Model name: model_name=EAM_Dynamo_LandaWynblattSiegel_2000_AlPb__MO_699137396381_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.031036108732224
cohesive_energy=3.3595443185119036
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.010444760931173871
Energy: 0.010900863013569058
Energy: 0.25823009430864247
Energy: 0.010900863013569058
Energy: 0.010900863014073487
Energy: 0.39296858728503425
Energy: 0.010900863014073487
Energy: 0.39296858728503425
Energy: 0.25823009430816607
Energy: 0.010900863013569058
Energy: 0.010444760931173871
Energy: 0.010900863013569058
Energy: 0.010900863013569058
Energy: 0.39296858728503425
Energy: 0.010900863014073487
Energy: 0.39296858728503425

minimum gb energy = 0.010444760931173871 eV
minimum distance =  2.80222663774932 Angstroms
sigma value = 1


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

Energy: 0.5038113182447669
Energy: 0.509146156497846
Energy: 0.540687862954591
Energy: 0.509146156497846
Energy: 0.4884419201979382
Energy: 0.5074976310360693
Energy: 0.4912989987878594
Energy: 0.5074976310372927
Energy: 0.4731456130594314
Energy: 0.49853652306244317
Energy: 0.4996640163008586
Energy: 0.49853652306244317
Energy: 0.4888349224389742
Energy: 0.5233626436599302
Energy: 0.47701475693466916
Energy: 0.523362643660542
Energy: 0.48735905079179387
Energy: 0.5134001702903436
Energy: 0.49426033904422845
Energy: 0.5134001702903436
Energy: 0.47487491713220575
Energy: 0.5687323970058751
Energy: 0.4687658387112613
Energy: 0.5687323970070987
Energy: 0.5106857595480335
Energy: 0.4985227844395632
Energy: 0.4750087932384682
Energy: 0.498522784440175
Energy: 0.46213093429008495
Energy: 0.5133403015287498
Energy: 0.46368368038629676
Energy: 0.5133403015287498
Energy: 0.4766170846273455
Energy: 0.5779217205720864
Energy: 0.5393216174548344
Energy: 0.5779217205714746
Energy: 0.4703274079093602
Energy: 0.4980452006772231
Energy: 0.45597281669779816
Energy: 0.4980452006772231
Energy: 0.5470778279981975
Energy: 0.5047405879689966
Energy: 0.4766583354477192
Energy: 0.5047405879689966
Energy: 0.5038985305671384
Energy: 0.5132627917423835
Energy: 0.48104274669735103
Energy: 0.5132627917423835
Energy: 0.4908828097682565
Energy: 0.49725344116764225
Energy: 0.5104961882014544
Energy: 0.49725344116764225
Energy: 0.4981207958765127
Energy: 0.5071420450327568
Energy: 0.47549401978316236
Energy: 0.5071420450339803
Energy: 0.4773796008255793
Energy: 0.5099503900616563
Energy: 0.4770884315166937
Energy: 0.5099503900610446
Energy: 0.4809800344629308
Energy: 0.5095429872854764
Energy: 0.4924112610419241
Energy: 0.5095429872854764
Energy: 0.4995567981398859
Energy: 0.49873009129940915
Energy: 0.46555561412433233
Energy: 0.49873009129940915
Energy: 0.4913780545866728
Energy: 0.49728088423402084
Energy: 0.5517698751437062
Energy: 0.49728088423402084
Energy: 0.45904302887557147
Energy: 0.5116295762730905
Energy: 0.48780218870869024
Energy: 0.5116295762743139
Energy: 0.5519546444548752
Energy: 0.6385424647532095
Energy: 0.4776508811357218
Energy: 0.6385424647532095
Energy: 0.4681901067994274
Energy: 0.49861699283350513
Energy: 0.4556056063955479
Energy: 0.4986169928322816
Energy: 0.4769511640414901
Energy: 0.5634675666198989
Energy: 0.547496480949455
Energy: 0.5634675666198989
Energy: 0.5318317724648816
Energy: 0.5134295217978481
Energy: 0.4652084696585752
Energy: 0.5134295217990716
Energy: 0.5192427719602382
Energy: 0.4988109225781945
Energy: 0.4748640158530249
Energy: 0.4988109225781945
Energy: 0.47499491210782485
Energy: 0.5678606391041515
Energy: 0.5559702441989393
Energy: 0.5678606391035398
Energy: 0.48772613599976167
Energy: 0.5134644167658373
Energy: 0.4769427942195317
Energy: 0.513464416766449
Energy: 0.48256990536026156
Energy: 0.5740704575552137
Energy: 0.47653743922360803
Energy: 0.574070457557049
Energy: 0.4713250359555394
Energy: 0.49677786170580274
Energy: 0.5002203022786382
Energy: 0.49677786170580274
Energy: 0.48812666769159463
Energy: 0.49537840811695943
Energy: 0.48616412857399954
Energy: 0.4953784081175712
Energy: 0.5178968720835574
Energy: 0.5098963414604177
Energy: 0.5051850327807896
Energy: 0.5098963414604177
Energy: 0.4900576737920661
Energy: 0.504089465287332
Energy: 0.49079593837766783
Energy: 0.504089465287332
Energy: 0.47860487703111954
Energy: 0.5011369229288014
Energy: 0.49815641124401683
Energy: 0.5011369229294131
Energy: 0.48732017393518495
Energy: 0.5227320208493063
Energy: 0.4788497317944043
Energy: 0.5227320208493063

minimum gb energy = 0.4556056063955479 eV
minimum distance =  2.58787759944002 Angstroms
sigma value = 1


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

Energy: 0.5546306034156496
Energy: 0.5462296274850262
Energy: 0.5491947720800239
Energy: 0.5462296274857238
Energy: 0.49671532504611227
Energy: 0.525678385706813
Energy: 0.4979550752524031
Energy: 0.525678385704023
Energy: 0.48682780651135993
Energy: 0.5468841815194062
Energy: 0.5070259116873999
Energy: 0.5468841815194062
Energy: 0.49063345644365775
Energy: 0.4947540129320726
Energy: 0.48102848406048787
Energy: 0.49475401293277016
Energy: 0.4899865455669061
Energy: 0.5281806765425504
Energy: 0.535874777909004
Energy: 0.528180676544643
Energy: 0.5350080414292018
Energy: 0.5282883749076793
Energy: 0.5566043385380877
Energy: 0.5282883749076793
Energy: 0.5464589123287402
Energy: 0.5693196846801404
Energy: 0.48120612094872783
Energy: 0.5693196846829305
Energy: 0.4700136536705391
Energy: 0.5473224354903723
Energy: 0.4815426024118685
Energy: 0.5473224354959525
Energy: 0.4870772321368845
Energy: 0.5016533123106038
Energy: 0.5114353317361617
Energy: 0.5016533123064187
Energy: 0.4876238426451849
Energy: 0.5469654044525053
Energy: 0.4941097807750117
Energy: 0.5469654044497153
Energy: 0.5015020330607824
Energy: 0.512965152500042
Energy: 0.5089671687294773
Energy: 0.512965152498647
Energy: 0.47880551290787643
Energy: 0.5363491818674275
Energy: 0.4969087405840734
Energy: 0.5363491818716125
Energy: 0.5270693390788966
Energy: 0.5258541563420734
Energy: 0.49675913572957403
Energy: 0.525854156339981
Energy: 0.4982809834122888
Energy: 0.5259666657715174
Energy: 0.49018452784125915
Energy: 0.52596666576803
Energy: 0.4786972042214274
Energy: 0.5362768186322683
Energy: 0.5197078515933417
Energy: 0.5362768186287806
Energy: 0.5014496423852255
Energy: 0.5137298155439809
Energy: 0.4980383061708677
Energy: 0.5137298155467709
Energy: 0.4874449869283604
Energy: 0.5472191016900239
Energy: 0.4753449342597712
Energy: 0.547219101694209
Energy: 0.48705900502863336
Energy: 0.5013527325745463
Energy: 0.5115245885406304
Energy: 0.5013527325731512
Energy: 0.47002103783038196
Energy: 0.5474321660019599
Energy: 0.47883363638354653
Energy: 0.5474321660068426
Energy: 0.5467119182662002
Energy: 0.569921533217084
Energy: 0.49226677800797897
Energy: 0.5699215332219351
Energy: 0.5349129273259299
Energy: 0.5283166250466707
Energy: 0.47875392691320107
Energy: 0.5283166250494606
Energy: 0.48994731306909656
Energy: 0.5280864101065825
Energy: 0.49783495786421156
Energy: 0.5280864101065825
Energy: 0.4903859810155417
Energy: 0.4946463908869237
Energy: 0.4809690914517716
Energy: 0.4946463908883187
Energy: 0.4868184099604972
Energy: 0.5468489011384637
Energy: 0.5141114687900701
Energy: 0.546848901142649
Energy: 0.49676236273077623
Energy: 0.5259566047753792
Energy: 0.4979234463399946
Energy: 0.5259566047781692
Energy: 0.5546306034156496
Energy: 0.5462296274850262
Energy: 0.536681007157708
Energy: 0.5462296274864213
Energy: 0.49671532504611227
Energy: 0.525678385706813
Energy: 0.4979550752524031
Energy: 0.525678385704023
Energy: 0.48682780651135993
Energy: 0.5468841815187088
Energy: 0.496846760384854
Energy: 0.5468841815194062
Energy: 0.4906334564443553
Energy: 0.4947540129320726
Energy: 0.4925646021248231
Energy: 0.49475401293416515

minimum gb energy = 0.4700136536705391 eV
minimum distance =  2.54083119531218 Angstroms
sigma value = 25


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

Energy: 0.5549694632133418
Energy: 0.5600746077363828
Energy: 0.597669404817429
Energy: 0.5600746077363828
Energy: 0.5214142895223499
Energy: 0.5344760384616165
Energy: 0.5129417781148606
Energy: 0.5344760384616165
Energy: 0.5031938119997759
Energy: 0.5916536650859715
Energy: 0.5120557368267625
Energy: 0.5916536650859715
Energy: 0.50202393654809
Energy: 0.5608391916789982
Energy: 0.5021679250828935
Energy: 0.5608391916789982
Energy: 0.5043235811743516
Energy: 0.5627923573271074
Energy: 0.5663598383547013
Energy: 0.5627923573279182
Energy: 0.5610968408025572
Energy: 0.5928952041899261
Energy: 0.5855058468795801
Energy: 0.5928952041899261
Energy: 0.5275136780341343
Energy: 0.5112039178141112
Energy: 0.5253059665571853
Energy: 0.5112039178141112
Energy: 0.5988516420285612
Energy: 0.5618614858968534
Energy: 0.4975808398914081
Energy: 0.5618614858968534
Energy: 0.5254142314562062
Energy: 0.5360766193665514
Energy: 0.5281326235998822
Energy: 0.5360766193665514
Energy: 0.5194122961814556
Energy: 0.5927200605033283
Energy: 0.4942624977546949
Energy: 0.5927200605033283
Energy: 0.5124527436620785
Energy: 0.5600179886206159
Energy: 0.521558203816971
Energy: 0.5600179886214267
Energy: 0.5176865578242199
Energy: 0.560124854401819
Energy: 0.5088823405892432
Energy: 0.560124854401819
Energy: 0.5120754533884364
Energy: 0.5558940011010939
Energy: 0.4957102131367334
Energy: 0.5558940011010939
Energy: 0.5257836288325181
Energy: 0.5432152441535462
Energy: 0.5277518341301798
Energy: 0.5432152441527354
Energy: 0.4903679133640675
Energy: 0.5626663995826464
Energy: 0.4963633556619726
Energy: 0.5626663995826464
Energy: 0.5272748863802572
Energy: 0.5105347180372594
Energy: 0.503971244799299
Energy: 0.5105347180372594
Energy: 0.48358316099976545
Energy: 0.5915740025655717
Energy: 0.4837015089926218
Energy: 0.5915740025655717
Energy: 0.5020564545641135
Energy: 0.5439118482272904
Energy: 0.5113605260586344
Energy: 0.5439118482281015
Energy: 0.49607681069291826
Energy: 0.5602837573672591
Energy: 0.5035319083897838
Energy: 0.5602837573672591
Energy: 0.5276195886379538
Energy: 0.5929633600073135
Energy: 0.511860501715232
Energy: 0.5929633600065026
Energy: 0.5163948374366715
Energy: 0.5358071177703114
Energy: 0.5135702694105794
Energy: 0.535807117769519
Energy: 0.5387508866774654
Energy: 0.5614529910417181
Energy: 0.5520981563114163
Energy: 0.5614529910417181
Energy: 0.5207329920704706
Energy: 0.5475098544741666
Energy: 0.5132726617410507
Energy: 0.5475098544741666
Energy: 0.5043747707477745
Energy: 0.5908552192863921
Energy: 0.5126398604201668
Energy: 0.5908552192863921
Energy: 0.5276714044447592
Energy: 0.5218123067583929
Energy: 0.5018545830073586
Energy: 0.5218123067583929

minimum gb energy = 0.48358316099976545 eV
minimum distance =  2.5327681495958 Angstroms
sigma value = 9


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

Energy: 0.5510100413308505
Energy: 0.5516719566600538
Energy: 0.6409439890937554
Energy: 0.5516719566581192
Energy: 0.5420906333574148
Energy: 0.5642896153425929
Energy: 0.5298355691276743
Energy: 0.5642896153416257
Energy: 0.5158478072753943
Energy: 0.5540857067128243
Energy: 0.5285983250081799
Energy: 0.5540857067108896
Energy: 0.6375569500916028
Energy: 0.6078681458792415
Energy: 0.5163274042843057
Energy: 0.6078681458792415
Energy: 0.5958012182385295
Energy: 0.5642846143383241
Energy: 0.6095073463168967
Energy: 0.5642846143392914
Energy: 0.49104537934755177
Energy: 0.5546037594905419
Energy: 0.5452691885671431
Energy: 0.5546037594895745
Energy: 0.5649913260129784
Energy: 0.5160623657786038
Energy: 0.5158162949821217
Energy: 0.5160623657766692
Energy: 0.5517874397684679
Energy: 0.5545638776416115
Energy: 0.5161737086608948
Energy: 0.5545638776425788
Energy: 0.5472352887177607
Energy: 0.5641880487846276
Energy: 0.5436789154358417
Energy: 0.5641880487865621
Energy: 0.5463537870868874
Energy: 0.5523117535970717
Energy: 0.5454572800705471
Energy: 0.5523117535970717
Energy: 0.5110164236946723
Energy: 0.5639735789383841
Energy: 0.5338678894297606
Energy: 0.5639735789374167
Energy: 0.567552744545479
Energy: 0.5723373212228963
Energy: 0.5163222580033509
Energy: 0.5723373212219289
Energy: 0.48594375614436697
Energy: 0.5542415981292652
Energy: 0.5255000403279582
Energy: 0.5542415981302325
Energy: 0.5580140324403339
Energy: 0.5403301527778173
Energy: 0.5412587219049027
Energy: 0.54033015277685
Energy: 0.48598942989058985
Energy: 0.5542957577000324
Energy: 0.5515279329668594
Energy: 0.5542957577009997
Energy: 0.567340088593295
Energy: 0.572494796327175
Energy: 0.5164565523315177
Energy: 0.5724947963291097
Energy: 0.5110058681085863
Energy: 0.563963439874307
Energy: 0.5295968598263763
Energy: 0.5639634398762416
Energy: 0.5463680891995659
Energy: 0.5520406129680565
Energy: 0.5455093887208649
Energy: 0.5520406129699911
Energy: 0.5472451995499528
Energy: 0.5641798454402591
Energy: 0.5436474526752613
Energy: 0.5641798454392919
Energy: 0.5515395578005673
Energy: 0.5544063298704327
Energy: 0.5161634041892319
Energy: 0.5544063298723673
Energy: 0.5649778232494325
Energy: 0.5159906165190693
Energy: 0.5158147257758041
Energy: 0.5159906165200366

minimum gb energy = 0.48594375614436697 eV
minimum distance =  2.64909709481494 Angstroms
sigma value = 25


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

Energy: 0.5406330038011778
Energy: 0.6177571918879216
Energy: 0.6879059216128109
Energy: 0.6177571918879216
Energy: 0.5067329849282132
Energy: 0.5946397368855615
Energy: 0.48972582774055945
Energy: 0.594639736887954
Energy: 0.5443302554999885
Energy: 0.6440281512877478
Energy: 0.48976493365151186
Energy: 0.6440281512877478
Energy: 0.5784991398546709
Energy: 0.6026181413094868
Energy: 0.5805656737545385
Energy: 0.6026181413106829
Energy: 0.5797586816367369
Energy: 0.5061165936827337
Energy: 0.5213274547018221
Energy: 0.5061165936827337
Energy: 0.49142560743583963
Energy: 0.6424706816767433
Energy: 0.543602916771606
Energy: 0.6424706816767433
Energy: 0.48937956222832674
Energy: 0.5445151304786486
Energy: 0.5434659721219002
Energy: 0.5445151304786486
Energy: 0.6271794759193923
Energy: 0.618844601521827
Energy: 0.5340867395826221
Energy: 0.618844601521827
Energy: 0.48976306659408997
Energy: 0.5468244316699302
Energy: 0.5162614149352646
Energy: 0.546824431668734
Energy: 0.619297830779049
Energy: 0.6023600349870661
Energy: 0.5430503538811776
Energy: 0.6023600349870661
Energy: 0.5096669533165709
Energy: 0.6027412619344952
Energy: 0.6624390553132705
Energy: 0.6027412619344952
Energy: 0.5439767226314819
Energy: 0.5371069258978433
Energy: 0.6197975490628128
Energy: 0.5371069258978433
Energy: 0.570139440077434
Energy: 0.644975321117754
Energy: 0.4888604365671714
Energy: 0.6449753211165578
Energy: 0.5447357087227445
Energy: 0.5806538449728421
Energy: 0.5781947377487229
Energy: 0.5806538449728421
Energy: 0.5264018953036796
Energy: 0.6082127097692726
Energy: 0.6289108293461096
Energy: 0.6082127097692726
Energy: 0.5147712480299527
Energy: 0.6318494731133776
Energy: 0.4908965306214287
Energy: 0.6318494731145738
Energy: 0.5441508110966042
Energy: 0.5491087158739414
Energy: 0.6191715807410761
Energy: 0.5491087158739414

minimum gb energy = 0.4888604365671714 eV
minimum distance =  2.62075384660688 Angstroms
sigma value = 17


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

Energy: 0.5646578524630373
Energy: 0.5661100395049762
Energy: 0.6848140762114977
Energy: 0.5661100395036212
Energy: 0.5727213355374907
Energy: 0.5386998611483435
Energy: 0.502134615695047
Energy: 0.538699861147666
Energy: 0.6105291814785377
Energy: 0.5546142077447507
Energy: 0.5031766362305744
Energy: 0.5546142077447507
Energy: 0.5453661169132736
Energy: 0.5630103352957568
Energy: 0.5579095006043957
Energy: 0.5630103352950794
Energy: 0.6194619232146477
Energy: 0.5392586297698994
Energy: 0.5390775183915358
Energy: 0.5392586297698994
Energy: 0.5177650338847444
Energy: 0.5720012721940961
Energy: 0.5835331943479344
Energy: 0.5720012721947737
Energy: 0.5402632156466324
Energy: 0.5626371672917195
Energy: 0.5385055887405751
Energy: 0.5626371672923969
Energy: 0.6029845956775743
Energy: 0.5719253293654116
Energy: 0.5254417605906547
Energy: 0.5719253293965454
Energy: 0.5605941356644203
Energy: 0.5814154955174532
Energy: 0.6117843336835891
Energy: 0.5814154955160983
Energy: 0.6433820575875894
Energy: 0.5676154220405615
Energy: 0.5472436240921047
Energy: 0.5676154220405615
Energy: 0.5040904895081622
Energy: 0.5661876325230939
Energy: 0.6065972632564325
Energy: 0.5661876325230939
Energy: 0.5525828727640616
Energy: 0.5619614096081715
Energy: 0.5531891966019904
Energy: 0.561961409607494
Energy: 0.6077413420915813
Energy: 0.5658084558207154
Energy: 0.5674732474618724
Energy: 0.5658084558207154
Energy: 0.5034228970376748
Energy: 0.5800424837611257
Energy: 0.5820769116855148
Energy: 0.5800424837604482
Energy: 0.57007136321252
Energy: 0.5671724369044145
Energy: 0.5691820365196377
Energy: 0.5671724369050921
Energy: 0.5664081243808625
Energy: 0.5721185955752989
Energy: 0.58034423821144
Energy: 0.5721185955759764
Energy: 0.537855135609509
Energy: 0.5799975711363391
Energy: 0.6479922817255995
Energy: 0.5799975711349841
Energy: 0.6324097704037417
Energy: 0.5544398619271532
Energy: 0.5177217444619175
Energy: 0.5544398619264758
Energy: 0.5450274295554086
Energy: 0.5831150401467814
Energy: 0.5296831321152726
Energy: 0.5831150401467814
Energy: 0.543580638880165
Energy: 0.5632318875418567
Energy: 0.5453980529171394
Energy: 0.5632318875425342
Energy: 0.5405169412984077
Energy: 0.5521205241376426
Energy: 0.5848981027344241
Energy: 0.552120524139675
Energy: 0.5507736399202879
Energy: 0.6028398495852332
Energy: 0.6562938619486238
Energy: 0.6028398495838782
Energy: 0.5931023182151712
Energy: 0.5642378747736938
Energy: 0.5016975523200063
Energy: 0.5642378747791137
Energy: 0.5553798453633518
Energy: 0.5699568644701813
Energy: 0.6078500110196557
Energy: 0.5699568644695039
Energy: 0.5563240941450601
Energy: 0.5513548063088507
Energy: 0.6091187913913778
Energy: 0.5513548063088507
Energy: 0.6414815162732547
Energy: 0.5628632638851772
Energy: 0.5022918860816202
Energy: 0.5628632638858545
Energy: 0.5208309945539934
Energy: 0.5819182456124885
Energy: 0.6866401104883268
Energy: 0.5819182456131661
Energy: 0.563462628506426
Energy: 0.573390835457221
Energy: 0.5859731498192589
Energy: 0.573390835457221
Energy: 0.6293991902209641
Energy: 0.5916580395192734
Energy: 0.5404347990065025
Energy: 0.591658039519951
Energy: 0.5253057587003522
Energy: 0.5825849652304222
Energy: 0.6108090692832329
Energy: 0.5825849652304222

minimum gb energy = 0.5016975523200063 eV
minimum distance =  2.52111983932162 Angstroms
sigma value = 53


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

Energy: 0.4701645757182131
Energy: 0.4704591700753627
Energy: 0.7110188683667648
Energy: 0.4704591700753627
Energy: 0.6031084146734886
Energy: 0.5501361110484837
Energy: 0.5377956074184412
Energy: 0.5501361110469241
Energy: 0.4821949745212082
Energy: 0.47044007578590263
Energy: 0.4687635478973791
Energy: 0.47044007578434294
Energy: 0.4822835872627211
Energy: 0.4705663495665799
Energy: 0.46898839688442157
Energy: 0.4705663495650202
Energy: 0.6032551789664925
Energy: 0.5502547013699648
Energy: 0.5910613582146552
Energy: 0.5502547013715244
Energy: 0.4701645757182131
Energy: 0.4704591700753627
Energy: 0.6624862868902485
Energy: 0.470459170073803
Energy: 0.6031084146734886
Energy: 0.5501361110484837
Energy: 0.5760057158768063
Energy: 0.5501361110469241
Energy: 0.4821949745196485
Energy: 0.47044007578434294
Energy: 0.5290718600760779
Energy: 0.47044007578278324
Energy: 0.4822835872627211
Energy: 0.4705663495650202
Energy: 0.5325471340225924
Energy: 0.4705663495650202
Energy: 0.6032551789664925
Energy: 0.5502547013699648
Energy: 0.6276655302605755
Energy: 0.5502547013699648
Energy: 0.4701645757182131
Energy: 0.470459170073803
Energy: 0.6459246158522566
Energy: 0.470459170073803
Energy: 0.6031084146734886
Energy: 0.5501361110484837
Energy: 0.5760057158799258
Energy: 0.5501361110469241
Energy: 0.4821949745212082
Energy: 0.47044007578434294
Energy: 0.5755547627060659
Energy: 0.47044007578434294

minimum gb energy = 0.4687635478973791 eV
minimum distance =  2.60618724829841 Angstroms
sigma value = 9


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

Energy: 0.5154126506543699
Energy: 0.5905995367943423
Energy: 0.7234157944448742
Energy: 0.5905995367926106
Energy: 0.6483216748233466
Energy: 0.5493794089786165
Energy: 0.5299337742276448
Energy: 0.5493794089797711
Energy: 0.5322138238832687
Energy: 0.5057273518353994
Energy: 0.5199536840433716
Energy: 0.5057273518330904
Energy: 0.6080932314919512
Energy: 0.6108059613807051
Energy: 0.5307117659118056
Energy: 0.6108059613807051
Energy: 0.612561379767785
Energy: 0.5344083391166622
Energy: 0.5437015798809247
Energy: 0.5344083391166622
Energy: 0.5049992075669841
Energy: 0.5048974483564223
Energy: 0.6101198361166199
Energy: 0.5048974483569997
Energy: 0.7035674546887554
Energy: 0.5305798079681626
Energy: 0.5313472139043914
Energy: 0.5305798079687399
Energy: 0.5338262902632809
Energy: 0.6187868842807879
Energy: 0.6176886283575658
Energy: 0.6187868842755924
Energy: 0.5331335733921811
Energy: 0.577035712728425
Energy: 0.5109909538627739
Energy: 0.5770357127243843
Energy: 0.5267678920027279
Energy: 0.5492114519347515
Energy: 0.5315990690684527
Energy: 0.5492114519359061
Energy: 0.5427896839696084
Energy: 0.5713061501479253
Energy: 0.6992158130243448
Energy: 0.5713061501490797
Energy: 0.6211272684899823
Energy: 0.5979165214318347
Energy: 0.5247138842630826
Energy: 0.5979165214266394
Energy: 0.5339582405734399
Energy: 0.5530333322092128
Energy: 0.6655379597097258
Energy: 0.5530333322097901
Energy: 0.6067202540130003
Energy: 0.6350851787302423
Energy: 0.5196554219643434
Energy: 0.6350851787302423
Energy: 0.5316293646239394
Energy: 0.5930343847183126
Energy: 0.6020370493687707
Energy: 0.5930343847183126
Energy: 0.535255301921414
Energy: 0.6180959713035286
Energy: 0.6078383617320359
Energy: 0.6180959713012195
Energy: 0.5807729981883359
Energy: 0.5929279961527841
Energy: 0.5319347799456585
Energy: 0.5929279961527841
Energy: 0.5536289835272458
Energy: 0.5305219114812696
Energy: 0.6067865031986076
Energy: 0.5305219114806923
Energy: 0.6124723977310976
Energy: 0.5507998466770236
Energy: 0.5065277215365303
Energy: 0.5507998466781783
Energy: 0.5240212221294274
Energy: 0.5591850610739256
Energy: 0.6021301010866283
Energy: 0.5591850610750801
Energy: 0.618482600329133
Energy: 0.6106642709835092
Energy: 0.6077475773501935
Energy: 0.6106642709840864
Energy: 0.5901684867254181
Energy: 0.5867238227975918
Energy: 0.5261439200956125
Energy: 0.5867238227970146
Energy: 0.5119371913771882
Energy: 0.5803223318957228
Energy: 0.5384091741910288
Energy: 0.5803223318957228
Energy: 0.7002212657821544
Energy: 0.5689053168578947
Energy: 0.5414944677520581
Energy: 0.5689053168573174
Energy: 0.5301637699391323
Energy: 0.6026279190604483
Energy: 0.6887166179774262
Energy: 0.6026279190604483
Energy: 0.5707046623973311
Energy: 0.5443772820938139
Energy: 0.532764582563016
Energy: 0.5443772820938139
Energy: 0.5934965927403171
Energy: 0.5968193596688968
Energy: 0.603994717335687
Energy: 0.5968193596694741
Energy: 0.5173051148739659
Energy: 0.6105044784655733
Energy: 0.6041400893148622
Energy: 0.610504478467305
Energy: 0.5559783346630335
Energy: 0.5446422794891886
Energy: 0.5320595675765645
Energy: 0.5446422794897661
Energy: 0.529805306645811
Energy: 0.6641694989092845
Energy: 0.6898517116381943
Energy: 0.6641694989092845
Energy: 0.662839651802699
Energy: 0.5687311657246369
Energy: 0.5408699406170737
Energy: 0.5687311657321414
Energy: 0.5147120890143704
Energy: 0.5314575640353584
Energy: 0.5366355146374289
Energy: 0.5314575640353584
Energy: 0.5064834104410941
Energy: 0.5753793950517089
Energy: 0.5269896157655416
Energy: 0.5753793950511316
Energy: 0.6023575036625449
Energy: 0.6111185747353757
Energy: 0.6079015488374863
Energy: 0.6111185747342212
Energy: 0.5433696068630641
Energy: 0.6210111079328836
Energy: 0.7306429874745024
Energy: 0.6210111079328836

minimum gb energy = 0.5048974483564223 eV
minimum distance =  2.54972856402595 Angstroms
sigma value = 73


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

Energy: 0.5412651006796001
Energy: 0.5427034921176028
Energy: 0.7270195144735736
Energy: 0.5427034921176028
Energy: 0.606524093144174
Energy: 0.5508993080823622
Energy: 0.5461081268445094
Energy: 0.5508993080823622
Energy: 0.5400516113735866
Energy: 0.5314124843208045
Energy: 0.5100287637340314
Energy: 0.5314124843189727
Energy: 0.5422557833221388
Energy: 0.5843431391320314
Energy: 0.5697340286549956
Energy: 0.5843431391329476
Energy: 0.5637999086913835
Energy: 0.5581269790093611
Energy: 0.5596634057039273
Energy: 0.5581269790102771
Energy: 0.5564973703304665
Energy: 0.5165768822690705
Energy: 0.6512507263302684
Energy: 0.5165768822681546
Energy: 0.6947140019568777
Energy: 0.5889756823943041
Energy: 0.5412181932096365
Energy: 0.5889756823924724
Energy: 0.5325910346111958
Energy: 0.49791384900024094
Energy: 0.6555286131740168
Energy: 0.49791384900024094
Energy: 0.674182768888593
Energy: 0.4978646455845953
Energy: 0.49788664191966236
Energy: 0.4978646455845953
Energy: 0.5421075344840478
Energy: 0.5830380279652596
Energy: 0.540253415052112
Energy: 0.5830380279661755
Energy: 0.5316519248455737
Energy: 0.5316269017971175
Energy: 0.658336302203354
Energy: 0.5316269017971175
Energy: 0.6018818796913515
Energy: 0.522167957000111
Energy: 0.5261922355172716
Energy: 0.522167957000111
Energy: 0.5319811290076554
Energy: 0.5326171345492811
Energy: 0.6118191761265668
Energy: 0.5326171345501969
Energy: 0.660794252437336
Energy: 0.5725347340382645
Energy: 0.5568873807382615
Energy: 0.5725347340373486
Energy: 0.5261956478908114
Energy: 0.6223308467054601
Energy: 0.6590215023407812
Energy: 0.6223308467054601
Energy: 0.6346281665811956
Energy: 0.554653369940757
Energy: 0.5328473571516213
Energy: 0.5546533699435046
Energy: 0.5590914574267614
Energy: 0.5422213724664948
Energy: 0.5400156751457813
Energy: 0.5422213724683267
Energy: 0.5415984465121396
Energy: 0.5420008906582935
Energy: 0.5646077495623312
Energy: 0.5420008906573777
Energy: 0.5908455954313067
Energy: 0.49785929492166126
Energy: 0.5313460068900413
Energy: 0.49785929492076625
Energy: 0.540316092707938
Energy: 0.5797799614285214
Energy: 0.7168162150219117
Energy: 0.5797799614303532
Energy: 0.6494405724131727
Energy: 0.5639941604747274
Energy: 0.5557920952663035
Energy: 0.5639941604747274
Energy: 0.5696501026260438
Energy: 0.5672709238096202
Energy: 0.6000169847690531
Energy: 0.5672709238096202

minimum gb energy = 0.49785929492076625 eV
minimum distance =  2.58392957636476 Angstroms
sigma value = 7


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

Energy: 0.5081579531582844
Energy: 0.5086299369955731
Energy: 0.7202644408936696
Energy: 0.5086299369962208
Energy: 0.6925988373784242
Energy: 0.5780109932971248
Energy: 0.5422826839516867
Energy: 0.5780109932964773
Energy: 0.52551786960801
Energy: 0.5126338220078983
Energy: 0.5433899259498272
Energy: 0.512633822008546
Energy: 0.5778212717030977
Energy: 0.5434892092832961
Energy: 0.551736972235203
Energy: 0.5434892092813532
Energy: 0.5331910507202386
Energy: 0.5548959665053737
Energy: 0.5123031653139892
Energy: 0.5548959665040784
Energy: 0.5268969614813143
Energy: 0.5516117880905436
Energy: 0.6505853367891862
Energy: 0.5516117880866579
Energy: 0.6170626176454311
Energy: 0.6185034987396894
Energy: 0.5504632960879672
Energy: 0.6185034987416324
Energy: 0.5268627705933658
Energy: 0.509354304745808
Energy: 0.700059751757297
Energy: 0.5093543047425699
Energy: 0.6054040472739012
Energy: 0.5349443185323328
Energy: 0.5525139812648622
Energy: 0.534944318535571
Energy: 0.5325515074384705
Energy: 0.5461192384589771
Energy: 0.5788197226185425
Energy: 0.5461192384628629
Energy: 0.5473717294978817
Energy: 0.5514177960103251
Energy: 0.5845430835192593
Energy: 0.5514177960070871
Energy: 0.5094908362507417
Energy: 0.5551616905038291
Energy: 0.5518256068918977
Energy: 0.5551616905018862
Energy: 0.5088477084797159
Energy: 0.5096976276410005
Energy: 0.594442922967381
Energy: 0.509697627645534
Energy: 0.5436392385392035
Energy: 0.5038784680185523
Energy: 0.5844778887379045
Energy: 0.5038784680159618
Energy: 0.5312023310069626
Energy: 0.613342497388767
Energy: 0.6684160420593517
Energy: 0.6133424973868242
Energy: 0.7094137960544576
Energy: 0.5035474127369352
Energy: 0.5354225754314375
Energy: 0.5035474127375827
Energy: 0.5467093315834435
Energy: 0.5627114858994342
Energy: 0.6226822817614533
Energy: 0.5627114858987866
Energy: 0.5177189706398806
Energy: 0.5608763011985025
Energy: 0.5518319950074068
Energy: 0.5608763012023883
Energy: 0.5465794275507353
Energy: 0.5516135187308489
Energy: 0.5849705587287471
Energy: 0.5516135187314966
Energy: 0.5326217760972359
Energy: 0.5492325086894007
Energy: 0.5535233418500483
Energy: 0.549232508688753
Energy: 0.5906673516739305
Energy: 0.5937594524399612
Energy: 0.548885237719364
Energy: 0.5937594524419041
Energy: 0.5335045520660842
Energy: 0.5919359623263218
Energy: 0.6025657387285799
Energy: 0.5919359623250265
Energy: 0.6659047209703521
Energy: 0.5619417409437417
Energy: 0.5844348485205282
Energy: 0.5619417409411511
Energy: 0.5106499203210696
Energy: 0.5087150979039896
Energy: 0.6737340855500287
Energy: 0.5087150979039896
Energy: 0.5876555753060446
Energy: 0.5544292086295101
Energy: 0.5506851698335575
Energy: 0.5544292086275673
Energy: 0.5782466529663521
Energy: 0.5900228351761391
Energy: 0.5493768219960692
Energy: 0.5900228351709581
Energy: 0.5344463364210211
Energy: 0.5460968609859587
Energy: 0.5610886472433656
Energy: 0.5460968609898446
Energy: 0.5847857688615202
Energy: 0.5621288995820982
Energy: 0.5544240231787687
Energy: 0.5621288995827459
Energy: 0.5246147950215732
Energy: 0.5514376936615498
Energy: 0.6286843721228751
Energy: 0.5514376936634928
Energy: 0.6376813130043815
Energy: 0.6098707429560413
Energy: 0.5417314735688855
Energy: 0.6098707429540983
Energy: 0.5246168825921566
Energy: 0.551269557123143
Energy: 0.6485546195003172
Energy: 0.5512695571270286

minimum gb energy = 0.5035474127369352 eV
minimum distance =  2.56754896733136 Angstroms
sigma value = 29


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

Energy: 0.4728987974061578
Energy: 0.4786792744220172
Energy: 0.763795922465864
Energy: 0.4786792744213655
Energy: 0.6045901796977655
Energy: 0.47423778448328024
Energy: 0.5501709289019278
Energy: 0.4742364882656774
Energy: 0.5491120675968328
Energy: 0.48870064161161014
Energy: 0.5186980576564256
Energy: 0.48870064161226184
Energy: 0.47318764444899836
Energy: 0.4540142225694143
Energy: 0.5500476708401277
Energy: 0.4540142225681109
Energy: 0.4733021670777332
Energy: 0.48185538362517905
Energy: 0.6321068537217451
Energy: 0.4818553836249534
Energy: 0.529597736378693
Energy: 0.48858195524598586
Energy: 0.5297268579663382
Energy: 0.4885819552451086
Energy: 0.5296671208337818
Energy: 0.4817506147517311
Energy: 0.47311556388102827
Energy: 0.48175061475150543
Energy: 0.5501913859902718
Energy: 0.45345897033633714
Energy: 0.47310275926477513
Energy: 0.4534584112596123
Energy: 0.5185769903279248
Energy: 0.48873520397400505
Energy: 0.60592206609281
Energy: 0.48873520397400505

minimum gb energy = 0.4534584112596123 eV
minimum distance =  2.61218951725897 Angstroms
sigma value = 5


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

Energy: 0.4871815565345863
Energy: 0.4904315362417703
Energy: 0.6730916317630572
Energy: 0.49043153624299385
Energy: 0.574871972246842
Energy: 0.5146777415120549
Energy: 0.5027145683364559
Energy: 0.5146777415108313
Energy: 0.4793733569132787
Energy: 0.48842496149180037
Energy: 0.5938191147080171
Energy: 0.48842496149180037
Energy: 0.5449193549446402
Energy: 0.5118484151380563
Energy: 0.4813138440750419
Energy: 0.5118484151386681
Energy: 0.4814613368694974
Energy: 0.5146790877009328
Energy: 0.559961309114961
Energy: 0.5146790877009328
Energy: 0.5454898827401602
Energy: 0.5383218438349595
Energy: 0.47872556590540366
Energy: 0.5383218438355714
Energy: 0.47920823144944374
Energy: 0.5123602500422375
Energy: 0.49120655939925445
Energy: 0.5123602500422375
Energy: 0.4764750298731255
Energy: 0.5384725776011141
Energy: 0.49559827545044166
Energy: 0.5384725775998905
Energy: 0.47996523299183574
Energy: 0.5743082585897019
Energy: 0.49483977266751566
Energy: 0.5743082585884784
Energy: 0.47807764082852516
Energy: 0.512675039592349
Energy: 0.5068877658706775
Energy: 0.512675039592349
Energy: 0.5202975352788618
Energy: 0.5398991917893358
Energy: 0.4945547898908466
Energy: 0.5398991917893358
Energy: 0.4985198177443418
Energy: 0.4849229457273923
Energy: 0.49049745530994115
Energy: 0.4849229457267805
Energy: 0.5113128598475044
Energy: 0.4903297167960746
Energy: 0.493103664566906
Energy: 0.4903297167960746
Energy: 0.48741562614573186
Energy: 0.49101513659914364
Energy: 0.5009393580792453
Energy: 0.49101513660036716
Energy: 0.6297227692771921
Energy: 0.5334361593578528
Energy: 0.4944274675991338
Energy: 0.5334361593578528
Energy: 0.4782132240223497
Energy: 0.48846014255705456
Energy: 0.6147850626526317
Energy: 0.48846014255644277
Energy: 0.5733962654697173
Energy: 0.4850828055507811
Energy: 0.5030204253934415
Energy: 0.4850828055520046
Energy: 0.4811199972090068
Energy: 0.5380405423360104
Energy: 0.6195219013870771
Energy: 0.5380405423366222
Energy: 0.49972870410983156
Energy: 0.5137657904918803
Energy: 0.4931350132907362
Energy: 0.5137657904906567
Energy: 0.47938878140248004
Energy: 0.585722234958492
Energy: 0.4823883349536275
Energy: 0.5857222349603274
Energy: 0.48561850596444434
Energy: 0.5107194324350967
Energy: 0.4815657858914527
Energy: 0.5107194324350967
Energy: 0.5030232684421484
Energy: 0.5126399352957256
Energy: 0.48389316268573984
Energy: 0.5126399352963373
Energy: 0.49624957445600193
Energy: 0.4914229174630545
Energy: 0.49943693516197546
Energy: 0.491422917461831
Energy: 0.4902140737813873
Energy: 0.49459299425442266
Energy: 0.495053628893801
Energy: 0.4945929942550344
Energy: 0.49526951527602536
Energy: 0.48789499363137295
Energy: 0.4961780165668655
Energy: 0.4878949936319847
Energy: 0.48790901692877664
Energy: 0.49105432296095414
Energy: 0.4810712667209605
Energy: 0.4910543229615659
Energy: 0.4961978272777447
Energy: 0.4746579824324115
Energy: 0.5268239137562206
Energy: 0.4746579824317997
Energy: 0.5564768991723235
Energy: 0.5111975273337761
Energy: 0.4782594742001153
Energy: 0.5111975273331644
Energy: 0.4850003067894135
Energy: 0.4806737241532124
Energy: 0.6536055657679684
Energy: 0.4806737241532124
Energy: 0.5888408934625019
Energy: 0.5381867109852905
Energy: 0.4812302486188421
Energy: 0.5381867109865139
Energy: 0.4767393612672666
Energy: 0.4821298595636946
Energy: 0.6175546283938442
Energy: 0.4821298595636946
Energy: 0.5748043680479686
Energy: 0.5327468390444666
Energy: 0.47909813662943473
Energy: 0.53274683904569
Energy: 0.4793542881309004
Energy: 0.5133086527527553
Energy: 0.48749267852303874
Energy: 0.5133086527527553

minimum gb energy = 0.4746579824317997 eV
minimum distance =  2.57889084058426 Angstroms
sigma value = 1


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

Energy: 0.4702582171272836
Energy: 0.4708744802352832
Energy: 0.49073426994827063
Energy: 0.4708744802369749
Energy: 0.6475450843945153
Energy: 0.5003000261066711
Energy: 0.46461528047238915
Energy: 0.5003000261066711
Energy: 0.4543309136499859
Energy: 0.5444502410324215
Energy: 0.5726948895571703
Energy: 0.5444502410315757
Energy: 0.5104584437665296
Energy: 0.5012315686611897
Energy: 0.4570089152763715
Energy: 0.5012315686628813
Energy: 0.4546519265823297
Energy: 0.4692905745514946
Energy: 0.561817164629162
Energy: 0.4692905745514946
Energy: 0.4544464133078773
Energy: 0.4999150752218226
Energy: 0.45725991163038815
Energy: 0.4999150752226684
Energy: 0.45374954063376305
Energy: 0.512374042144681
Energy: 0.4695008039631969
Energy: 0.512374042145527
Energy: 0.45392904706279924
Energy: 0.5444972125878285
Energy: 0.4794774978564467
Energy: 0.5444972125869826
Energy: 0.4704078271144942
Energy: 0.4692831294937512
Energy: 0.4797723537268624
Energy: 0.46928312949544304
Energy: 0.4705365954519243
Energy: 0.46930719331183046
Energy: 0.48002487362511526
Energy: 0.46930719331013865
Energy: 0.45320914993567696
Energy: 0.5444851645168168
Energy: 0.4660973804466463
Energy: 0.5444851645168168
Energy: 0.45314803483332383
Energy: 0.512309686898906
Energy: 0.47148789309316236
Energy: 0.5123096868980601
Energy: 0.4543870313619511
Energy: 0.49994242028767905
Energy: 0.45718279858310124
Energy: 0.49994242028598734
Energy: 0.45453849926100953
Energy: 0.4693846570658521
Energy: 0.5299277178021154
Energy: 0.4693846570675438
Energy: 0.5106674062690243
Energy: 0.5012666415589091
Energy: 0.4574194224416294
Energy: 0.5012666415614467
Energy: 0.45432754638798706
Energy: 0.5444561054449101
Energy: 0.6105605275404381
Energy: 0.5444561054449101
Energy: 0.6476417162117216
Energy: 0.5001946584322915
Energy: 0.46457633849745905
Energy: 0.5001946584289081
Energy: 0.4702582171272836
Energy: 0.4708744802352832
Energy: 0.5159634846925205
Energy: 0.4708744802369749
Energy: 0.6475450843945153
Energy: 0.500300026107517
Energy: 0.46461528047238915
Energy: 0.5003000261066711
Energy: 0.4543309136499859
Energy: 0.5444502410324215
Energy: 0.6859845842412521
Energy: 0.5444502410315757
Energy: 0.5104584437665296
Energy: 0.5012315686603631
Energy: 0.4570089152763715
Energy: 0.5012315686620356
Energy: 0.4546519265823297
Energy: 0.4692905745514946
Energy: 0.5618171644828849
Energy: 0.4692905745514946
Energy: 0.4544464133078773
Energy: 0.4999150752218226
Energy: 0.45725991163038815
Energy: 0.4999150752218226
Energy: 0.45374954063376305
Energy: 0.512374042144681
Energy: 0.4604815063802338
Energy: 0.512374042145527

minimum gb energy = 0.45314803483332383 eV
minimum distance =  2.58286596178908 Angstroms
sigma value = 17


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

Energy: 0.4742554625181086
Energy: 0.47467685795023723
Energy: 0.7803804140774734
Energy: 0.47467685795076003
Energy: 0.5380936482952065
Energy: 0.4708177686510258
Energy: 0.4650311886734536
Energy: 0.4708177686520714
Energy: 0.46266883889833277
Energy: 0.515059002632388
Energy: 0.5685478262648114
Energy: 0.5150590026318651
Energy: 0.6164256482510315
Energy: 0.5561564737931123
Energy: 0.46167480749568734
Energy: 0.5561564737941579
Energy: 0.46495561552644826
Energy: 0.5025787624713246
Energy: 0.6015576930244703
Energy: 0.5025787624734159
Energy: 0.5016683007523434
Energy: 0.5656743031157293
Energy: 0.46719947163344777
Energy: 0.5656743031172977
Energy: 0.4781809371156892
Energy: 0.4949808102257457
Energy: 0.4702337158431064
Energy: 0.4949808102247
Energy: 0.47954970492313265
Energy: 0.5649652826003865
Energy: 0.4631025580490903
Energy: 0.5649652826009092
Energy: 0.47672365854035514
Energy: 0.5661677311030435
Energy: 0.4968292928021663
Energy: 0.5661677311035664
Energy: 0.4699540565261008
Energy: 0.5670905564600337
Energy: 0.4691001908166827
Energy: 0.5670905564589881
Energy: 0.46713482167682796
Energy: 0.5584641261558292
Energy: 0.4639028463326069
Energy: 0.5584641261563519
Energy: 0.4601263858755629
Energy: 0.49192350584188715
Energy: 0.4568304725882182
Energy: 0.49192350584240996
Energy: 0.4774359544784547
Energy: 0.5630041595967108
Energy: 0.4660759207216194
Energy: 0.5630041595956653
Energy: 0.47778204931294455
Energy: 0.5021027363812238
Energy: 0.4747173150413405
Energy: 0.5021027363822694
Energy: 0.4683676945801517
Energy: 0.5585134410732092
Energy: 0.47990032867165794
Energy: 0.5585134410721636
Energy: 0.468266088501588
Energy: 0.4700787894986479
Energy: 0.5968767569567797
Energy: 0.4700787894986479
Energy: 0.49280674344185726
Energy: 0.558150415555123
Energy: 0.46597061253289385
Energy: 0.5581504155535545
Energy: 0.4589649315464138
Energy: 0.5204629530019727
Energy: 0.5931812769713566
Energy: 0.5204629530030181
Energy: 0.537669633933576
Energy: 0.49339780935916844
Energy: 0.4651308199964115
Energy: 0.4933978093633509
Energy: 0.4648080485685928
Energy: 0.4699831838830382
Energy: 0.5991433815919429
Energy: 0.4699831838825154
Energy: 0.6630503529214985
Energy: 0.4670070636865108
Energy: 0.4760289686772026
Energy: 0.4670070636870336
Energy: 0.47625660473221365
Energy: 0.5208123370970623
Energy: 0.7250518147387505
Energy: 0.5208123370970623
Energy: 0.5256819952043841
Energy: 0.5613836067967596
Energy: 0.46585703689226426
Energy: 0.5613836067946683
Energy: 0.46503481722929685
Energy: 0.49599260825533303
Energy: 0.5397889034635498
Energy: 0.49599260825428737
Energy: 0.5088521331469175
Energy: 0.520363254334613
Energy: 0.4601316054052906
Energy: 0.5203632543330445
Energy: 0.4673120789920648
Energy: 0.5026223508090492
Energy: 0.49296394047611153
Energy: 0.5026223508106175
Energy: 0.5334607105417134
Energy: 0.5651610178680878
Energy: 0.46837385656563024
Energy: 0.5651610178707018
Energy: 0.4826217090996398
Energy: 0.5587460326462961
Energy: 0.4826602676838879
Energy: 0.5587460326478645
Energy: 0.4749423499452243
Energy: 0.5021356022506023
Energy: 0.4721629129378188
Energy: 0.5021356022495567
Energy: 0.4673201045542162
Energy: 0.5631353103868474
Energy: 0.5042145147889674
Energy: 0.563135310388416
Energy: 0.4658538256974253
Energy: 0.5008882087697878
Energy: 0.4600466549115339
Energy: 0.5008882087703105
Energy: 0.46607340666037333
Energy: 0.5580881285240316
Energy: 0.46527969478560965
Energy: 0.5580881285235086
Energy: 0.4680986625493795
Energy: 0.5677613671495595
Energy: 0.5464211804326876
Energy: 0.5677613671511279
Energy: 0.4991886441680012
Energy: 0.5656893457604559
Energy: 0.4716031249183701
Energy: 0.5656893457635928
Energy: 0.4623167883356553
Energy: 0.5205455112135778
Energy: 0.4903655673736733
Energy: 0.5205455112125322
Energy: 0.5008275937181151
Energy: 0.4956303307757891
Energy: 0.47734782718819874
Energy: 0.4956303307742207
Energy: 0.46599384969906366
Energy: 0.5681851835108637
Energy: 0.5007999890853396
Energy: 0.5681851835108637
Energy: 0.6002904971193987
Energy: 0.5035530289370176
Energy: 0.4661080049056346
Energy: 0.5035530289344037

minimum gb energy = 0.4568304725882182 eV
minimum distance =  2.57872301477674 Angstroms
sigma value = 89


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

Energy: 0.4149169835178999
Energy: 0.4152159663399323
Energy: 0.7903560717216591
Energy: 0.4152159663399323
Energy: 0.415213153315775
Energy: 0.42995702243410805
Energy: 0.4257082985910667
Energy: 0.42995702243410805
Energy: 0.4239089227718187
Energy: 0.6315026447991757
Energy: 0.7463617288779366
Energy: 0.6315026448005436
Energy: 0.46906443275525256
Energy: 0.42992234166983323
Energy: 0.4256546908526152
Energy: 0.4299223416712012
Energy: 0.4241908627378879
Energy: 0.45577619251629353
Energy: 0.5857873677104201
Energy: 0.45577619251629353
Energy: 0.4240527973763514
Energy: 0.41522424290548837
Energy: 0.41674824977647246
Energy: 0.41522424290548837
Energy: 0.42388658230922877
Energy: 0.49275247492351454
Energy: 0.4152242438872387
Energy: 0.49275247492351454
Energy: 0.43739643869342854
Energy: 0.49125775940296657
Energy: 0.42577024763311194
Energy: 0.49125775940433447
Energy: 0.42428976025433407
Energy: 0.4556526950160944
Energy: 0.43594356720671856
Energy: 0.45565269501472644
Energy: 0.4299786575492782
Energy: 0.45399218780177536
Energy: 0.42435615171573104
Energy: 0.45399218780314327
Energy: 0.4150014121000712
Energy: 0.43016112501498105
Energy: 0.42404506999163805
Energy: 0.43016112501498105
Energy: 0.41516715745882027
Energy: 0.49117713207295366
Energy: 0.4256477188544318
Energy: 0.4911771320715857
Energy: 0.42418654012341594
Energy: 0.4157552030298075
Energy: 0.43486717366580774
Energy: 0.4157552030298075
Energy: 0.4242418953445471
Energy: 0.4539564324251074
Energy: 0.4243304101309644
Energy: 0.4539564324251074
Energy: 0.43752442743520803
Energy: 0.4158571986510856
Energy: 0.4241157629339149
Energy: 0.4158571986510856

minimum gb energy = 0.4149169835178999 eV
minimum distance =  2.59032520109422 Angstroms
sigma value = 13


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

Energy: 0.43166765326224865
Energy: 0.4172772568218709
Energy: 0.7192107811480171
Energy: 0.4172772568218709
Energy: 0.6008575852922119
Energy: 0.42744482100118436
Energy: 0.41626803097958565
Energy: 0.4274448210034778
Energy: 0.4173084729059481
Energy: 0.482283480866407
Energy: 0.515936654349875
Energy: 0.48228348086296685
Energy: 0.41624826413553956
Energy: 0.42911222781517955
Energy: 0.4136659404505343
Energy: 0.42911222779857827
Energy: 0.4233231211195383
Energy: 0.4822824265142359
Energy: 0.45673230405055837
Energy: 0.4822824265165293
Energy: 0.41576350736210627
Energy: 0.4296622142221198
Energy: 0.4220075014543525
Energy: 0.42966221422039974
Energy: 0.42299323073339534
Energy: 0.48802128364210134
Energy: 0.5509432976311588
Energy: 0.48802128363980785
Energy: 0.4166182439832924
Energy: 0.493981408524517
Energy: 0.4219743626874662
Energy: 0.4939814085193568
Energy: 0.4229956056127204
Energy: 0.44661464422787805
Energy: 0.4905750548536089
Energy: 0.4466146446559931
Energy: 0.4949492204240921
Energy: 0.49335457075771255
Energy: 0.41358379309506693
Energy: 0.4933545706986829
Energy: 0.42306175630181425
Energy: 0.4557109467344813
Energy: 0.4138251528105806
Energy: 0.45571094673390794
Energy: 0.5547525026316001
Energy: 0.4547194130712563
Energy: 0.41758023763950586
Energy: 0.4547194130735498
Energy: 0.4383455928005556
Energy: 0.42583236322209683
Energy: 0.43359563969646253
Energy: 0.4258323632295504
Energy: 0.558548406016031
Energy: 0.4554045314298579
Energy: 0.41758035099682717
Energy: 0.4554045314292845
Energy: 0.4226963954962328
Energy: 0.5257104555678833
Energy: 0.4206813732246259
Energy: 0.5257104555667366
Energy: 0.4151548250044511
Energy: 0.455465600189663
Energy: 0.41238047484860796
Energy: 0.4554656001850761
Energy: 0.42248928320760715
Energy: 0.4429626655269909
Energy: 0.41284522957123543
Energy: 0.4429626655338711
Energy: 0.4329048624799887
Energy: 0.4450675340128424
Energy: 0.4206679937170315
Energy: 0.4450675340082817
Energy: 0.4223808223106245
Energy: 0.4873745777591431
Energy: 0.4206386966066145
Energy: 0.4873745777534356
Energy: 0.42267215132457125
Energy: 0.487282279697824
Energy: 0.42062765122571094
Energy: 0.4872822796886503
Energy: 0.43284767565890014
Energy: 0.4449723885396565
Energy: 0.4206535219145489
Energy: 0.4449723885408032
Energy: 0.4224325891970729
Energy: 0.4430118113500223
Energy: 0.412231147608242
Energy: 0.44301181135174245
Energy: 0.41524968067819285
Energy: 0.45545325085914745
Energy: 0.4128519547404062
Energy: 0.4554532508585741
Energy: 0.4231164640948611
Energy: 0.5255944363194507
Energy: 0.41978123877621126
Energy: 0.5255944363217441
Energy: 0.5583464993317264
Energy: 0.45545978971565027
Energy: 0.4177229597841931
Energy: 0.45545978971679696
Energy: 0.4384164126185728
Energy: 0.4256978347556269
Energy: 0.4329595764108195
Energy: 0.42569783475620027
Energy: 0.5552193198521922
Energy: 0.4548539891516166
Energy: 0.417653399630494
Energy: 0.45485398917627096
Energy: 0.4228455055446301
Energy: 0.455652588553807
Energy: 0.4156774247123593
Energy: 0.4556525885561004
Energy: 0.49507946057484786
Energy: 0.4928336834950975
Energy: 0.41352824518694553
Energy: 0.49283368350883205
Energy: 0.4231367590632336
Energy: 0.44658102327916854
Energy: 0.557562668326027
Energy: 0.4465810233221443
Energy: 0.4165287410439647
Energy: 0.4930015780505939
Energy: 0.4221054722319937
Energy: 0.49300157805288725
Energy: 0.42315270071753813
Energy: 0.48786292793654346
Energy: 0.6263132517150886
Energy: 0.4878629279382635
Energy: 0.41597809874600944
Energy: 0.42779546715454775
Energy: 0.4221086720552695
Energy: 0.4277954671574146
Energy: 0.4235201980131641
Energy: 0.48242280779664565
Energy: 0.45322689216241013
Energy: 0.48242280779435226
Energy: 0.4159677695510208
Energy: 0.42884461912466265
Energy: 0.41354346533593966
Energy: 0.42884461918483907

minimum gb energy = 0.412231147608242 eV
minimum distance =  2.59918540462546 Angstroms
sigma value = 37


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

Energy: 0.39712110286119134
Energy: 0.3974999219928667
Energy: 0.7873454797627659
Energy: 0.3974999219928667
Energy: 0.6126000330849891
Energy: 0.5239306546673274
Energy: 0.3824578713675529
Energy: 0.5239306546673274
Energy: 0.3767951932203171
Energy: 0.632612088264206
Energy: 0.7154844695897943
Energy: 0.632612088264206
Energy: 0.3771691728683102
Energy: 0.5247629154987955
Energy: 0.38244979290080616
Energy: 0.5247629154997819
Energy: 0.3814433880578764
Energy: 0.3971529244596055
Energy: 0.44839032774124443
Energy: 0.3971529244596055
Energy: 0.3793768302164405
Energy: 0.523946386755081
Energy: 0.3786605613367971
Energy: 0.523946386755081
Energy: 0.3822048735188054
Energy: 0.6535877556730314
Energy: 0.5032140765200162
Energy: 0.6535877556730314
Energy: 0.38158117598735025
Energy: 0.39736162559285304
Energy: 0.39891325229444663
Energy: 0.39736162559285304
Energy: 0.38157691853489617
Energy: 0.5239378240409334
Energy: 0.5683579547171772
Energy: 0.5239378240409334
Energy: 0.537641108166974
Energy: 0.6273135249351933
Energy: 0.3785643868171147
Energy: 0.6273135249351933
Energy: 0.3821974927867433
Energy: 0.6487126836440764
Energy: 0.37694560146655565
Energy: 0.6487126836440764
Energy: 0.4989217007910023
Energy: 0.3970713343377745
Energy: 0.38250388520110873
Energy: 0.3970713343377745
Energy: 0.3768743783484296
Energy: 0.5239125166718285
Energy: 0.3857876408898035
Energy: 0.5239125166728149
Energy: 0.5033581868214824
Energy: 0.6496716056914571
Energy: 0.38158836669409446
Energy: 0.6496716056914571
Energy: 0.39721973571336744
Energy: 0.4188409142064341
Energy: 0.3815460929181277
Energy: 0.4188409142064341
Energy: 0.3972080037127108
Energy: 0.5238994516000004
Energy: 0.38250462353343706
Energy: 0.5238994516009868
Energy: 0.37684570473493006
Energy: 0.438347870600979
Energy: 0.3935070681356356
Energy: 0.438347870600979
Energy: 0.376974082653809
Energy: 0.6495622180260722
Energy: 0.3817481619110013
Energy: 0.6495622180270586
Energy: 0.3822861933813618
Energy: 0.3972472784680119
Energy: 0.38183361771006846
Energy: 0.3972472784680119
Energy: 0.381666261070264
Energy: 0.5239011274726127
Energy: 0.3768497150784275
Energy: 0.5239011274726127

minimum gb energy = 0.3767951932203171 eV
minimum distance =  2.57611034160806 Angstroms
sigma value = 25


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

Energy: 0.3812710060067222
Energy: 0.5687927444145794
Energy: 0.41501279575402245
Energy: 0.5687927444145794
Energy: 0.6128786913755304
Energy: 0.5750158656498855
Energy: 0.3621227045003168
Energy: 0.5750158656498855
Energy: 0.35777705928003956
Energy: 0.35827262453996833
Energy: 0.6823371154529252
Energy: 0.3582726245391981
Energy: 0.4344701836794776
Energy: 0.5752543485194558
Energy: 0.362107264296439
Energy: 0.575254348520226
Energy: 0.36148395928606364
Energy: 0.47649162803394085
Energy: 0.34847235604961063
Energy: 0.4764916280331705
Energy: 0.34810014405995027
Energy: 0.5754288969986853
Energy: 0.3620615979153109
Energy: 0.5754288969994555
Energy: 0.3619836283933349
Energy: 0.3584363358676839
Energy: 0.5132437748192538
Energy: 0.35843633586845425
Energy: 0.3500683474998955
Energy: 0.4885320090623297
Energy: 0.35881786736856897
Energy: 0.4885320090623297
Energy: 0.3615711569668413
Energy: 0.5756947149558918
Energy: 0.5127328753410626
Energy: 0.5756947149574323
Energy: 0.3518396359668185
Energy: 0.5665746607697335
Energy: 0.3823794645419052
Energy: 0.5665746607689633
Energy: 0.3619806958841314
Energy: 0.4666265088946929
Energy: 0.5223526124728951
Energy: 0.4666265088946929
Energy: 0.4791766079808985
Energy: 0.5677184987280551
Energy: 0.358804719057396
Energy: 0.5677184987288254
Energy: 0.36146199080334623
Energy: 0.5751585298401901
Energy: 0.4352733005915416
Energy: 0.5751585298401901
Energy: 0.456285318913472
Energy: 0.4383007669341724
Energy: 0.36213222913550414
Energy: 0.4383007669341724
Energy: 0.36228276399539094
Energy: 0.4666145211833545
Energy: 0.34815397881967003
Energy: 0.4666145211833545
Energy: 0.45582019989536066
Energy: 0.5876115083239448
Energy: 0.3627186133246224
Energy: 0.5876115083231747
Energy: 0.36151816930803826
Energy: 0.4889088180757191
Energy: 0.3500354565518548
Energy: 0.4889088180757191
Energy: 0.4482002433361095
Energy: 0.4756041880686651
Energy: 0.36215111592880717
Energy: 0.47560418808484095
Energy: 0.38494653308764915
Energy: 0.4662243266776836
Energy: 0.3516026451286542
Energy: 0.4662243266776836
Energy: 0.522529112096296
Energy: 0.4965195385798138
Energy: 0.3610338283208593
Energy: 0.4965195385798138
Energy: 0.36154862901915424
Energy: 0.45700815968719016
Energy: 0.3538629862132191
Energy: 0.45700815968719016
Energy: 0.357987801381391
Energy: 0.5741898523668958
Energy: 0.3621788546651312
Energy: 0.5741898523668958
Energy: 0.3624260271262067
Energy: 0.47424297866932524
Energy: 0.4563995212273801
Energy: 0.47424297866855497
Energy: 0.34814088603566734
Energy: 0.5881770276855542
Energy: 0.3619085308749648
Energy: 0.5881770276863245
Energy: 0.36108482759516314
Energy: 0.5105895899119725
Energy: 0.4559704211954775
Energy: 0.5105895899119725
Energy: 0.35163026391704993
Energy: 0.4891612518318092
Energy: 0.3580926313224246
Energy: 0.48916125183257947

minimum gb energy = 0.34810014405995027 eV
minimum distance =  2.56654425849395 Angstroms
sigma value = 41


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

Energy: 0.47157897463019594
Energy: 0.5271154629996905
Energy: 0.7737061645868838
Energy: 0.5271154629996905
Energy: 0.6015588896700894
Energy: 0.33651814996212365
Energy: 0.3316093707197195
Energy: 0.3365181499633867
Energy: 0.34217574335602874
Energy: 0.3326925531906324
Energy: 0.6545318848807943
Energy: 0.33269255319189533
Energy: 0.46331684470363454
Energy: 0.3356376624803438
Energy: 0.33163348230948936
Energy: 0.3356376624803438
Energy: 0.32877311705050916
Energy: 0.35272126686399474
Energy: 0.3238416384664267
Energy: 0.35272126685957417
Energy: 0.3945327100629475
Energy: 0.335656343848643
Energy: 0.3316490089677079
Energy: 0.33565634384488274
Energy: 0.3310401560275262
Energy: 0.3360809560911285
Energy: 0.3655561672580305
Energy: 0.33608095609176
Energy: 0.3236456366326083
Energy: 0.34423832787274555
Energy: 0.3293841109669136
Energy: 0.34423832787148256
Energy: 0.33299342667999715
Energy: 0.5419068453293613
Energy: 0.472192077105587
Energy: 0.5419068453287298
Energy: 0.3253413905866918
Energy: 0.3296771359464099
Energy: 0.3427116332205113
Energy: 0.32967713594767295
Energy: 0.33104180954721873
Energy: 0.3374435439616358
Energy: 0.5290985400591601
Energy: 0.33744354395913856
Energy: 0.32600343190107234
Energy: 0.3465313673165358
Energy: 0.4702422439974696
Energy: 0.3465313673424274
Energy: 0.33299048739125947
Energy: 0.534427821444706
Energy: 0.5293080296835196
Energy: 0.534427821444706
Energy: 0.4299296190346583
Energy: 0.5305698572411403
Energy: 0.34271855172572674
Energy: 0.5305698572411403
Energy: 0.331068269802739
Energy: 0.33592638464104996
Energy: 0.4624378813022986
Energy: 0.33592638463031443
Energy: 0.4179511725964747
Energy: 0.4077788122036844
Energy: 0.32933755830275324
Energy: 0.40777881216266537
Energy: 0.3331034323220326
Energy: 0.53465427141969
Energy: 0.43042758407169446
Energy: 0.5346542714203214
Energy: 0.41594843340192245
Energy: 0.5305116025556289
Energy: 0.3316133314697671
Energy: 0.5305116025556289
Energy: 0.3310752873790818
Energy: 0.43465551541736047
Energy: 0.3236791305941083
Energy: 0.43465551541736047
Energy: 0.4129428067643996
Energy: 0.4540041802273898
Energy: 0.3352401004677256
Energy: 0.4540041802267583
Energy: 0.3442974363452115
Energy: 0.5345530552034686
Energy: 0.3252704125175791
Energy: 0.5345530552034686
Energy: 0.5295481167586709
Energy: 0.5473919102765055
Energy: 0.33168652619625255
Energy: 0.547391910275874
Energy: 0.47076528602823964
Energy: 0.4353089337704649
Energy: 0.32570710978919165
Energy: 0.4353089337685704
Energy: 0.47095092433956165
Energy: 0.44844633564404657
Energy: 0.33485578100005225
Energy: 0.448446335643415
Energy: 0.3443448572860343
Energy: 0.5567500481271164
Energy: 0.328867947052595
Energy: 0.5567500481271164
Energy: 0.46252474336261973
Energy: 0.5511423867725737
Energy: 0.3316636656298231
Energy: 0.5511423867725737
Energy: 0.3310851883417643
Energy: 0.40618263213921635
Energy: 0.41795030248988674
Energy: 0.4061826321398479
Energy: 0.3291104021814055
Energy: 0.5323977222211802
Energy: 0.3347150987909821
Energy: 0.5323977222205488
Energy: 0.3332961608552668
Energy: 0.5566923615090896
Energy: 0.4160554205108107
Energy: 0.5566923615097211
Energy: 0.3234632183219853
Energy: 0.5518116955242087
Energy: 0.3337475468995492
Energy: 0.5518116955242087
Energy: 0.33331334270026153
Energy: 0.45422346386756407
Energy: 0.41290962610489923
Energy: 0.45422346386756407
Energy: 0.32580406478864893
Energy: 0.5326493344135854
Energy: 0.3471396300503217
Energy: 0.5326493344129538

minimum gb energy = 0.3234632183219853 eV
minimum distance =  2.54347999597183 Angstroms
sigma value = 15


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

Energy: 0.4337955510509735
Energy: 0.5011989460819546
Energy: 0.39023807861169385
Energy: 0.5011989460835596
Energy: 0.587390017360476
Energy: 0.48791518442462584
Energy: 0.3161955801208282
Energy: 0.4879151844240909
Energy: 0.3273504742894069
Energy: 0.31535981054715523
Energy: 0.6911214228203155
Energy: 0.3153598105492951
Energy: 0.586500881407896
Energy: 0.4863208834639756
Energy: 0.3160386088919088
Energy: 0.4863208834639756
Energy: 0.3142591336848896
Energy: 0.5073147718013258
Energy: 0.30508854008513697
Energy: 0.5073147718013258
Energy: 0.41891816882993177
Energy: 0.488919523456133
Energy: 0.3160534170740748
Energy: 0.48891952345773787
Energy: 0.3157444764530719
Energy: 0.3746446892911132
Energy: 0.338124801975625
Energy: 0.37464468929325306
Energy: 0.3625700820729166
Energy: 0.3783030498462738
Energy: 0.31602828475108036
Energy: 0.3783030498526934
Energy: 0.31706834354924335
Energy: 0.5097733108230074
Energy: 0.4374770839129288
Energy: 0.5097733108240773
Energy: 0.30321944050568456
Energy: 0.4890793893351378
Energy: 0.31468675975051014
Energy: 0.48907938933567274
Energy: 0.3157289287684735
Energy: 0.49138760789038494
Energy: 0.48934995700276473
Energy: 0.4913876078914549
Energy: 0.3042911986450485
Energy: 0.3156245598034591
Energy: 0.3276107147514461
Energy: 0.3156245597954346
Energy: 0.31718323720313457
Energy: 0.5048573711291495
Energy: 0.5243083619548057
Energy: 0.5048573711307545
Energy: 0.30475233468657553
Energy: 0.4975245881590841
Energy: 0.4330913581867153
Energy: 0.4975245881574792
Energy: 0.31573568171694966
Energy: 0.4871647400303121
Energy: 0.533916521543677
Energy: 0.487164740031382
Energy: 0.39192396990028844
Energy: 0.37085343439632323
Energy: 0.32778376223003897
Energy: 0.3708534341198398
Energy: 0.3172302500373503
Energy: 0.5050759317893497
Energy: 0.4771449107440765
Energy: 0.5050759317898846
Energy: 0.3853095657318845
Energy: 0.5058862645899922
Energy: 0.3146757257684505
Energy: 0.5058862645894571
Energy: 0.31574152978558306
Energy: 0.48740465464455535
Energy: 0.41920204756108564
Energy: 0.4874046546450903
Energy: 0.3835189777624867
Energy: 0.3712895252746896
Energy: 0.3160666467650015
Energy: 0.3712895252720148
Energy: 0.3172308446736981
Energy: 0.47666275167792255
Energy: 0.36262264461614646
Energy: 0.47666275167845745
Energy: 0.38084935366801803
Energy: 0.5046100684179399
Energy: 0.31892733542177343
Energy: 0.5046100684158488
Energy: 0.31572728128734695
Energy: 0.48740268270027187
Energy: 0.30315490406414375
Energy: 0.48740268270027187
Energy: 0.4844165292357578
Energy: 0.4137583663538254
Energy: 0.3161450916193106
Energy: 0.4137583663527555
Energy: 0.32863251360333756
Energy: 0.49983543218865745
Energy: 0.3046746027757051
Energy: 0.49983543218812243
Energy: 0.4848890802988905
Energy: 0.507529180543225
Energy: 0.31888195222832943
Energy: 0.5075291805421551
Energy: 0.4334397817258426
Energy: 0.5009555361526261
Energy: 0.30465474534419584
Energy: 0.5009555361520911
Energy: 0.5439403557693772
Energy: 0.4115470040371353
Energy: 0.3160600701250256
Energy: 0.4115470040382052
Energy: 0.32870113947490803
Energy: 0.5216849577994004
Energy: 0.306604413013343
Energy: 0.5216849577994004
Energy: 0.42416763224280946
Energy: 0.5028277456287719
Energy: 0.31869538360320326
Energy: 0.5028277456282368
Energy: 0.31580731977339077
Energy: 0.5076167191147675
Energy: 0.38548495015350154
Energy: 0.5076167191142326
Energy: 0.4193658080095573
Energy: 0.4862668473076241
Energy: 0.316140559189822
Energy: 0.4862668473081591
Energy: 0.31713227305819436
Energy: 0.521493900724035
Energy: 0.38348397434315257
Energy: 0.5214939007235
Energy: 0.30660896316179637
Energy: 0.4983255025922419
Energy: 0.3188784206839445
Energy: 0.4983255025922419
Energy: 0.30906129371448293
Energy: 0.5074293460115596
Energy: 0.38071586685055686
Energy: 0.5074293460126296
Energy: 0.3031879660003736
Energy: 0.486449982748526
Energy: 0.3175089805260307
Energy: 0.486449982749061
Energy: 0.31720262574310715
Energy: 0.5215598822217279
Energy: 0.4944327801103837
Energy: 0.5215598822227978

minimum gb energy = 0.30315490406414375 eV
minimum distance =  2.57677668569993 Angstroms
sigma value = 85


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

Energy: 0.4099494421010913
Energy: 0.47241137039248443
Energy: 0.4147011276309176
Energy: 0.47241137039248443
Energy: 0.5769532004261712
Energy: 0.39284459441370506
Energy: 0.29020799454450275
Energy: 0.39284459441324115
Energy: 0.39193979450343425
Energy: 0.34912570101327833
Energy: 0.32371485131212463
Energy: 0.3491257010183821
Energy: 0.5740337835127861
Energy: 0.3930743303958547
Energy: 0.2902232586089363
Energy: 0.3930743303958547
Energy: 0.30487234516503126
Energy: 0.28999435501744997
Energy: 0.33254010497157666
Energy: 0.2899943550202339
Energy: 0.5587994700477074
Energy: 0.3925652208230994
Energy: 0.29021338761881826
Energy: 0.39256522082541934
Energy: 0.28845458243998146
Energy: 0.40101579747981453
Energy: 0.33188437189253855
Energy: 0.4010157974793505
Energy: 0.37480850482445477
Energy: 0.43467698139019906
Energy: 0.29026883468428627
Energy: 0.43467698138973515
Energy: 0.2899399887964834
Energy: 0.34089726868383213
Energy: 0.39063163998795397
Energy: 0.340897268685203
Energy: 0.32392254389945724
Energy: 0.35861934394790757
Energy: 0.28883615331571544
Energy: 0.3586193439469796
Energy: 0.2912013992603386
Energy: 0.34966144965519247
Energy: 0.4464935064947399
Energy: 0.34966144965519247
Energy: 0.27379797917050486
Energy: 0.3916419119277855
Energy: 0.30519999184281993
Energy: 0.39164191192824954
Energy: 0.2898882506877882
Energy: 0.2968640798847377
Energy: 0.4790950890366283
Energy: 0.2968640798847377
Energy: 0.27443798588381885
Energy: 0.3488117127422585
Energy: 0.3917814706693053
Energy: 0.34881171274411443
Energy: 0.29129450567233445
Energy: 0.39283883156253
Energy: 0.5208483472733034
Energy: 0.3928388315634579
Energy: 0.2749079522106607
Energy: 0.47257477082498356
Energy: 0.4096435915859265
Energy: 0.47257477082498356
Energy: 0.2899310678561705
Energy: 0.2968329612023599
Energy: 0.5213591772076975
Energy: 0.29683296120189595
Energy: 0.35041179801054717
Energy: 0.3497332580913769
Energy: 0.39162292406477134
Energy: 0.3497332580913769
Energy: 0.29126024763603026
Energy: 0.39281559084933415
Energy: 0.4789793133443351
Energy: 0.3928155908484062
Energy: 0.34575744628038424
Energy: 0.4751166925169838
Energy: 0.30523256113080416
Energy: 0.4751166925165198
Energy: 0.2899501305277107
Energy: 0.29662620964218717
Energy: 0.4500601516192686
Energy: 0.29662620964033126
Energy: 0.3444232433881341
Energy: 0.3926822138266071
Energy: 0.2888172338138113
Energy: 0.3926822138270711
Energy: 0.29118273095461966
Energy: 0.39113869259400486
Energy: 0.3744368242593217
Energy: 0.3911386925930769
Energy: 0.3444373420802676
Energy: 0.4805615283870348
Energy: 0.29025926072443986
Energy: 0.4805615283870348
Energy: 0.2898340768779467
Energy: 0.3063152758122957
Energy: 0.32404675088290785
Energy: 0.3063152758118317
Energy: 0.4371659332398585
Energy: 0.3488716109205059
Energy: 0.2928042019556044
Energy: 0.3488716109469318
Energy: 0.30630701922574327
Energy: 0.3917461170575414
Energy: 0.27358520014175164
Energy: 0.3917461170575414
Energy: 0.44004426043284095
Energy: 0.47590245764489686
Energy: 0.29031343904174445
Energy: 0.47590245764489686
Energy: 0.39174298686224923
Energy: 0.3486746616104362
Energy: 0.2755658000505868
Energy: 0.34867466160997224
Energy: 0.5207944986574904
Energy: 0.4346796020927126
Energy: 0.29069305092472136
Energy: 0.4346796020927126
Energy: 0.4098633216755829
Energy: 0.46930172865035846
Energy: 0.27481820805936485
Energy: 0.46930172865035846
Energy: 0.4916212736370854
Energy: 0.4802075476074328
Energy: 0.2903006169793179
Energy: 0.4802075476074328
Energy: 0.39179148450351214
Energy: 0.3052437226411042
Energy: 0.2757791201612473
Energy: 0.3052437226411042
Energy: 0.4790326420147935
Energy: 0.3915836499904807
Energy: 0.29029269725542584
Energy: 0.39158364999094464
Energy: 0.30636102875390286
Energy: 0.4797304677467362
Energy: 0.3458636251774066
Energy: 0.4797304677462722
Energy: 0.37994451261502543
Energy: 0.47573580652239816
Energy: 0.2903942604022599
Energy: 0.4757358065228622
Energy: 0.28999098359995057
Energy: 0.3481568717338185
Energy: 0.3442240522591208
Energy: 0.3481568717347464
Energy: 0.3738232949521385
Energy: 0.39145609802387715
Energy: 0.29061037525877964
Energy: 0.39145609802434117
Energy: 0.2912245802247405
Energy: 0.47962675130149507
Energy: 0.3444430190159357
Energy: 0.4796267513010311
Energy: 0.2781698224786361
Energy: 0.4537416906452138
Energy: 0.2917711496422342
Energy: 0.45374169064474973
Energy: 0.2906786243371691
Energy: 0.3938031443288569
Energy: 0.4370772742202197
Energy: 0.3938031443288569
Energy: 0.27354325570608495
Energy: 0.3916188864008426
Energy: 0.30804717003950977
Energy: 0.3916188863999146
Energy: 0.29142238207933235
Energy: 0.4793827978778169
Energy: 0.4399552894219636
Energy: 0.47938279787735283

minimum gb energy = 0.27354325570608495 eV
minimum distance =  2.57527715962153 Angstroms
sigma value = 113


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

Energy: 0.011811584586443605
Energy: 0.012266373290033428
Energy: 0.8706650027848609
Energy: 0.012266373289320058
Energy: 0.6168889414656934
Energy: 0.17674100900757395
Energy: 0.17709979891355818
Energy: 0.1767410090079108
Energy: 0.011811584586443605
Energy: 0.012266373290033428
Energy: 0.7157293699552281
Energy: 0.012266373289676741
Energy: 0.6168889414656934
Energy: 0.17674100900757395
Energy: 0.17709979891530195
Energy: 0.17674100900757395
Energy: 0.011811584586780475
Energy: 0.012266373290033428
Energy: 0.7157293699545344
Energy: 0.012266373289320058
Energy: 0.6168889414653563
Energy: 0.17674100900757395
Energy: 0.17709979891320146
Energy: 0.1767410090079108

minimum gb energy = 0.011811584586443605 eV
minimum distance =  2.82955354777572 Angstroms
sigma value = 1