 1.4260480856560966
Energy: 1.4209174633529
Energy: 1.4933807951934057
Energy: 1.534588952729444
Energy: 1.5456773555970214
Energy: 1.49504724938708
Energy: 1.5294408412058789
Energy: 1.4931867103311875
Energy: 1.4458183046532571
Energy: 1.4275332942858712
Energy: 1.4207252212046357
Energy: 1.4267796156514465
Energy: 1.4261158863386865
Energy: 1.4201964500729896
Energy: 1.4255774986506355
Energy: 1.5129439805857914
Energy: 1.4951585457569563
Energy: 1.5437309106087178
Energy: 1.5073936345918801
Energy: 1.4948421028069503
Energy: 1.5033917544830853
Energy: 1.447293985077076
Energy: 1.4217670955955188
Energy: 1.5040985208176127
Energy: 1.441934900150272
Energy: 1.419764619390353
Energy: 1.5103047415710564
Energy: 1.4469305729834097
Energy: 1.472816554975002
Energy: 1.5089320538170754
Energy: 1.4421105152562113
Energy: 1.4952330451107743
Energy: 1.3895940040783485
Energy: 1.4272207355857407
Energy: 1.4451677826076155
Energy: 1.3903364637830793
Energy: 1.4280234139452281
Energy: 1.4237883303278778

minimum gb energy = 1.3895940040783485 eV
minimum distance =  2.318651072894 Angstroms
sigma value = 9


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

Energy: 2.3565982820860465
Energy: 1.6897429555567567
Energy: 1.687562115739561
Energy: 1.6910888598349179
Energy: 1.561076018768697
Energy: 1.600269898278517
Energy: 1.6870915529054145
Energy: 1.557049179116058
Energy: 1.459297399170818
Energy: 1.5377771901487365
Energy: 1.5370805847655686
Energy: 1.5265063380108053
Energy: 1.6134755527356595
Energy: 1.5268953502490195
Energy: 1.4783593474874126
Energy: 1.6690377882278553
Energy: 1.5527640539248873
Energy: 1.5512780526506982
Energy: 1.6061836256766922
Energy: 1.545708769810827
Energy: 1.5458127184756267
Energy: 1.607365896036457
Energy: 1.534590029679017
Energy: 1.5388756038771705
Energy: 1.5575556015066168
Energy: 1.499591334358583
Energy: 1.4570553451889483
Energy: 1.560099875698567
Energy: 1.563165305516343
Energy: 1.458422482307491
Energy: 1.5274845475981706
Energy: 1.5460855843856682
Energy: 1.5523947279855483
Energy: 1.5295112351316804
Energy: 1.531078117818314
Energy: 1.5521637687622991
Energy: 1.5062090969781394
Energy: 1.5468123324983951
Energy: 1.4853546080792286
Energy: 1.5040826949860326
Energy: 1.5325811216448655
Energy: 1.4848500301270824
Energy: 1.5612474198337936
Energy: 1.5516839137167817
Energy: 1.5117344545172153
Energy: 1.562180387069822
Energy: 1.5863292397984183
Energy: 1.4687579243886768
Energy: 1.777437273529895
Energy: 1.5197513487219598
Energy: 1.5016560722333947
Energy: 1.55851547752417
Energy: 1.5673949346437324
Energy: 1.5384529246387981
Energy: 1.7802468982305006
Energy: 1.5105128255472131
Energy: 1.5018301495909319
Energy: 1.5590471583610366
Energy: 1.5062586899257946
Energy: 1.4690858071801767
Energy: 1.561920092932684
Energy: 1.4594538540817257
Energy: 1.4706726636616598
Energy: 1.5622430724131924
Energy: 1.4684212868686126
Energy: 1.4702977142047855
Energy: 1.5626608529188837
Energy: 1.5710156983499937
Energy: 1.456720452009914
Energy: 1.5368667069619322
Energy: 1.5572122431080984
Energy: 1.4603049186619903
Energy: 1.8042466571003246
Energy: 1.5832091873618561
Energy: 1.5747010340725263
Energy: 1.530260294491827
Energy: 1.5777327005045338
Energy: 1.4267669459396768
Energy: 1.722117663408813
Energy: 1.5768538181800678
Energy: 1.5359906801135148
Energy: 1.5331435454825095
Energy: 1.6125256752246069
Energy: 1.539897614652076
Energy: 1.5636708095892757
Energy: 1.457231774577157
Energy: 1.4574586398321085
Energy: 1.5650354450476023
Energy: 1.569552204164496
Energy: 1.536042725100682
Energy: 1.545492950578095
Energy: 1.536089197728564
Energy: 1.456301499410692
Energy: 1.546826556674035
Energy: 1.5559629625676352
Energy: 1.466053135175666
Energy: 1.5473788395926062
Energy: 1.5368192590493945
Energy: 1.5810885994520314
Energy: 1.5488031837532998
Energy: 1.5762566635536592
Energy: 1.5403032931236147
Energy: 1.6863578472622298
Energy: 1.6175522866214715
Energy: 1.5559485918108567
Energy: 1.5557745131634755
Energy: 1.6129142836755965
Energy: 1.5554810688365532
Energy: 1.6129494539478322
Energy: 1.5693544147322347
Energy: 1.529176515174517
Energy: 1.6129369897958012
Energy: 1.5826165641745107
Energy: 1.525765447573038
Energy: 1.6116845925742391
Energy: 1.569466574907791
Energy: 1.5309033708324569
Energy: 1.6123375456274576
Energy: 1.561004734258677
Energy: 1.535969817243064
Energy: 1.5437303615524791
Energy: 1.5385622359892965
Energy: 1.5377924003698946
Energy: 1.5729508844862934
Energy: 1.5427665381104774
Energy: 1.4601911622604882

minimum gb energy = 1.4267669459396768 eV
minimum distance =  2.32779559208793 Angstroms
sigma value = 27


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

Energy: 1.6484782473181208
Energy: 1.73772017345955
Energy: 1.562219749194613
Energy: 1.6145442889063513
Energy: 2.170777516880635
Energy: 1.5641435275655318
Energy: 1.656638718046009
Energy: 1.637435110196008
Energy: 1.5763828495764136
Energy: 1.619680687290035
Energy: 1.6138394914887375
Energy: 1.516028475361709
Energy: 1.5653563600823162
Energy: 1.5288107776062254
Energy: 1.527523713822107
Energy: 1.5664413832739998
Energy: 1.481117455143584
Energy: 1.5337195484220683
Energy: 1.5560223617128865
Energy: 1.5379526910857897
Energy: 1.5322745264459237
Energy: 1.5561743141756401
Energy: 1.4995154282390313
Energy: 1.5351772781551534
Energy: 1.5143461566398608
Energy: 1.5505350055073484
Energy: 1.4974817616653593
Energy: 1.515726066908629
Energy: 1.5427629253874546
Energy: 1.4980805585107722
Energy: 1.5493570960245668
Energy: 1.5355526236334056
Energy: 1.5394602022766717
Energy: 1.5503473399212453
Energy: 1.562790347777433
Energy: 1.537761955752019
Energy: 1.5437152139694017
Energy: 1.4435327992529492
Energy: 1.4436402527734595
Energy: 1.5449703227504217
Energy: 1.429314886529062
Energy: 1.4464666268113453
Energy: 1.5267333223328754
Energy: 1.4878771893967613
Energy: 1.5016333835936324
Energy: 1.5273229494545943
Energy: 1.4778658131540423
Energy: 1.5404667093051867
Energy: 1.8020483443723152
Energy: 1.5397585184871005
Energy: 1.5030344490252348
Energy: 1.5236369439523454
Energy: 1.5389120287951639
Energy: 1.512815763756999
Energy: 1.6032346675273794
Energy: 1.5329797829874001
Energy: 1.538706750125899
Energy: 1.5398848415000719
Energy: 1.5319343037979318
Energy: 1.5204472279022
Energy: 1.527305635769355
Energy: 1.503699561234915
Energy: 1.5030090860500773
Energy: 1.5284131899789908
Energy: 1.5254000156281342
Energy: 1.4983287512675698
Energy: 1.552770273602271
Energy: 1.5451798675629291
Energy: 1.5441160163505887
Energy: 1.551254474234119
Energy: 1.5528347397826894
Energy: 1.5463704969172436
Energy: 1.4328217474826341
Energy: 1.5510251167248479
Energy: 1.442889732743323
Energy: 1.4343024146263044
Energy: 1.5559668154875272
Energy: 1.4405469572208196
Energy: 1.420588913630734
Energy: 1.5500443711983112
Energy: 1.5507014318642616
Energy: 1.4225241945339353
Energy: 1.5440250745824644
Energy: 1.4411860002895232
Energy: 1.5493198432023347
Energy: 1.5616981405871415
Energy: 1.5443977169162666
Energy: 1.5513403636635725
Energy: 1.5491487822722505
Energy: 1.5473619670335164
Energy: 1.5836946526972484
Energy: 1.539080661016847
Energy: 1.5459271933162957
Energy: 1.5407715830487159
Energy: 1.527002371145267
Energy: 1.5425228831081832
Energy: 1.5148813557036047
Energy: 1.550309283986945
Energy: 1.5112980988468194
Energy: 1.5117786055104643
Energy: 1.5512109214189367
Energy: 1.5478370360323936
Energy: 1.5774134303595253
Energy: 1.4916911300449363
Energy: 1.5047646705481286
Energy: 1.5166639021801038
Energy: 1.5448603802497518
Energy: 1.5244269533663881
Energy: 1.527984790288816
Energy: 1.428368968420382
Energy: 1.4404877615711722
Energy: 1.529214195697065
Energy: 1.4235075452277848
Energy: 1.4410770556492714
Energy: 1.5436526471998713
Energy: 1.4278775837694593
Energy: 1.440451529684488
Energy: 1.543641005816117
Energy: 1.4238188953890787
Energy: 1.441243982614375
Energy: 1.5448065507814892
Energy: 1.4912674229235865
Energy: 1.492580878370736
Energy: 1.52941880334875
Energy: 1.5469979737051374
Energy: 1.5255286313277108
Energy: 1.504135892815725
Energy: 1.5530439150239619
Energy: 1.5555918345804594
Energy: 1.504753700017879
Energy: 1.5958732227450745
Energy: 1.5635999563772807
Energy: 1.564744387428
Energy: 1.5018747851310323
Energy: 1.5221274600186272
Energy: 1.5615790652523693
Energy: 1.552258304763535
Energy: 1.5384438199415902
Energy: 1.5446011952642182
Energy: 1.5322928234489173
Energy: 1.532374045165351
Energy: 1.5387262558348038
Energy: 1.522866305353835
Energy: 1.5331245375496338
Energy: 1.5512501282299291
Energy: 1.6288646048935185
Energy: 1.6394002154205805
Energy: 1.4812757528875888
Energy: 1.6308247786159118
Energy: 1.4799367667435168

minimum gb energy = 1.420588913630734 eV
minimum distance =  2.30126371004815 Angstroms
sigma value = 19


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

Energy: 2.2943828191156395
Energy: 1.5292256669848672
Energy: 1.5134300141000667
Energy: 1.5013584708597063
Energy: 1.5651296142536175
Energy: 1.48692198263793
Energy: 1.546948444131977
Energy: 1.4845021760066597
Energy: 1.4872849369111796
Energy: 1.4672685924763473
Energy: 1.492900545744192
Energy: 1.48012049431309
Energy: 1.546749527186058
Energy: 1.4725933359831167
Energy: 1.4585089396017403
Energy: 1.5364295046758145
Energy: 1.468807308595758
Energy: 1.4582548278759886
Energy: 1.5423839979723974
Energy: 1.4808793101378586
Energy: 1.4843604246626654
Energy: 1.4922682392866267
Energy: 1.4736327723538223
Energy: 1.4846860819435415
Energy: 1.4765171133953747
Energy: 1.5039873418047072
Energy: 1.4606470965703653
Energy: 1.4855178041697665
Energy: 1.5376088217589488
Energy: 1.4793223335995895
Energy: 1.5553472593604045
Energy: 1.5619229028203152
Energy: 1.5647829652098242
Energy: 1.5184724819828508
Energy: 1.4820791879410666
Energy: 1.5521944049078968
Energy: 1.4869518910855897
Energy: 1.4908398022765004
Energy: 1.5129733290697327
Energy: 1.4800863773965762
Energy: 1.489851632285935
Energy: 1.4924167398127963
Energy: 1.5262632981783395
Energy: 1.49401351706452
Energy: 1.4586700632339589
Energy: 1.5249016489459906
Energy: 1.4993068394162943
Energy: 1.4863351572567574
Energy: 1.455629043088325
Energy: 1.476881468480683
Energy: 1.4826377757076736
Energy: 1.4579972503736662
Energy: 1.5167035689591684
Energy: 1.4793138648701254
Energy: 1.457235495651244
Energy: 1.515826295167616
Energy: 1.4861722907063806
Energy: 1.5039995648587108
Energy: 1.5147925795487411
Energy: 1.4833943378631573
Energy: 1.5354008907401804
Energy: 1.4728291683888755
Energy: 1.420565302179107
Energy: 1.5361469736963675
Energy: 1.4362031997375122
Energy: 1.4189609369108882
Energy: 1.5302398249880966
Energy: 1.4290221146442506
Energy: 1.4523811796050596
Energy: 1.5006480234550117
Energy: 1.5510029671743772
Energy: 1.4519729409818307
Energy: 1.5341593213770404
Energy: 1.4697072938788818
Energy: 1.4793379875406831
Energy: 1.5083526166467613
Energy: 1.4694154591724413
Energy: 1.48590360444162
Energy: 1.631125559960293
Energy: 1.5278589317778897
Energy: 1.5217368741281403
Energy: 1.4263122104804875
Energy: 1.5180122725402605
Energy: 1.5145485919209187
Energy: 1.5308715400484223
Energy: 1.432786646474944
Energy: 1.427583154406987
Energy: 1.530580266488585
Energy: 1.4276086855119197
Energy: 1.4744837885928022
Energy: 1.5305901232339931
Energy: 1.472362127955688
Energy: 1.497889030691609
Energy: 1.5067478098988163
Energy: 1.4289971595302398
Energy: 1.4190096768816276
Energy: 1.492447444369941
Energy: 1.5151518264292885
Energy: 1.4936842647119175
Energy: 1.4297707132259168
Energy: 1.5128688746010828
Energy: 1.4877299685353949
Energy: 1.574598777425449
Energy: 1.4485455073038653
Energy: 1.4844168707224805
Energy: 1.4232261815908511
Energy: 1.4955345501044133
Energy: 1.458699454906111
Energy: 1.5483138945992485
Energy: 1.425516274305966
Energy: 1.4623817157591397
Energy: 1.4836075996360891
Energy: 1.4250633506709394
Energy: 1.4677692800203408
Energy: 1.5142036768777059
Energy: 1.425014211106459
Energy: 1.4625217842790355
Energy: 1.519807053916484
Energy: 1.4250043908604024
Energy: 1.498774843218511
Energy: 1.425872095845909
Energy: 1.448197930065202
Energy: 1.4751495424329766
Energy: 1.427202735853767
Energy: 1.466235356506565
Energy: 1.4757972979881548
Energy: 1.4435245016547025
Energy: 1.4191192168587714
Energy: 1.4511201390075152
Energy: 1.4442660814558295
Energy: 1.4924482289159828
Energy: 1.4541864479074353
Energy: 1.5148464691110493
Energy: 1.4990217621070279
Energy: 1.4320757474827184
Energy: 1.5131552694062385
Energy: 1.4715442312714035
Energy: 1.4652097573830742
Energy: 1.5550668026648449
Energy: 1.4169742165681138
Energy: 1.4929531220713537
Energy: 1.5295056185353184
Energy: 1.4178654436961478
Energy: 1.4907518094304888
Energy: 1.538930320915855
Energy: 1.43370064668346
Energy: 1.4187000908110068
Energy: 1.4609835729266607
Energy: 1.5013814950220692
Energy: 1.4753551549050095
Energy: 1.48647446154785
Energy: 1.48324264937346
Energy: 1.4576435109926151
Energy: 1.4547986995644901
Energy: 1.482883186013443
Energy: 1.4805573745724978
Energy: 1.5470849061280267
Energy: 1.488858366206444
Energy: 1.48335106328605
Energy: 1.5281529807806005
Energy: 1.4738106958166497
Energy: 1.4833111195248052
Energy: 1.5461337883468282
Energy: 1.4721755080425167
Energy: 1.4764297247722071
Energy: 1.5251811403584303
Energy: 1.4706961660802347
Energy: 1.480302554752157
Energy: 1.5753617042075392
Energy: 1.525446377171991
Energy: 1.4850086519634018
Energy: 1.4146255302580504
Energy: 1.5444731144365484
Energy: 1.4923070896771444

minimum gb energy = 1.4146255302580504 eV
minimum distance =  2.29761486185621 Angstroms
sigma value = 101


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

Energy: 2.111811302656008
Energy: 1.4902389120593325
Energy: 1.4938165602486637
Energy: 1.46905738991823
Energy: 1.467028057179796
Energy: 1.3810003972205334
Energy: 1.5383111949072343
Energy: 1.4368430836765695
Energy: 1.4127440108752771
Energy: 1.4977159123775636
Energy: 1.4544430096133747
Energy: 1.4126528410791281
Energy: 1.537374612629782
Energy: 1.3915689192279277
Energy: 1.4259506294881223
Energy: 1.4446462646387577
Energy: 1.3971133677460297
Energy: 1.4260798767056238
Energy: 1.5188761875982735
Energy: 1.4146369412632456
Energy: 1.4163621741009942
Energy: 1.4538787252352643
Energy: 1.4128461172845324
Energy: 1.4148119480435986
Energy: 1.4094239340250503
Energy: 1.4436966995924847
Energy: 1.4261898038072076
Energy: 1.4141932295502608
Energy: 1.5136701674745825
Energy: 1.4434843399829556
Energy: 1.5080706064900098
Energy: 1.4926117318916428
Energy: 1.4888525326406
Energy: 1.5097642414802568
Energy: 1.4765911700368952
Energy: 1.4893530159973494
Energy: 1.4827405178407733
Energy: 1.4079927778664472
Energy: 1.4226737403127987
Energy: 1.4749727124291199
Energy: 1.4029760290507027
Energy: 1.4355929611533063
Energy: 1.4203419841839404
Energy: 1.4103461763047984
Energy: 1.4118582269995992
Energy: 1.5054902471679399
Energy: 1.4733657802758597
Energy: 1.435079952635361
Energy: 1.3885511653210587
Energy: 1.4249269950357863
Energy: 1.4127529679364852
Energy: 1.390557803253518
Energy: 1.4427049766591262
Energy: 1.4123089977792194
Energy: 1.384494569355139
Energy: 1.489309088758642
Energy: 1.4760761820454102
Energy: 1.388608248375531
Energy: 1.4914652329213838
Energy: 1.4735730695516573
Energy: 1.5354940821850422
Energy: 1.3742160320475751
Energy: 1.3726609635428915
Energy: 1.5151223914036542
Energy: 1.3604284032013105
Energy: 1.3735342914217765
Energy: 1.543075697155794
Energy: 1.41799440063005
Energy: 1.4197790795058465
Energy: 1.4704246851713154
Energy: 1.4604514542596665
Energy: 1.4423706739106028
Energy: 1.4355298680954565
Energy: 1.4236777515210843
Energy: 1.4250828634526496
Energy: 1.3854911210117975
Energy: 1.4232501148240149
Energy: 1.4268903362861978
Energy: 1.4340970680738951
Energy: 1.4763895178811566
Energy: 1.4768807317872046
Energy: 1.4031235579244465
Energy: 1.4102180374958784
Energy: 1.4250318959172832
Energy: 1.5362996061249445
Energy: 1.4055392842887986
Energy: 1.3987919443337222
Energy: 1.4436240970870866
Energy: 1.3993096078902052
Energy: 1.42300464335101
Energy: 1.5367590910854891
Energy: 1.4080991156099518
Energy: 1.4120342517712083
Energy: 1.4618963110777756
Energy: 1.4211326599147571
Energy: 1.4150988710254586
Energy: 1.4510771226927597
Energy: 1.5633276764309783
Energy: 1.4755434455633976
Energy: 1.352903103589473
Energy: 1.566610619461942
Energy: 1.3746384825767826
Energy: 1.6176938317794165
Energy: 1.4352320213506133
Energy: 1.4377318766394362
Energy: 1.4569596901936457
Energy: 1.5220278528220146
Energy: 1.455895174215702
Energy: 1.537174814190219
Energy: 1.4091597325696532
Energy: 1.4124567088415558
Energy: 1.4442337387045328
Energy: 1.3964863867738184
Energy: 1.4555853945560437
Energy: 1.5175764005642365
Energy: 1.4096881981287377
Energy: 1.4123788093103435
Energy: 1.5204037527339405
Energy: 1.4080850652273609
Energy: 1.4142286707768532
Energy: 1.4144598664908439
Energy: 1.436195620012572
Energy: 1.426118037033485
Energy: 1.4151385316845109
Energy: 1.5021399245860079
Energy: 1.4512324913738202
Energy: 1.4687375455269154
Energy: 1.4146939471191216
Energy: 1.414311496638141
Energy: 1.439183920610538
Energy: 1.4241419944153235
Energy: 1.4124434350876598
Energy: 1.469105180793428
Energy: 1.4028422459949705
Energy: 1.4114254841041538
Energy: 1.5074107941968822
Energy: 1.411194297210343
Energy: 1.4051399484464264
Energy: 1.5442720071520384
Energy: 1.4132472960577536
Energy: 1.4103900430562832
Energy: 1.501841104083726
Energy: 1.410191657094193
Energy: 1.425627376783937
Energy: 1.384030065375985
Energy: 1.4307303362387558
Energy: 1.4124192631485506
Energy: 1.3847870979803163
Energy: 1.4234919442541631
Energy: 1.4122259881147825
Energy: 1.3872614698393277
Energy: 1.419765445742656
Energy: 1.4021091793752962
Energy: 1.3884971040610519
Energy: 1.4777680121699297
Energy: 1.419428022884854
Energy: 1.5075750296801285
Energy: 1.352195505376034
Energy: 1.3525882698626421
Energy: 1.5089445545447626
Energy: 1.3567360543184281
Energy: 1.3893892763597293
Energy: 1.540800132065598
Energy: 1.3540561195062248
Energy: 1.3541652133138857
Energy: 1.466847789308545
Energy: 1.353019793372046
Energy: 1.4735452796347552
Energy: 1.4346678607110308
Energy: 1.4503609692207085
Energy: 1.4450733720387323
Energy: 1.3811812701616233
Energy: 1.449954555506204
Energy: 1.4190885878756025
Energy: 1.4372312583233324
Energy: 1.449991834101087
Energy: 1.4087879506602365
Energy: 1.3809526999351678
Energy: 1.4474276962588093
Energy: 1.4157389660827282
Energy: 1.540209211667226
Energy: 1.4167565966425477
Energy: 1.4184808452766564
Energy: 1.4660053923994247
Energy: 1.3889470899543794
Energy: 1.4203921652163078
Energy: 1.5366839564201875
Energy: 1.4079827912787517
Energy: 1.4111701070337448
Energy: 1.4233178226546501
Energy: 1.4069225232338842
Energy: 1.413137593926574
Energy: 1.4531237891327584
Energy: 1.386198249961133
Energy: 1.4336714020994847
Energy: 1.3485978451521679
Energy: 1.3858865159072524
Energy: 1.4850505891414996

minimum gb energy = 1.3485978451521679 eV
minimum distance =  2.29822895809399 Angstroms
sigma value = 33


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

Energy: 0.020482209252079633
Energy: 1.6825000489224404
Energy: 0.021236712930580007
Energy: 0.02289610631929141
Energy: 1.2214244008209434
Energy: 0.021054437078956687
Energy: 0.7326815345742996
Energy: 0.1791147287288444
Energy: 0.17613650345305196
Energy: 0.17991142332787602
Energy: 0.17900140357444574
Energy: 0.17649387279156364
Energy: 1.7648212953479614
Energy: 1.2039745952287468
Energy: 1.2016365771362518
Energy: 1.2149574604451532
Energy: 1.2091257642975273
Energy: 1.2014005637915914
Energy: 0.02084004219391234
Energy: 0.1791147287306635
Energy: 0.17613650345305196
Energy: 0.17991142332652466
Energy: 0.17900140357444574
Energy: 0.17649387279109588

minimum gb energy = 0.020482209252079633 eV
minimum distance =  2.45364198481085 Angstroms
sigma value = 1