Model name: model_name=EAM_Dynamo_LiuAdams_1998_AlMg__MO_019873715786_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.03203821182251
cohesive_energy=3.36023026856906
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: 0.010445925194599132
Energy: 0.42210758435923
Energy: 0.010445925194851222
Energy: 0.42210758435948204
Energy: 0.010445925194851222
Energy: 0.42210758435948204
Energy: 0.42210758435948204
Energy: 0.29800544457262923
Energy: 0.42210758435948204
Energy: 0.29800544457262923
Energy: 0.42210758435948204
Energy: 0.29800544457237715
Energy: 0.010445925194851222
Energy: 0.42210758435948204
Energy: 0.010445925194599132
Energy: 0.42210758435948204
Energy: 0.010445925194851222
Energy: 0.42210758435948204
Energy: 0.42210758435923
Energy: 0.29800544457237715
Energy: 0.42210758435948204
Energy: 0.4489173561971156
Energy: 0.42210758435948204
Energy: 0.5368591561952301
Energy: 0.010445925194851222
Energy: 0.42210758435948204
Energy: 0.010445925194599132
Energy: 0.42210758435948204
Energy: 0.010445925196083658
Energy: 0.42210758435973417
Energy: 0.42210758435948204
Energy: 0.29800544457237715
Energy: 0.42210758435948204
Energy: 0.5368591561952301
Energy: 0.42210758435948204
Energy: 0.4427161859221936

minimum gb energy = 0.010445925194599132 eV
minimum distance =  2.59778860205144 Angstroms
sigma value = 1


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

Energy: 0.5764094204894181
Energy: 0.574813395072137
Energy: 0.5764094204900251
Energy: 0.5748133950727438
Energy: 0.5764094204900251
Energy: 0.5748133950727438
Energy: 0.6296712610760946
Energy: 0.5306866486194063
Energy: 0.6296712610767016
Energy: 0.5306866486194063
Energy: 0.6296712610767016
Energy: 0.5306866486194063
Energy: 0.5524918904645536
Energy: 0.6004846317706325
Energy: 0.5524918904639468
Energy: 0.6004846317688121
Energy: 0.5524918904645536
Energy: 0.6004846317694188
Energy: 0.6307105405217973
Energy: 0.5449243050396784
Energy: 0.6307105405217973
Energy: 0.5449243050396784
Energy: 0.6307105405217973
Energy: 0.5449243050396784
Energy: 0.5648689498352131
Energy: 0.6108707360909458
Energy: 0.5648689498352131
Energy: 0.6108707360909458
Energy: 0.5648689498358198
Energy: 0.6108707360909458
Energy: 0.5805033139648519
Energy: 0.5457143988094301
Energy: 0.5805033139636383
Energy: 0.5457143988100369
Energy: 0.580503313964245
Energy: 0.5457143988100369
Energy: 0.5672139854696379
Energy: 0.5833547523817552
Energy: 0.5672139854702446
Energy: 0.5833547523805416
Energy: 0.5672139854708514
Energy: 0.5833547523811484
Energy: 0.5655078879825398
Energy: 0.62751806215106
Energy: 0.5655078879831467
Energy: 0.62751806215106
Energy: 0.5655078879825398
Energy: 0.6275180621516667
Energy: 0.5932442462773558
Energy: 0.5637048124774597
Energy: 0.5932442462779627
Energy: 0.5637048124774597
Energy: 0.5932442462779627
Energy: 0.5637048124774597
Energy: 0.5237673876508487
Energy: 0.6212409677216036
Energy: 0.5237673876508487
Energy: 0.6212409677209968
Energy: 0.523767387650242
Energy: 0.6212409677216036
Energy: 0.5724401226059821
Energy: 0.5322193173358043
Energy: 0.572440122605403
Energy: 0.532219317336411
Energy: 0.572440122606589
Energy: 0.532219317336411
Energy: 0.5362901198156373
Energy: 0.6592105030939082
Energy: 0.5362901198156373
Energy: 0.6592105030939082
Energy: 0.5362901198162441
Energy: 0.6592105030939082
Energy: 0.6352350408742384
Energy: 0.5257599929205945
Energy: 0.6352350408754521
Energy: 0.5257599929205945
Energy: 0.6352350408730247
Energy: 0.5257599929199878
Energy: 0.5564971534186203
Energy: 0.5632640733677576
Energy: 0.5564971534180134
Energy: 0.5632640733677576
Energy: 0.5564971534180134
Energy: 0.5632640733683644
Energy: 0.6413734430926776
Energy: 0.5317935720448881
Energy: 0.641373443091464
Energy: 0.5317935720448881
Energy: 0.6413734430920709
Energy: 0.5317935720454948
Energy: 0.6260609573877346
Energy: 0.5964085815556691
Energy: 0.6260609573883413
Energy: 0.5964085815556691
Energy: 0.6260609573877346
Energy: 0.5964085815550623
Energy: 0.5571415973573227
Energy: 0.5669688914454469
Energy: 0.5571415973573227
Energy: 0.5669688914454469
Energy: 0.5571415973573227
Energy: 0.5669688914454469
Energy: 0.5526889077211927
Energy: 0.5791451123668235
Energy: 0.5526889077211927
Energy: 0.5791451123668235
Energy: 0.5526889077193724
Energy: 0.5791451123668235
Energy: 0.5516561384414899
Energy: 0.5533058115691518
Energy: 0.5516561384408831
Energy: 0.5533058115697588
Energy: 0.5516561384420967
Energy: 0.5533058115703655
Energy: 0.6079793336238543
Energy: 0.5329126243121083
Energy: 0.6079793336238543
Energy: 0.5329126243121083
Energy: 0.607979333624461
Energy: 0.5329126243121083
Energy: 0.5390158846434214
Energy: 0.6649697065287198
Energy: 0.5390158846434214
Energy: 0.6649697065293265
Energy: 0.5390158846434214
Energy: 0.6649697065293265
Energy: 0.5749680282365376
Energy: 0.5629519195158452
Energy: 0.574968028235931
Energy: 0.5629519195158452
Energy: 0.574968028235931
Energy: 0.5629519195158452
Energy: 0.5240613757785137
Energy: 0.618566362456965
Energy: 0.5240613757773002
Energy: 0.6185663624575717
Energy: 0.5240613757785137
Energy: 0.618566362456965

minimum gb energy = 0.523767387650242 eV
minimum distance =  2.69813999864191 Angstroms
sigma value = 33


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

Energy: 0.6211344578858062
Energy: 0.611766367160048
Energy: 0.6029066974498046
Energy: 0.6117663671607382
Energy: 0.6211344578858062
Energy: 0.6117663671576319
Energy: 0.6370956632849961
Energy: 0.5397878822809984
Energy: 0.6370956632853413
Energy: 0.5397878822809984
Energy: 0.637095663284651
Energy: 0.5397878822772016
Energy: 0.5566924634762097
Energy: 0.5692654200557891
Energy: 0.556692463477559
Energy: 0.5692654200544084
Energy: 0.5566924634765235
Energy: 0.5692654200509569
Energy: 0.6212755227486344
Energy: 0.5903696716895017
Energy: 0.6212755227517407
Energy: 0.5903696716891567
Energy: 0.6212755227482892
Energy: 0.5903696716926081
Energy: 0.561354260508902
Energy: 0.6082173096264853
Energy: 0.5613542605092473
Energy: 0.6082173096264853
Energy: 0.5613542605071764
Energy: 0.6082173096275207
Energy: 0.5659576939428854
Energy: 0.5562186103765667
Energy: 0.5659576939442659
Energy: 0.556218610377257
Energy: 0.5659576939428854
Energy: 0.5562186103741507
Energy: 0.5980870823078093
Energy: 0.5976467469961999
Energy: 0.598087082307464
Energy: 0.5976467469961999
Energy: 0.5980870823060834
Energy: 0.5976467469882615
Energy: 0.5227301471864333
Energy: 0.652301166024191
Energy: 0.5227301471847073
Energy: 0.6523011660245361
Energy: 0.5227301471867783
Energy: 0.6523011660245361
Energy: 0.554883815164695
Energy: 0.5782529861884297
Energy: 0.5548838151629693
Energy: 0.5782529861884297
Energy: 0.554883815164695
Energy: 0.5782529861860135
Energy: 0.5288212349443697
Energy: 0.6543982697771048
Energy: 0.5288216858840632
Energy: 0.65439826977745
Energy: 0.5288212349443697
Energy: 0.6543982697812467
Energy: 0.6136734540016971
Energy: 0.5287572377341729
Energy: 0.6136734540030777
Energy: 0.5287572377338277
Energy: 0.6136734540016971
Energy: 0.528757237739005
Energy: 0.5566957605624612
Energy: 0.5960407621383326
Energy: 0.5566959609823237
Energy: 0.5960407621379875
Energy: 0.556695760562116
Energy: 0.596040762139023
Energy: 0.6275843186509721
Energy: 0.5499595893392577
Energy: 0.6275989903855071
Energy: 0.5499595893392577
Energy: 0.6275843186530431
Energy: 0.549959589337877
Energy: 0.5855078783177684
Energy: 0.5804689766007908
Energy: 0.5855081966921944
Energy: 0.5804689766011046
Energy: 0.5855078783177684
Energy: 0.5804689765973393
Energy: 0.6319284009418483
Energy: 0.5654792684735037
Energy: 0.6319284009473708
Energy: 0.5654792684738489
Energy: 0.6319284009418483
Energy: 0.5654792684776454
Energy: 0.5576098394612423
Energy: 0.5698887758158887
Energy: 0.5576098394595166
Energy: 0.5698887758158887
Energy: 0.5576098394595166
Energy: 0.5698887758141629
Energy: 0.5820722286860325
Energy: 0.5573613568126776
Energy: 0.5820722286860325
Energy: 0.5573613568130227
Energy: 0.5820722286863776
Energy: 0.5573613568109519
Energy: 0.5724275026723786
Energy: 0.5808306914124156
Energy: 0.5724275026782463
Energy: 0.5808306914124156
Energy: 0.572427502673069
Energy: 0.5808306914089642
Energy: 0.5703029791365247
Energy: 0.5621382187112041
Energy: 0.5703029791396311
Energy: 0.5621382187125846
Energy: 0.57030297913687
Energy: 0.5621382187150007
Energy: 0.6029512248461733
Energy: 0.5933454759349408
Energy: 0.6028480488537326
Energy: 0.5933454759345957
Energy: 0.6029512248451377
Energy: 0.5933454759408083
Energy: 0.5347730377260347
Energy: 0.6536381884255141
Energy: 0.5346414911645497
Energy: 0.6536381884258592
Energy: 0.5347730377256896
Energy: 0.6536381884217174
Energy: 0.5827560835836645
Energy: 0.5555148453126538
Energy: 0.5827560835795227
Energy: 0.5555148453126538
Energy: 0.5827560835836645
Energy: 0.5555148453112733
Energy: 0.5270077914617144
Energy: 0.6554375372703551
Energy: 0.5277761029441127
Energy: 0.6554375372682841
Energy: 0.5270077914617144
Energy: 0.6554375372665583
Energy: 0.6136663798699754
Energy: 0.5642702628947599
Energy: 0.6136663798717013
Energy: 0.5642702628944147
Energy: 0.6136663798696304
Energy: 0.5642702628995921
Energy: 0.5567019119665761
Energy: 0.5631693754658608
Energy: 0.556704369620923
Energy: 0.5631693754662058
Energy: 0.5567019119669213
Energy: 0.5631693754634446
Energy: 0.6467170653301458
Energy: 0.6076265852874602
Energy: 0.6336505858272415
Energy: 0.6076265852874602
Energy: 0.6467170653291104
Energy: 0.6076265852836635
Energy: 0.62506480324717
Energy: 0.5907409796936377
Energy: 0.6121143767552802
Energy: 0.5907409796936377
Energy: 0.625064803247515
Energy: 0.5907409796912215
Energy: 0.5771627041147485
Energy: 0.5637305115207434
Energy: 0.577162704115784
Energy: 0.5637305115207434
Energy: 0.5771627041147485
Energy: 0.5637305115245399
Energy: 0.6548298626590873
Energy: 0.5373821663326652
Energy: 0.6548298626601227
Energy: 0.537382166331975
Energy: 0.6548298626590873
Energy: 0.5373821663361168
Energy: 0.5279937556420539
Energy: 0.6131364245921996
Energy: 0.5279937556406733
Energy: 0.6131364245925448
Energy: 0.5279937556420539
Energy: 0.6131364245880578
Energy: 0.6442477546337726
Energy: 0.5781834964328754
Energy: 0.6442477546292856
Energy: 0.5781834964328754
Energy: 0.6442477546337726
Energy: 0.5781834964294238
Energy: 0.5477634039582634
Energy: 0.6345393643260842
Energy: 0.5477634039579182
Energy: 0.6345393643278099
Energy: 0.5477634039582634
Energy: 0.6345393643295357
Energy: 0.5833530372822907
Energy: 0.5933681155041016
Energy: 0.583353037285052
Energy: 0.5933681155041016
Energy: 0.5833530372812865
Energy: 0.5933681155034113
Energy: 0.567125370989481
Energy: 0.63431916502492
Energy: 0.5671253709905164
Energy: 0.6343191650245749
Energy: 0.5671253709891358
Energy: 0.6343191650256104
Energy: 0.5735498774736989
Energy: 0.558092338555205
Energy: 0.5735498774750795
Energy: 0.558092338555205
Energy: 0.5735498774740441
Energy: 0.5580923385527891
Energy: 0.5594244903128904
Energy: 0.5946608541202401
Energy: 0.5594244903122
Energy: 0.594660854119895
Energy: 0.5594244903125452
Energy: 0.5946608541195498
Energy: 0.5768577411328145
Energy: 0.5709696063380543
Energy: 0.576858707894289
Energy: 0.5709696063415058
Energy: 0.5768577411328145
Energy: 0.5709696063415058
Energy: 0.5573247430970673
Energy: 0.5639910518920236
Energy: 0.5573228138400345
Energy: 0.5639910518920236
Energy: 0.5573247430963769
Energy: 0.563991051892714
Energy: 0.5853995470085812
Energy: 0.5962687452651173
Energy: 0.5853998805177452
Energy: 0.5962687452647722
Energy: 0.5853995470092715
Energy: 0.5962687452561435
Energy: 0.653469200310719
Energy: 0.5360507827807868
Energy: 0.6534692003114092
Energy: 0.5360507827811318
Energy: 0.653469200310719
Energy: 0.5360507827807868
Energy: 0.5565860668763825
Energy: 0.5542379504631781
Energy: 0.5565860668767277
Energy: 0.5542379504635233
Energy: 0.5565860668763825
Energy: 0.5542379504700811

minimum gb energy = 0.5227301471847073 eV
minimum distance =  2.68086817343267 Angstroms
sigma value = 51


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

Energy: 0.5855355139385745
Energy: 0.5736030889284927
Energy: 0.5855355139377748
Energy: 0.5736030889284927
Energy: 0.5855355139385745
Energy: 0.5736030889284927
Energy: 0.6070105035703209
Energy: 0.5402078117556827
Energy: 0.6070105035711206
Energy: 0.5402078117556827
Energy: 0.6070105035711206
Energy: 0.5402078117556827
Energy: 0.5392785311419426
Energy: 0.5748086640480459
Energy: 0.5392785311419426
Energy: 0.5748086640488457
Energy: 0.5392785311427423
Energy: 0.5748086640464466
Energy: 0.5546888513868002
Energy: 0.5200595162255023
Energy: 0.5546888513868002
Energy: 0.5200595162255023
Energy: 0.5546888513868002
Energy: 0.5200595162255023
Energy: 0.5880107573615619
Energy: 0.5521193655816717
Energy: 0.5880107573615619
Energy: 0.5521193655792727
Energy: 0.5880107573615619
Energy: 0.5521193655800724
Energy: 0.5919500999567481
Energy: 0.5520781047998934
Energy: 0.5919500999567481
Energy: 0.5520781047998934
Energy: 0.5919500999567481
Energy: 0.5520781047982939
Energy: 0.5784952063568971
Energy: 0.5545229126998963
Energy: 0.5784952063568971
Energy: 0.5545229126998963
Energy: 0.5784952063568971
Energy: 0.554522912700696
Energy: 0.537063715262251
Energy: 0.5524309177785169
Energy: 0.537063715262251
Energy: 0.5524309177785169
Energy: 0.537063715262251
Energy: 0.5524309177785169
Energy: 0.6296426828280607
Energy: 0.5213701450793062
Energy: 0.6296426828272611
Energy: 0.5213701450793062
Energy: 0.6296426828272611
Energy: 0.5213701450793062
Energy: 0.5360337195127081
Energy: 0.6402211785625954
Energy: 0.5360337195127081
Energy: 0.6402211785625954
Energy: 0.5360337195135079
Energy: 0.6402211785617957
Energy: 0.6188810984207892
Energy: 0.5211252312519659
Energy: 0.6188810984215889
Energy: 0.5211252312511662
Energy: 0.6188810984207892
Energy: 0.5211252312511662
Energy: 0.5796119707474596
Energy: 0.5749223455992173
Energy: 0.5796119707474596
Energy: 0.574922345600017
Energy: 0.5796119707474596
Energy: 0.5749223455992173
Energy: 0.6381739325629924
Energy: 0.5412989247305521
Energy: 0.6381739325637921
Energy: 0.5412989247305521
Energy: 0.6381739325637921
Energy: 0.5412989247305521
Energy: 0.5384129282719029
Energy: 0.5494412028066541
Energy: 0.5384129282711033
Energy: 0.5494412028058544
Energy: 0.5384129282727027
Energy: 0.5494412028074538
Energy: 0.5545042388555684
Energy: 0.5682931949431551
Energy: 0.5545042388563681
Energy: 0.5682931949431551
Energy: 0.5545042388555684
Energy: 0.5682931949431551
Energy: 0.60509641684637
Energy: 0.5520630163264857
Energy: 0.60509641684637
Energy: 0.5520630163272854
Energy: 0.60509641684637
Energy: 0.5520630163272854
Energy: 0.590677153790664
Energy: 0.6193910802809189
Energy: 0.5906771537914636
Energy: 0.6193910802809189
Energy: 0.590677153790664
Energy: 0.6193910802809189
Energy: 0.5648995318427847
Energy: 0.5519963421888686
Energy: 0.5648995318427847
Energy: 0.5519963421888686
Energy: 0.5648995318427847
Energy: 0.5519963421888686

minimum gb energy = 0.5200595162255023 eV
minimum distance =  2.58198951416051 Angstroms
sigma value = 19


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

Energy: 0.549808836987304
Energy: 0.4843248174021825
Energy: 0.5498088369868296
Energy: 0.4843248174021825
Energy: 0.549808836987304
Energy: 0.4843248174021825
Energy: 0.5779236391994621
Energy: 0.5683221242511205
Energy: 0.5779236391994621
Energy: 0.5683221242482742
Energy: 0.5779236391989877
Energy: 0.5683221242487487
Energy: 0.4582871629880809
Energy: 0.5822742863370797
Energy: 0.45828716298855526
Energy: 0.5822742863404002
Energy: 0.45828716298855526
Energy: 0.5822742863389772
Energy: 0.5360721265854499
Energy: 0.458331198104994
Energy: 0.5360721265854499
Energy: 0.458331198104994
Energy: 0.5360721265854499
Energy: 0.458331198104994
Energy: 0.5093079320716376
Energy: 0.5240935187507578
Energy: 0.509307932072112
Energy: 0.5240935187484075
Energy: 0.5093079320716376
Energy: 0.5240935187493563
Energy: 0.509170707538448
Energy: 0.524041856824916
Energy: 0.5091707075389007
Energy: 0.5240418568258649
Energy: 0.509170707538448
Energy: 0.5240418568258649
Energy: 0.5360670841639045
Energy: 0.45831596434284394
Energy: 0.5360670841639045
Energy: 0.45831596434284394
Energy: 0.5360670841639045
Energy: 0.4583159643423695
Energy: 0.4582933784785633
Energy: 0.5822925804261608
Energy: 0.4582933784780888
Energy: 0.5822925804247377
Energy: 0.4582933784785633
Energy: 0.5822925804256864
Energy: 0.5779232276715136
Energy: 0.568297918412774
Energy: 0.5779232276710393
Energy: 0.5682979184156203
Energy: 0.5779232276705649
Energy: 0.5682979184160947
Energy: 0.549808836987304
Energy: 0.4843248174021825
Energy: 0.549808836987304
Energy: 0.4843248174021825
Energy: 0.549808836987304
Energy: 0.4843248174021825
Energy: 0.5779236391989877
Energy: 0.5683221242463984
Energy: 0.5779236391985133
Energy: 0.5683221242473471
Energy: 0.5779236391994621
Energy: 0.5683221242473471
Energy: 0.45828716298855526
Energy: 0.5822742863380284
Energy: 0.45828716298855526
Energy: 0.5822742863394516
Energy: 0.4582871629880809
Energy: 0.5822742863389772
Energy: 0.5360721265849755
Energy: 0.458331198104994
Energy: 0.5360721265849755
Energy: 0.458331198104994
Energy: 0.5360721265859243
Energy: 0.458331198104994
Energy: 0.5093079320716376
Energy: 0.5240935187488819
Energy: 0.5093079320716376
Energy: 0.5240935187512321
Energy: 0.5093079320711632
Energy: 0.5240935187484075
Energy: 0.5091707075389007
Energy: 0.5240418568263391
Energy: 0.509170707538448
Energy: 0.5240418568258649
Energy: 0.5091707075389007
Energy: 0.5240418568253905
Energy: 0.5360670841634302
Energy: 0.4583159643423695
Energy: 0.5360670841634302
Energy: 0.45831596434284394
Energy: 0.5360670841634302
Energy: 0.45831596434284394
Energy: 0.4582933784785633
Energy: 0.5822925804261608
Energy: 0.4582933784785633
Energy: 0.582292580425212
Energy: 0.4582933784785633
Energy: 0.5822925804271095
Energy: 0.5779232276719879
Energy: 0.5682979184122997
Energy: 0.5779232276729367
Energy: 0.5682979184160947
Energy: 0.5779232276729367
Energy: 0.5682979184151459
Energy: 0.549808836987304
Energy: 0.48432481740265676
Energy: 0.549808836987304
Energy: 0.4843248174021825
Energy: 0.5498088369877784
Energy: 0.4843248174021825
Energy: 0.5779236391999365
Energy: 0.5683221242501717
Energy: 0.5779236391989877
Energy: 0.5683221242478216
Energy: 0.5779236391989877
Energy: 0.5683221242478216
Energy: 0.45828716298855526
Energy: 0.5822742863375541
Energy: 0.45828716298855526
Energy: 0.5822742863404002
Energy: 0.4582871629880809
Energy: 0.5822742863385026
Energy: 0.5360721265849755
Energy: 0.458331198104994
Energy: 0.5360721265849755
Energy: 0.458331198104994
Energy: 0.5360721265854499
Energy: 0.458331198104994
Energy: 0.509307932072112
Energy: 0.5240935187488819
Energy: 0.509307932072112
Energy: 0.5240935187512321
Energy: 0.5093079320716376
Energy: 0.5240935187498307
Energy: 0.509170707538448
Energy: 0.5240418568258649
Energy: 0.509170707538448
Energy: 0.5240418568268135
Energy: 0.5091707075389007
Energy: 0.5240418568268135
Energy: 0.5360670841639045
Energy: 0.45831596434284394
Energy: 0.5360670841634302
Energy: 0.45831596434284394
Energy: 0.5360670841639045
Energy: 0.4583159643423695
Energy: 0.4582933784785633
Energy: 0.582292580425212
Energy: 0.4582933784785633
Energy: 0.5822925804247377
Energy: 0.4582933784785633
Energy: 0.5822925804256864
Energy: 0.5779232276719879
Energy: 0.5682979184122997
Energy: 0.5779232276715136
Energy: 0.5682979184156203
Energy: 0.5779232276734111
Energy: 0.5682979184156203
Energy: 0.5498088369877784
Energy: 0.48432481740265676
Energy: 0.549808836987304
Energy: 0.48432481740265676
Energy: 0.549808836987304
Energy: 0.4843248174021825
Energy: 0.5779236391994621
Energy: 0.568322124249223
Energy: 0.5779236391994621
Energy: 0.5683221242482742
Energy: 0.5779236391989877
Energy: 0.568322124249223
Energy: 0.4582871629880809
Energy: 0.5822742863375541
Energy: 0.45828716298855526
Energy: 0.5822742863389772
Energy: 0.45828716298855526
Energy: 0.5822742863399258

minimum gb energy = 0.4582871629880809 eV
minimum distance =  2.57078908881387 Angstroms
sigma value = 27


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

Energy: 0.4868229589686646
Energy: 0.46984547841113755
Energy: 0.4868229589686646
Energy: 0.46984547841113755
Energy: 0.4868229589698266
Energy: 0.46984547841113755
Energy: 0.5668142213268895
Energy: 0.5034969099822072
Energy: 0.5668142213292133
Energy: 0.5034969099822072
Energy: 0.5668142213280514
Energy: 0.5034969099822072
Energy: 0.46132861064938385
Energy: 0.5460527711592367
Energy: 0.461328610516974
Energy: 0.5460527711592367
Energy: 0.46132861054021307
Energy: 0.5460527711592367
Energy: 0.5142880536162352
Energy: 0.45257079499575026
Energy: 0.5142880536150733
Energy: 0.45257079499575026
Energy: 0.5142880536150733
Energy: 0.45257079499575026
Energy: 0.5369524649251517
Energy: 0.45148925167234993
Energy: 0.5369524649228279
Energy: 0.45148925167234993
Energy: 0.5369524649228279
Energy: 0.451489251671188
Energy: 0.5121356143299849
Energy: 0.5553625312240534
Energy: 0.5121356143299849
Energy: 0.5553625312252154
Energy: 0.512135614328823
Energy: 0.5553625312252154
Energy: 0.47066211287315396
Energy: 0.4876883380200668
Energy: 0.47066211287315396
Energy: 0.4876883380200668
Energy: 0.47066211287315396
Energy: 0.4876883380200668
Energy: 0.48712241648229193
Energy: 0.47239961497324495
Energy: 0.48712241648229193
Energy: 0.47239961497440686
Energy: 0.48712241648229193
Energy: 0.47239961497324495
Energy: 0.5002592292843562
Energy: 0.47429673067533534
Energy: 0.5002592292855181
Energy: 0.4742967306730114
Energy: 0.5002592292866801
Energy: 0.47429673067417333
Energy: 0.5109496012184833
Energy: 0.5311106188324951
Energy: 0.5109496012184833
Energy: 0.5311106188324951
Energy: 0.5109496012184833
Energy: 0.5311106188324951
Energy: 0.48775319401118805
Energy: 0.4394852156213698
Energy: 0.48775319401118805
Energy: 0.43948521562253173
Energy: 0.48775319401118805
Energy: 0.4394852156213698
Energy: 0.5348809754431144
Energy: 0.49970343447728227
Energy: 0.5348809754419525
Energy: 0.49970343447495835
Energy: 0.5348809754431144
Energy: 0.4997034344784442

minimum gb energy = 0.4394852156213698 eV
minimum distance =  2.57468764644544 Angstroms
sigma value = 9


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

Energy: 0.44994809661546836
Energy: 0.44282706693348317
Energy: 0.44994809661546836
Energy: 0.4428270669331567
Energy: 0.4499480966144889
Energy: 0.44282706693348317
Energy: 0.5971701550367767
Energy: 0.420224060375924
Energy: 0.5971701550357973
Energy: 0.42022406037559756
Energy: 0.5971701550361238
Energy: 0.42022406037559756
Energy: 0.40326652261666834
Energy: 0.6176870172568205
Energy: 0.4032665226173212
Energy: 0.6176870172568205
Energy: 0.4032665226173212
Energy: 0.6176870172568205
Energy: 0.4290269503052414
Energy: 0.41223720452785667
Energy: 0.4290269503058944
Energy: 0.41223720452785667
Energy: 0.4290269503058944
Energy: 0.41223720452753027
Energy: 0.43951681300198403
Energy: 0.42708642749443615
Energy: 0.43951681300198403
Energy: 0.4270864274947626
Energy: 0.4395168130010046
Energy: 0.4270864274947626
Energy: 0.4475067885372375
Energy: 0.4281407143795655
Energy: 0.4475067885310344
Energy: 0.42814071438185086
Energy: 0.4475067885346257
Energy: 0.4281407143802185
Energy: 0.4236686432831977
Energy: 0.49829058165191875
Energy: 0.42366864328287124
Energy: 0.49829058165191875
Energy: 0.4236686432825447
Energy: 0.49829058165191875
Energy: 0.39516279169323204
Energy: 0.48410722422932384
Energy: 0.395162791693885
Energy: 0.4841072242296503
Energy: 0.39516279169323204
Energy: 0.48410722422932384
Energy: 0.560400722868737
Energy: 0.4269886973882001
Energy: 0.5604007228631869
Energy: 0.4269886973885266
Energy: 0.560400722867431
Energy: 0.4269886973878736
Energy: 0.44432061145355306
Energy: 0.5550824873245654
Energy: 0.4443206114532265
Energy: 0.5550824873216271
Energy: 0.4443206114532265
Energy: 0.5550824873209741
Energy: 0.4292618885202192
Energy: 0.4132648985615263
Energy: 0.42926188851923974
Energy: 0.4132648985615263
Energy: 0.4292618885198927
Energy: 0.41326489856119986
Energy: 0.4122954897401694
Energy: 0.4609128580840552
Energy: 0.41229548974049585
Energy: 0.46091285808601407
Energy: 0.4122954897398429
Energy: 0.46091285808666704
Energy: 0.4420465080963267
Energy: 0.4239596847006154
Energy: 0.4420465080973061
Energy: 0.42395968469571826
Energy: 0.44204650809959145
Energy: 0.42395968469604467
Energy: 0.4504656061798014
Energy: 0.42806387678531055
Energy: 0.45046560617686315
Energy: 0.4280638767885754
Energy: 0.450465606178822
Energy: 0.4280638767918104
Energy: 0.4163398475812564
Energy: 0.4556653690699898
Energy: 0.41633984758060344
Energy: 0.45566536907064276
Energy: 0.4163398475809299
Energy: 0.45566536907064276
Energy: 0.514902619208717
Energy: 0.42864572807424073
Energy: 0.5149026192126349
Energy: 0.428645728077832
Energy: 0.5149026192074112
Energy: 0.4286457280683641
Energy: 0.5079847847557555
Energy: 0.5185107874883058
Energy: 0.5079847847557555
Energy: 0.5185107874909176
Energy: 0.5079847847570614
Energy: 0.5185107874905912
Energy: 0.42740006321573054
Energy: 0.4273961046166482
Energy: 0.4274000632154041
Energy: 0.4273961046166482
Energy: 0.4274000632163835
Energy: 0.42739610461697464
Energy: 0.3978294589843258
Energy: 0.5793971314799462
Energy: 0.39782945898530525
Energy: 0.5793971314805991
Energy: 0.3978294589849788
Energy: 0.5793971314802727
Energy: 0.5469927383481811
Energy: 0.42485974168939955
Energy: 0.5469927383481811
Energy: 0.42485974168939955
Energy: 0.5469927383468751
Energy: 0.424859741689726
Energy: 0.3979363071921153
Energy: 0.5794161047044296
Energy: 0.39793630719309475
Energy: 0.5794161047041031
Energy: 0.3979363071927683
Energy: 0.5794161047044296
Energy: 0.42552581975579507
Energy: 0.4274615757602084
Energy: 0.4255258197571011
Energy: 0.4274615757602084
Energy: 0.42552581975612164
Energy: 0.4274615757602084
Energy: 0.5081817376036979
Energy: 0.5186524106608281
Energy: 0.5081817376046773
Energy: 0.5186524106588692
Energy: 0.5081817376040244
Energy: 0.5186524106562573
Energy: 0.515081040161765
Energy: 0.43376554109442567
Energy: 0.5150810401673152
Energy: 0.4337655410905079
Energy: 0.515081040159806
Energy: 0.4337655410954051
Energy: 0.4162831557453362
Energy: 0.45550817499792534
Energy: 0.41628315574566266
Energy: 0.45550817499727236
Energy: 0.4162831557450097
Energy: 0.45550817499792534
Energy: 0.45064725953932533
Energy: 0.4448331124834581
Energy: 0.4506472595386724
Energy: 0.4448331124828052
Energy: 0.45064725954030477
Energy: 0.4448331124818258
Energy: 0.44215740149572486
Energy: 0.42381654625083237
Energy: 0.44215740149735727
Energy: 0.42381654625115894
Energy: 0.44215740149572486
Energy: 0.42381654625148535
Energy: 0.41269075188795085
Energy: 0.4342917140133178
Energy: 0.41269075188729787
Energy: 0.434291714019521
Energy: 0.41269075188827725
Energy: 0.434291714019521
Energy: 0.42932635323103274
Energy: 0.4134993766754642
Energy: 0.4293263532300533
Energy: 0.4134993766754642
Energy: 0.42932635322972684
Energy: 0.4134993766754642
Energy: 0.4439800626338365
Energy: 0.5291579318052481
Energy: 0.44398006263416295
Energy: 0.5291579315281847
Energy: 0.44398006263351003
Energy: 0.5291579313366295
Energy: 0.5601648167808427
Energy: 0.42709096290430265
Energy: 0.5601648167775779
Energy: 0.42709096290462917
Energy: 0.5601648167867194
Energy: 0.42709096290462917
Energy: 0.3950443694850824
Energy: 0.4841531788376195
Energy: 0.39504436948475596
Energy: 0.4841531788376195
Energy: 0.39504436948540894
Energy: 0.4841531788376195
Energy: 0.4238182755461123
Energy: 0.4981743654999519
Energy: 0.4238182755474182
Energy: 0.49817436549799304
Energy: 0.42381827554643875
Energy: 0.49817436550060495
Energy: 0.44764481313239335
Energy: 0.4281791098041202
Energy: 0.44764481313108745
Energy: 0.42817910980150836
Energy: 0.44764481312719934
Energy: 0.42817910979857005
Energy: 0.4395264753610236
Energy: 0.4273260000443763
Energy: 0.43952647536135014
Energy: 0.42732600004404986
Energy: 0.4395264753593913
Energy: 0.4273260000443763
Energy: 0.42904279396495526
Energy: 0.412247363558104
Energy: 0.42904279396430234
Energy: 0.412247363558104
Energy: 0.4290427939646288
Energy: 0.4122473635577775
Energy: 0.40329526012199396
Energy: 0.6177095622351672
Energy: 0.40329526012232036
Energy: 0.6177095622364731
Energy: 0.40329526012232036
Energy: 0.6177095622354937
Energy: 0.596974791655888
Energy: 0.4203466299402975
Energy: 0.596974791655235
Energy: 0.4203466299409504
Energy: 0.596974791655235
Energy: 0.4203466299412769
Energy: 0.44994809661612134
Energy: 0.4428270669295654
Energy: 0.4499480966180802
Energy: 0.44282706692891244
Energy: 0.44994809661677426
Energy: 0.4428270669282594
Energy: 0.5971701550364503
Energy: 0.4223039358192196
Energy: 0.5971701550384092
Energy: 0.4223039358188931
Energy: 0.5971701550384092
Energy: 0.4223039358192196
Energy: 0.4032665226186272
Energy: 0.6176870172538822
Energy: 0.4032665226189536
Energy: 0.6176870172535557
Energy: 0.40326652261830065
Energy: 0.6176870172538822
Energy: 0.42902695030491494
Energy: 0.41223720452589785
Energy: 0.42902695030426197
Energy: 0.41223720452622425
Energy: 0.4290269503052414
Energy: 0.41223720452622425
Energy: 0.4395168129974133
Energy: 0.4270864274977009
Energy: 0.43951681299871925
Energy: 0.4270864274977009
Energy: 0.4395168129977398
Energy: 0.4270864274977009

minimum gb energy = 0.39504436948475596 eV
minimum distance =  2.6538456870565 Angstroms
sigma value = 57


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

Energy: 0.16625045465342428
Energy: 0.17162988785513694
Energy: 0.16625045465342428
Energy: 0.17162988785513694
Energy: 0.16625045465342428
Energy: 0.17162988785513694
Energy: 0.26225704153231505
Energy: 0.25712334421104427
Energy: 0.2622570415315719
Energy: 0.25712334421104427
Energy: 0.2622570415315719
Energy: 0.2571233442117874
Energy: 0.20762937232912423
Energy: 0.23905536378107695
Energy: 0.20762937232912423
Energy: 0.23905536378033374
Energy: 0.20762937232912423
Energy: 0.23905536378033374
Energy: 0.17308453303052335
Energy: 0.16658910030354573
Energy: 0.17308453303052335
Energy: 0.16658910030354573
Energy: 0.17308453303052335
Energy: 0.16658910030428892
Energy: 0.26263612249156804
Energy: 0.26247549184538316
Energy: 0.26263612249156804
Energy: 0.26247549184538316
Energy: 0.26263612249082485
Energy: 0.26247549184538316
Energy: 0.16657558890114962
Energy: 0.20759454831089103
Energy: 0.16657558890114962
Energy: 0.20759454831089103
Energy: 0.16657558890114962
Energy: 0.20759454831089103
Energy: 0.16660987473671862
Energy: 0.20755191893185748
Energy: 0.16660987473671862
Energy: 0.2075519189311143
Energy: 0.16660987473671862
Energy: 0.2075519189311143
Energy: 0.26278535063587327
Energy: 0.2624209240527173
Energy: 0.26278535063587327
Energy: 0.2624209240527173
Energy: 0.2627853506351301
Energy: 0.2624209240527173
Energy: 0.17308817834445944
Energy: 0.16657307336396035
Energy: 0.17308817834445944
Energy: 0.16657307336396035
Energy: 0.17308817834445944
Energy: 0.16657307336396035
Energy: 0.20762366082675365
Energy: 0.23886919631606757
Energy: 0.20762366082675365
Energy: 0.23886919631532438
Energy: 0.20762366082749686
Energy: 0.23886919631606757
Energy: 0.26281829319958494
Energy: 0.25716569143630863
Energy: 0.26281829319958494
Energy: 0.25716569143556534
Energy: 0.26281829319884176
Energy: 0.25716569143556534
Energy: 0.16625045465342428
Energy: 0.17162988785439376
Energy: 0.16625045465342428
Energy: 0.17162988785513694
Energy: 0.16625045465342428
Energy: 0.17162988785513694
Energy: 0.26225704153231505
Energy: 0.25712334421104427
Energy: 0.26225704153305834
Energy: 0.25712334421104427
Energy: 0.26225704153231505
Energy: 0.25712334421104427
Energy: 0.20762937232912423
Energy: 0.23905536378033374
Energy: 0.20762937232912423
Energy: 0.23905536378033374
Energy: 0.20762937232838105
Energy: 0.23905536378033374
Energy: 0.1730845330297802
Energy: 0.16658910030354573
Energy: 0.17308453303052335
Energy: 0.16658910030354573
Energy: 0.17308453303126656
Energy: 0.16658910030354573
Energy: 0.26263612249156804
Energy: 0.26247549184464
Energy: 0.26263612249082485
Energy: 0.26247549184464
Energy: 0.26263612249156804
Energy: 0.26247549184538316
Energy: 0.16657558890040644
Energy: 0.2075945483116342
Energy: 0.16657558890040644
Energy: 0.2075945483116342
Energy: 0.16657558890114962
Energy: 0.20759454831089103
Energy: 0.16660987473597547
Energy: 0.20755191893185748
Energy: 0.16660987473671862
Energy: 0.20755191893185748
Energy: 0.16660987473671862
Energy: 0.2075519189311143
Energy: 0.26278535063587327
Energy: 0.2624209240527173
Energy: 0.26278535063587327
Energy: 0.2624209240527173
Energy: 0.26278535063587327
Energy: 0.2624209240534605

minimum gb energy = 0.16625045465342428 eV
minimum distance =  2.77569186203858 Angstroms
sigma value = 11


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

Energy: 0.4048462826141357
Energy: 0.40490591896898315
Energy: 0.40484628261468014
Energy: 0.40490591896898315
Energy: 0.40484628261468014
Energy: 0.40490591896898315
Energy: 0.4467187118346616
Energy: 0.38204048261515383
Energy: 0.4467187118362948
Energy: 0.38204048261515383
Energy: 0.4467187118341172
Energy: 0.38204048261515383
Energy: 0.43556519693370194
Energy: 0.5808883302039837
Energy: 0.4355651969342464
Energy: 0.5808883302034392
Energy: 0.4355651969342464
Energy: 0.580888330204528
Energy: 0.45074914191154863
Energy: 0.3811230087145171
Energy: 0.45074914191318183
Energy: 0.3811230087145171
Energy: 0.45074914191154863
Energy: 0.3811230087145171
Energy: 0.3745965201535544
Energy: 0.3442384152722993
Energy: 0.3745965201546432
Energy: 0.3442384152722993
Energy: 0.37459652015409867
Energy: 0.3442384152722993
Energy: 0.408746676489628
Energy: 0.43039489142093584
Energy: 0.4087466764890836
Energy: 0.43039489142039145
Energy: 0.408746676489628
Energy: 0.43039489142039145
Energy: 0.35324646847689284
Energy: 0.48867806913457235
Energy: 0.3532464684774372
Energy: 0.48867806913511674
Energy: 0.35324646847689284
Energy: 0.48867806913511674
Energy: 0.42364702921417635
Energy: 0.3238867897937784
Energy: 0.42364702921363195
Energy: 0.3238867897937784
Energy: 0.42364702921199876
Energy: 0.323886789793234
Energy: 0.4126639337788329
Energy: 0.32638669664149106
Energy: 0.4126639337793773
Energy: 0.32638669664149106
Energy: 0.4126639337799217
Energy: 0.32638669664203546
Energy: 0.3321995299923754
Energy: 0.5031629233822738
Energy: 0.3321995299929198
Energy: 0.5031629233822738
Energy: 0.3321995299929198
Energy: 0.5031629233822738
Energy: 0.5031696229828977
Energy: 0.489209216035804
Energy: 0.5031696229812644
Energy: 0.489209216035804
Energy: 0.5031696229834421
Energy: 0.489209216035804
Energy: 0.38358268896929504
Energy: 0.3573756527641419
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Energy: 0.35737565276359745
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Energy: 0.4214575045738657
Energy: 0.39020697816397526
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Energy: 0.4487728401789781
Energy: 0.5638203835879269
Energy: 0.4487728401800669
Energy: 0.56382038358956
Energy: 0.4487728401778894
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Energy: 0.5321456168919776
Energy: 0.38349293670860385
Energy: 0.5321456168957883
Energy: 0.38349293670914825
Energy: 0.5321456168941551
Energy: 0.38349293670969264
Energy: 0.40547493540182283
Energy: 0.3978352846865579
Energy: 0.40547493540182283
Energy: 0.39783528468546914
Energy: 0.4054749354023672
Energy: 0.39783528468601354
Energy: 0.36684030243662474
Energy: 0.3820946263797227
Energy: 0.36684030243989113
Energy: 0.3820946263791783
Energy: 0.36684030243553595
Energy: 0.3820946263791783
Energy: 0.49728220234513004
Energy: 0.5808239418739187
Energy: 0.49728220234458564
Energy: 0.5808239418733743
Energy: 0.49728220234458564
Energy: 0.5808239418722855
Energy: 0.45286917210504807
Energy: 0.3807177499521185
Energy: 0.4528691721055924
Energy: 0.3807177499521185
Energy: 0.4528691721055924
Energy: 0.38071774995266294
Energy: 0.38375184034780685
Energy: 0.38233959478064145
Energy: 0.38375184034944004
Energy: 0.38233959478173024
Energy: 0.38375184034889565
Energy: 0.38233959478173024
Energy: 0.336118530666589
Energy: 0.431303208737066
Energy: 0.3361185306660445
Energy: 0.431303208737066
Energy: 0.3361185306660445
Energy: 0.431303208737066
Energy: 0.42655549155581335
Energy: 0.4615487041514594
Energy: 0.4265554913533956
Energy: 0.46154870415091503
Energy: 0.4265554911281131
Energy: 0.4615487041514594
Energy: 0.45410209381163985
Energy: 0.3985921045557543
Energy: 0.45410209381163985
Energy: 0.3985921045557543
Energy: 0.45410209381163985
Energy: 0.3985921045552098
Energy: 0.41502207648078693
Energy: 0.36607686340534057
Energy: 0.4150220764813314
Energy: 0.3660768634047962
Energy: 0.41502207648078693
Energy: 0.3660768634047962
Energy: 0.3360461914150229
Energy: 0.5013676574831195
Energy: 0.33604619141447845
Energy: 0.501367657483664
Energy: 0.3360461914139341
Energy: 0.501367657483664
Energy: 0.5985352804071419
Energy: 0.49135499767648244
Energy: 0.5985352804071419
Energy: 0.49135499767648244
Energy: 0.5985352804060531
Energy: 0.49135499767648244

minimum gb energy = 0.323886789793234 eV
minimum distance =  2.64809052253248 Angstroms
sigma value = 41


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

Energy: 0.4568245052176804
Energy: 0.3671508401345171
Energy: 0.4568245052172513
Energy: 0.3671508401345171
Energy: 0.4568245052172513
Energy: 0.367150840134088
Energy: 0.49891975064584354
Energy: 0.4403183917444937
Energy: 0.49891975064498534
Energy: 0.4403183917449228
Energy: 0.49891975064541444
Energy: 0.4403183917440647
Energy: 0.5221773027322253
Energy: 0.6416181344403988
Energy: 0.5221773027322253
Energy: 0.641618134441257
Energy: 0.5221773027313671
Energy: 0.6416181344408279
Energy: 0.426146675943418
Energy: 0.35954546680390825
Energy: 0.4261466759429889
Energy: 0.35954546680390825
Energy: 0.426146675943418
Energy: 0.35954546680390825
Energy: 0.3429050008812484
Energy: 0.399777585049376
Energy: 0.3429050008808194
Energy: 0.399777585049376
Energy: 0.3429050008816776
Energy: 0.399777585049376
Energy: 0.46253088948398036
Energy: 0.5277243256652265
Energy: 0.46253088948398036
Energy: 0.5277243256652265
Energy: 0.46253088948355126
Energy: 0.5277243256652265
Energy: 0.38637328535577414
Energy: 0.5343461097172043
Energy: 0.3863732853553451
Energy: 0.5343461097172043
Energy: 0.38637328535491594
Energy: 0.5343461097172043
Energy: 0.368595521102623
Energy: 0.35965041751722704
Energy: 0.3685955211030521
Energy: 0.35965041751679794
Energy: 0.36859552110219396
Energy: 0.35965041751679794
Energy: 0.34631692439483674
Energy: 0.3957516961459011
Energy: 0.34631692439483674
Energy: 0.3957516961459011
Energy: 0.3463169243952658
Energy: 0.3957516961459011
Energy: 0.4332697914659527
Energy: 0.5502485776541215
Energy: 0.4332697914663817
Energy: 0.5502485776541215
Energy: 0.4332697914663817
Energy: 0.5502485776536925
Energy: 0.4381709506253391
Energy: 0.5620870743204023
Energy: 0.43817095062491
Energy: 0.5620870743208313
Energy: 0.4381709506253391
Energy: 0.5620870743208313
Energy: 0.3446366873271018
Energy: 0.44023916186858114
Energy: 0.3446366873266727
Energy: 0.45405683112260353
Energy: 0.3446366873271018
Energy: 0.43039294515737
Energy: 0.3737118176215144
Energy: 0.36041582092343416
Energy: 0.3737118176215144
Energy: 0.36041582092343416
Energy: 0.3737118176215144
Energy: 0.36041582092343416
Energy: 0.3405829670200952
Energy: 0.5096541669733022
Energy: 0.340582967019237
Energy: 0.5096541669745893
Energy: 0.3405829670196661
Energy: 0.5096541669775929
Energy: 0.4637197906741688
Energy: 0.5294488271244572
Energy: 0.46371979067331065
Energy: 0.5294488271244572
Energy: 0.46371979067459784
Energy: 0.5294488271240281
Energy: 0.3441253726771015
Energy: 0.447391437012462
Energy: 0.3441253726775307
Energy: 0.4610678565494014
Energy: 0.3441253726771015
Energy: 0.4351282202706173
Energy: 0.38578942628569196
Energy: 0.3603866974745953
Energy: 0.38578942628569196
Energy: 0.3603866974741662
Energy: 0.38578942628569196
Energy: 0.3603866974741662
Energy: 0.45824118460555696
Energy: 0.6430079606182143
Energy: 0.45824118460598606
Energy: 0.6430079606182143
Energy: 0.45824118460555696
Energy: 0.6430079606177852
Energy: 0.5008777162954096
Energy: 0.4421041693124848
Energy: 0.5008777162954096
Energy: 0.4421041693124848
Energy: 0.5008777162949805
Energy: 0.4421041693124848
Energy: 0.4575612962912645
Energy: 0.47758040066620727
Energy: 0.4575612962912645
Energy: 0.4758821488124287
Energy: 0.4575612962916936
Energy: 0.41559804075888845
Energy: 0.380402855483088
Energy: 0.4701212561156273
Energy: 0.38040285548394615
Energy: 0.4701212561156273
Energy: 0.38040285548351704
Energy: 0.4701212561156273
Energy: 0.5168632848029627
Energy: 0.6440510087742684
Energy: 0.5168632848029627
Energy: 0.6440510087742684
Energy: 0.5168632848029627
Energy: 0.6440510087742684
Energy: 0.42780033008638385
Energy: 0.3550757186779268
Energy: 0.42780033008638385
Energy: 0.3550757186779268
Energy: 0.42780033008638385
Energy: 0.3550757186779268
Energy: 0.34421823037085414
Energy: 0.4593492503277843
Energy: 0.3442182303712833
Energy: 0.4872728727357606
Energy: 0.3442182303712833
Energy: 0.4409888883409196
Energy: 0.34207908342212784
Energy: 0.4737464015324483
Energy: 0.3420790834216987
Energy: 0.47374640153201925
Energy: 0.3420790834216987
Energy: 0.47374640153287734
Energy: 0.3866711291280954
Energy: 0.5271367532225164
Energy: 0.38667112912852447
Energy: 0.5271367532242327
Energy: 0.3866711291280954
Energy: 0.5271367532250909
Energy: 0.3689806174291872
Energy: 0.3554274426580073
Energy: 0.3689806174291872
Energy: 0.3554274426580073
Energy: 0.36898061742961624
Energy: 0.3554274426580073
Energy: 0.38068552984782256
Energy: 0.460593401840893
Energy: 0.38068552984825166
Energy: 0.4752282177725151
Energy: 0.38068552984782256
Energy: 0.4473308627200411
Energy: 0.43557507240028404
Energy: 0.4733624647154285
Energy: 0.4355750724011422
Energy: 0.4733624647162866
Energy: 0.4355750724011422
Energy: 0.4733624647154285
Energy: 0.553413224351942
Energy: 0.4839043702068924
Energy: 0.553413224351513
Energy: 0.4839043702068924
Energy: 0.5534132243523711
Energy: 0.48390437020903787
Energy: 0.3451807812483768
Energy: 0.40922402074912384
Energy: 0.34518078124880586
Energy: 0.40922402074955294
Energy: 0.3451807812483768
Energy: 0.40922402074955294
Energy: 0.38943040924992745
Energy: 0.3589093301065807
Energy: 0.38943040924949834
Energy: 0.35890933010615167
Energy: 0.38943040924949834
Energy: 0.3589093301065807
Energy: 0.3424370219945073
Energy: 0.4128878205808963
Energy: 0.34243702199493636
Energy: 0.41288782058132534
Energy: 0.34243702199493636
Energy: 0.41288782058132534

minimum gb energy = 0.340582967019237 eV
minimum distance =  2.65924080284405 Angstroms
sigma value = 33


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

Energy: 0.3834373630817629
Energy: 0.36352539593601635
Energy: 0.3834373630808595
Energy: 0.36352539593601635
Energy: 0.38343736308146176
Energy: 0.36352539593601635
Energy: 0.4246736463478965
Energy: 0.3625343056554873
Energy: 0.4246736463475954
Energy: 0.3625343056554873
Energy: 0.4246736463475954
Energy: 0.3625343056554873
Energy: 0.5722087330986766
Energy: 0.6168134157561561
Energy: 0.5722087330980743
Energy: 0.6168134157564572
Energy: 0.5722087330968698
Energy: 0.6168134157573606
Energy: 0.41723219763994013
Energy: 0.3536495544938609
Energy: 0.4172321976405424
Energy: 0.3536495544944632
Energy: 0.41723219764024133
Energy: 0.35364955449476426
Energy: 0.3591170431757855
Energy: 0.5701153498101192
Energy: 0.3591170431757855
Energy: 0.5701153498104204
Energy: 0.3591170431751833
Energy: 0.5701153498104204
Energy: 0.5300820800147372
Energy: 0.36889987431456284
Energy: 0.530082080014436
Energy: 0.3688998743142617
Energy: 0.5300820800147372
Energy: 0.3688998743142617
Energy: 0.41124612402907934
Energy: 0.4578811798406085
Energy: 0.4112461240296816
Energy: 0.4578811798400062
Energy: 0.4112461240293805
Energy: 0.45788117984030735
Energy: 0.4217597688532398
Energy: 0.4792017875066059
Energy: 0.42175976885293864
Energy: 0.479201787506907
Energy: 0.42175976885384203
Energy: 0.479201787506907
Energy: 0.5695612019123284
Energy: 0.4133227836533274
Energy: 0.569561201913533
Energy: 0.41332278365362857
Energy: 0.5695612019126296
Energy: 0.41332278365362857
Energy: 0.5463855708724038
Energy: 0.3769445107688982
Energy: 0.5463855708733072
Energy: 0.3769445107691993
Energy: 0.5463855708739094
Energy: 0.3769445107688982
Energy: 0.42258419679964165
Energy: 0.4229584970095796
Energy: 0.42258419679934045
Energy: 0.4229584970119887
Energy: 0.4225841968017496
Energy: 0.42295849701168753
Energy: 0.35543841062119946
Energy: 0.35344192594584545
Energy: 0.35543841065218873
Energy: 0.35344192594644763
Energy: 0.35543841065851245
Energy: 0.35344192594614654
Energy: 0.4158795572033579
Energy: 0.5699252885271656
Energy: 0.4158795572027556
Energy: 0.5699252885274668
Energy: 0.41587955720215336
Energy: 0.5699252885271656
Energy: 0.4756954360584326
Energy: 0.42184310842319783
Energy: 0.47569543605783027
Energy: 0.42184310842470346
Energy: 0.47569543605783027
Energy: 0.4218431084238
Energy: 0.47479136518098486
Energy: 0.41077899796177075
Energy: 0.4747913651797803
Energy: 0.410778997964481
Energy: 0.4747913651800814
Energy: 0.4107789979653844
Energy: 0.37727645368043305
Energy: 0.5261827374937396
Energy: 0.37727645367983076
Energy: 0.526182737494643
Energy: 0.37727645367952967
Energy: 0.5261827374883192
Energy: 0.5723173941959083
Energy: 0.35986929862031997
Energy: 0.5723173941950049
Energy: 0.3598692986200188
Energy: 0.572317394195306
Energy: 0.3598692986194166
Energy: 0.3540883361131217
Energy: 0.4174444457175349
Energy: 0.3540883361131217
Energy: 0.4174444457169327
Energy: 0.35408833611282053
Energy: 0.41744444571482475
Energy: 0.6180242941609999
Energy: 0.5709349728136422
Energy: 0.6180242941600965
Energy: 0.5709349728136422
Energy: 0.6180242941609999
Energy: 0.5709349728136422
Energy: 0.4815358824851951
Energy: 0.41266809534518956
Energy: 0.4815358824863996
Energy: 0.41266809534518956
Energy: 0.481535882484894
Energy: 0.41266809534518956
Energy: 0.36571345219444795
Energy: 0.38418891070102706
Energy: 0.36571345219444795
Energy: 0.38418891070102706
Energy: 0.36571345219474904
Energy: 0.3841889107007259
Energy: 0.3609993105573467
Energy: 0.44068039132900094
Energy: 0.3609993105567445
Energy: 0.4406803913286998
Energy: 0.3609993105567445
Energy: 0.4406803913286998
Energy: 0.5984062778462548
Energy: 0.4897773307873652
Energy: 0.5984062778462548
Energy: 0.4897773307876662
Energy: 0.5984062778456525
Energy: 0.48977733078706404
Energy: 0.36280130857988546
Energy: 0.5224590506057667
Energy: 0.36280130857958437
Energy: 0.5224590506057667
Energy: 0.36280130857988546
Energy: 0.5224590506051643
Energy: 0.5684345521132718
Energy: 0.35991608772485184
Energy: 0.5684345521129706
Energy: 0.35991608772455075
Energy: 0.5684345521123684
Energy: 0.35991608772485184
Energy: 0.3694917677389779
Energy: 0.5996540041526122
Energy: 0.3694917677395802
Energy: 0.5996540041523111
Energy: 0.3694917677395802
Energy: 0.5996540041520099
Energy: 0.4457155303217226
Energy: 0.41005382249199884
Energy: 0.44571553032051814
Energy: 0.4100538224916977
Energy: 0.4457155303187113
Energy: 0.4100538224916977
Energy: 0.3857663040988558
Energy: 0.3548620062869985
Energy: 0.3857663040991569
Energy: 0.35486200628639614
Energy: 0.3857663040991569
Energy: 0.3548620062869985
Energy: 0.41194570138280445
Energy: 0.5704632342775154
Energy: 0.4119457013822022
Energy: 0.5704632342772145
Energy: 0.4119457013831056
Energy: 0.5704632342775154
Energy: 0.3780701984108267
Energy: 0.5449170875839146
Energy: 0.37807019841022443
Energy: 0.5449170875836133
Energy: 0.37807019841052564
Energy: 0.5449170875839146
Energy: 0.42023854104306485
Energy: 0.35691127744571643
Energy: 0.4202385410454739
Energy: 0.35691127744722206
Energy: 0.4202385410454739
Energy: 0.35691127744571643
Energy: 0.3629586378338983
Energy: 0.5688912076027255
Energy: 0.3629586378338983
Energy: 0.5688912076030266
Energy: 0.36295863783299487
Energy: 0.5688912076027255
Energy: 0.4822635675163854
Energy: 0.3739501221648099
Energy: 0.4822635675160843
Energy: 0.37395012216420764
Energy: 0.4822635675163854
Energy: 0.3739501221657133
Energy: 0.42203237571608654
Energy: 0.47504213082430424
Energy: 0.4220323757236149
Energy: 0.4750421308212929
Energy: 0.42203237571970015
Energy: 0.4750421308212929
Energy: 0.4218107000832044
Energy: 0.474472171854362
Energy: 0.4218107000792897
Energy: 0.474472171854362
Energy: 0.42181070008290333
Energy: 0.47447217185345864
Energy: 0.4824351717850381
Energy: 0.3737071751258147
Energy: 0.48243517178564027
Energy: 0.3737071751258147
Energy: 0.48243517178564027
Energy: 0.3737071751255136
Energy: 0.36300510968279337
Energy: 0.5690032968836004
Energy: 0.36300510968339567
Energy: 0.5690032968836004
Energy: 0.36300510968279337
Energy: 0.5690032968829981
Energy: 0.42044111693914865
Energy: 0.35702383026279666
Energy: 0.4204411169388475
Energy: 0.3570238302633989
Energy: 0.4204411169397509
Energy: 0.3570238302630978
Energy: 0.377606387652552
Energy: 0.5448565017459784
Energy: 0.37760638765405763
Energy: 0.5448565017468818
Energy: 0.3776063876528531
Energy: 0.5448565017465807
Energy: 0.4119568887204732
Energy: 0.5700494154246479
Energy: 0.4119568887204732
Energy: 0.5700494154252502
Energy: 0.4119568887207743
Energy: 0.5700494154246479
Energy: 0.38589736018439347
Energy: 0.3549211530841259
Energy: 0.3858973601849958
Energy: 0.3549211530835237
Energy: 0.3858973601849958
Energy: 0.3549211530841259
Energy: 0.4459431157280795
Energy: 0.40994609505625595
Energy: 0.4459431157289828
Energy: 0.40994609505625595
Energy: 0.4459431157283806
Energy: 0.40994609505595486
Energy: 0.36951344522454893
Energy: 0.5994953235311767
Energy: 0.3695134452254523
Energy: 0.5994953235308754
Energy: 0.3695134452257534
Energy: 0.5994953235320801
Energy: 0.5684450908691455
Energy: 0.36003356074573034
Energy: 0.5684450908697479
Energy: 0.36003356074573034
Energy: 0.5684450908706513
Energy: 0.36003356074603143
Energy: 0.36256633929560717
Energy: 0.5223521596776574
Energy: 0.3625663392968117
Energy: 0.5223521596779586
Energy: 0.3625663392962094
Energy: 0.5223521596776574
Energy: 0.5984639866882656
Energy: 0.4898800886441076
Energy: 0.5984639866888679
Energy: 0.48988008864350524
Energy: 0.5984639866879645
Energy: 0.48988008864350524
Energy: 0.36090522094456307
Energy: 0.4407706817231314
Energy: 0.3609052209436597
Energy: 0.4407706817204212
Energy: 0.36090522094456307
Energy: 0.4407706817204212

minimum gb energy = 0.35344192594584545 eV
minimum distance =  2.68087840017982 Angstroms
sigma value = 67


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

Energy: 0.35626577973648804
Energy: 0.37453170631450666
Energy: 0.3562657797362822
Energy: 0.37453170631450666
Energy: 0.35626577973648804
Energy: 0.3745317063147125
Energy: 0.3385744655095782
Energy: 0.3625410561999897
Energy: 0.33857446550916653
Energy: 0.36254105619978394
Energy: 0.33857446550937237
Energy: 0.36254105619978394
Energy: 0.5172207884721636
Energy: 0.5321118857527288
Energy: 0.5172207884723694
Energy: 0.5321118857527288
Energy: 0.5172207884725752
Energy: 0.5321118857527288
Energy: 0.33857659599843415
Energy: 0.3625440358211544
Energy: 0.3385765959982283
Energy: 0.3625440358211544
Energy: 0.33857659599864
Energy: 0.36254403582136024
Energy: 0.35626577973548174
Energy: 0.37453170631571875
Energy: 0.35626577973548174
Energy: 0.37453170631631344
Energy: 0.35626577973548174
Energy: 0.3745317063161075
Energy: 0.33857446550978404
Energy: 0.36254105619857185
Energy: 0.3385744655095782
Energy: 0.36254105619877763
Energy: 0.33857446550978404
Energy: 0.36254105619877763
Energy: 0.517220788472964
Energy: 0.5321118857521112
Energy: 0.5172207884725752
Energy: 0.5321118857519055
Energy: 0.5172207884725752
Energy: 0.5321118857517226

minimum gb energy = 0.33857446550916653 eV
minimum distance =  2.6789505584774 Angstroms
sigma value = 3


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

Energy: 0.5861893999336031
Energy: 0.43227568731337374
Energy: 0.5861893999341509
Energy: 0.43227568731362276
Energy: 0.5861893999346985
Energy: 0.432275687313075
Energy: 0.4615844481387772
Energy: 0.43035472823827203
Energy: 0.46158444813713406
Energy: 0.4303547282379732
Energy: 0.4615844481379307
Energy: 0.43035472823852106
Energy: 0.4746082238694326
Energy: 0.5917322030687227
Energy: 0.4746082238702293
Energy: 0.5917322030689717
Energy: 0.47460822386998036
Energy: 0.5917322030689717
Energy: 0.5081079062084836
Energy: 0.4208459161949486
Energy: 0.5081079062073882
Energy: 0.43421654769442697
Energy: 0.5081079062079359
Energy: 0.42084591619659184
Energy: 0.45533373279496775
Energy: 0.4908250400278969
Energy: 0.4553337327930257
Energy: 0.4908250400240627
Energy: 0.45533373279551553
Energy: 0.49082504002376387
Energy: 0.4742096059610612
Energy: 0.475787793847656
Energy: 0.47420960595916906
Energy: 0.47578779385173925
Energy: 0.47420960596026457
Energy: 0.47578779385064374
Energy: 0.5543941675124028
Energy: 0.6212449760285144
Energy: 0.5543941675127015
Energy: 0.621244976029062
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Energy: 0.4755823842791931
Energy: 0.43561375312090717
Energy: 0.4755823842786454
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Energy: 0.4755823842772512
Energy: 0.4481462547664652
Energy: 0.4351665903857504
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Energy: 0.48382169575101897
Energy: 0.4351665903862981
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Energy: 0.47776778826209904
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Energy: 0.6011755966931921
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Energy: 0.48984012028970225
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Energy: 0.4785595576006824
Energy: 0.469725619726192
Energy: 0.47855955760177793
Energy: 0.4821808231193393
Energy: 0.47855955760177793
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Energy: 0.4471624113825528
Energy: 0.4691138309792735
Energy: 0.44716241138115853
Energy: 0.4691138309795723
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Energy: 0.4691138309795723
Energy: 0.5123801801361597
Energy: 0.47305853457664226
Energy: 0.5123801801370061
Energy: 0.4730585345829165
Energy: 0.5123801801367073
Energy: 0.47305853458431074
Energy: 0.6633847323611298
Energy: 0.5703423791300429
Energy: 0.6633847323636196
Energy: 0.5703423791300429
Energy: 0.663384732362524
Energy: 0.5703423791300429
Energy: 0.549813143468848
Energy: 0.4303682233502587
Energy: 0.5498131434685991
Energy: 0.4303682233500098
Energy: 0.5498131434696448
Energy: 0.43255170422526357
Energy: 0.5080425999502547
Energy: 0.45321668297264506
Energy: 0.5080425999480637
Energy: 0.45321668297319284
Energy: 0.5080425999508025
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Energy: 0.429887622860364
Energy: 0.5610451259712311
Energy: 0.42988762285901966
Energy: 0.5610451259720776
Energy: 0.4298876228601151
Energy: 0.5610451259717788
Energy: 0.6150219724500843
Energy: 0.5384340769690766
Energy: 0.6150219724520263
Energy: 0.5384340769687779
Energy: 0.6150219724514786
Energy: 0.5384340769690766
Energy: 0.4786554932910671
Energy: 0.4643383347582579
Energy: 0.4786554932924614
Energy: 0.5031860004825001
Energy: 0.4786554932924614
Energy: 0.4643383347582579
Energy: 0.47263220909790954
Energy: 0.5797758182650709
Energy: 0.47263220909845727
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Energy: 0.472632209096814
Energy: 0.5797758182648217
Energy: 0.41575303019840304
Energy: 0.5111633495190563
Energy: 0.41575303020114174
Energy: 0.5111633495190563
Energy: 0.4157530301978553
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Energy: 0.4731637640976236
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Energy: 0.4731637640984203
Energy: 0.4794924332206696
Energy: 0.4731637640967771
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Energy: 0.4575437646156307
Energy: 0.465422842206643
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Energy: 0.465422842206643
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Energy: 0.46542284220609526
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Energy: 0.579899577592447
Energy: 0.4704980467504399
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Energy: 0.47049804674740237
Energy: 0.579899577592198
Energy: 0.4734953009992454
Energy: 0.48028843611979916
Energy: 0.47349530099650666
Energy: 0.48028843611895256
Energy: 0.47349530099486337
Energy: 0.4802884361184048
Energy: 0.5077293266201477
Energy: 0.49829721812890054
Energy: 0.5077293266215419
Energy: 0.49829721812914946
Energy: 0.5077293266226374
Energy: 0.4982972181286018
Energy: 0.4716825797710982
Energy: 0.4432462855427057
Energy: 0.4716825797700027
Energy: 0.4572266330134455
Energy: 0.47168257976970396
Energy: 0.45722663300796806
Energy: 0.5055352561565639
Energy: 0.4531746553260735
Energy: 0.5055352561571117
Energy: 0.45317465532577467
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Energy: 0.45317465532522694
Energy: 0.5029384436415558
Energy: 0.473795486978993
Energy: 0.5029384436489753
Energy: 0.47379548697924206
Energy: 0.5029384436462366
Energy: 0.47379548697924206
Energy: 0.6636815940495532
Energy: 0.4213610716599966
Energy: 0.6636815940498022
Energy: 0.4213610716602954
Energy: 0.6636815940492544
Energy: 0.4213610716646774
Energy: 0.5044545817685696
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Energy: 0.4561852994309779
Energy: 0.5044545817691174
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Energy: 0.4515734873959356
Energy: 0.46544265576439
Energy: 0.4515734873951389
Energy: 0.46544265576414096
Energy: 0.45157348739429237
Energy: 0.46544265576414096
Energy: 0.49032415214508995
Energy: 0.499733407381431
Energy: 0.4903241521388158
Energy: 0.49973340738113226
Energy: 0.49032415215823605
Energy: 0.499733407381431
Energy: 0.48701279254484253
Energy: 0.4906952944704595
Energy: 0.48701279254539026
Energy: 0.490695294469364
Energy: 0.4870127925442947
Energy: 0.49069529446881616
Energy: 0.4697443485745273
Energy: 0.5403179221221259
Energy: 0.46974434857422853
Energy: 0.5403179221256615
Energy: 0.4697443485750751
Energy: 0.5403179221226738
Energy: 0.4378661483575433
Energy: 0.4787093959740509
Energy: 0.43786614835834
Energy: 0.4787093959735032
Energy: 0.43786614835809107
Energy: 0.4787093959748974
Energy: 0.5571964352007913
Energy: 0.4790821460000279
Energy: 0.5571964352002434
Energy: 0.4790821459997291
Energy: 0.5571964352018869
Energy: 0.4790821460000279
Energy: 0.42676646868741513
Energy: 0.5603269753121831
Energy: 0.42676646868905843
Energy: 0.5603269753118842
Energy: 0.426766468687963
Energy: 0.5603269753107888
Energy: 0.4658466222270195
Energy: 0.5408000242331734
Energy: 0.4658466222248284
Energy: 0.54080002423402
Energy: 0.4658466222188032
Energy: 0.5408000242329245
Energy: 0.45937670085780274
Energy: 0.491919059998852
Energy: 0.45937670085835053
Energy: 0.4919190597366292
Energy: 0.45937670085750393
Energy: 0.49191905857943263
Energy: 0.6310215129994217
Energy: 0.4163727276828002
Energy: 0.6310215129986249
Energy: 0.4163727276822525
Energy: 0.6310215129980771
Energy: 0.41637272768250144
Energy: 0.4930045404731141
Energy: 0.5557903915515526
Energy: 0.49300454047475734
Energy: 0.5557903915526481
Energy: 0.49300454047475734
Energy: 0.5557903915526481
Energy: 0.5095667859705832
Energy: 0.45671555205165726
Energy: 0.5095667859700356
Energy: 0.4567155520511096
Energy: 0.509566785971131
Energy: 0.45671555205086056
Energy: 0.5522641767809803
Energy: 0.43479927607445057
Energy: 0.5522641767796358
Energy: 0.43479927607445057
Energy: 0.5522641767804326
Energy: 0.43479927607420155
Energy: 0.5597975324594993
Energy: 0.4439372602854534
Energy: 0.5597975324589515
Energy: 0.4439372602852044
Energy: 0.5597975324597979
Energy: 0.4612309675311723
Energy: 0.46118650263943434
Energy: 0.4732761080216912
Energy: 0.46118650263888655
Energy: 0.4732761080227867
Energy: 0.46118650263998207
Energy: 0.4732761080233344
Energy: 0.4468701641726691
Energy: 0.4728813715892828
Energy: 0.44687016417187236
Energy: 0.4728813715892828
Energy: 0.44687016417296793
Energy: 0.47288137158898397
Energy: 0.45926432213801643
Energy: 0.49361821670585915
Energy: 0.45926432213801643
Energy: 0.4936182167055604
Energy: 0.4592643221372197
Energy: 0.49361821670610817
Energy: 0.49082794656294926
Energy: 0.4914523909586884
Energy: 0.49082794655612727
Energy: 0.49145239095321097
Energy: 0.4908279465585672
Energy: 0.491452390962224
Energy: 0.47699738021848326
Energy: 0.4933253440920132
Energy: 0.4769973802179355
Energy: 0.49332534409395523
Energy: 0.47699738021629223
Energy: 0.49332534409146545

minimum gb energy = 0.4157530301978553 eV
minimum distance =  2.60471225074508 Angstroms
sigma value = 81


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

Energy: 0.5859584297731277
Energy: 0.45437146347346336
Energy: 0.5632545736237615
Energy: 0.4543714634749669
Energy: 0.585958429772752
Energy: 0.4543714634749669
Energy: 0.46119094293665924
Energy: 0.4593394098779152
Energy: 0.4611909429351557
Energy: 0.45933940987528404
Energy: 0.4611909429332763
Energy: 0.45933940987528404
Energy: 0.5275937009013509
Energy: 0.5506624223921439
Energy: 0.5119397841295391
Energy: 0.5506624223887608
Energy: 0.5275937009036064
Energy: 0.550662422388385
Energy: 0.42085244585248094
Energy: 0.4663111204741982
Energy: 0.4208524458532327
Energy: 0.4663111204719428
Energy: 0.42085244585285686
Energy: 0.4663111204708151
Energy: 0.4592759509111617
Energy: 0.4248014647527468
Energy: 0.4592759509096582
Energy: 0.424801464758761
Energy: 0.4592759509126653
Energy: 0.42480146475800923
Energy: 0.42726774779977583
Energy: 0.4328928994680908
Energy: 0.42726774780090343
Energy: 0.43289289946545945
Energy: 0.42726774780015175
Energy: 0.43289289946545945
Energy: 0.4639634171354744
Energy: 0.585719512091521
Energy: 0.4639634171324672
Energy: 0.5857195120862926
Energy: 0.46396341713321904
Energy: 0.5857195120866685
Energy: 0.46197071974323856
Energy: 0.4607860968799835
Energy: 0.4618000657309438
Energy: 0.4607860968766005
Energy: 0.46197071974248677
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Energy: 0.46656452233311896
Energy: 0.46194199180711315
Energy: 0.46656452232033874
Energy: 0.4619419918100861
Energy: 0.4665645222996989
Energy: 0.4619419918100861
Energy: 0.49096878795843046
Energy: 0.5731560505201844
Energy: 0.4909687879576787
Energy: 0.5731560505171772
Energy: 0.4909687879550475
Energy: 0.5731560505171772
Energy: 0.5641420762987953
Energy: 0.6281577325746907
Energy: 0.564142076299547
Energy: 0.6281577325746907
Energy: 0.5641420762991711
Energy: 0.6281577325746907
Energy: 0.39974004809751507
Energy: 0.4396408977598878
Energy: 0.39974004809450786
Energy: 0.43964089775800835
Energy: 0.3997400480926285
Energy: 0.43964089775763243
Energy: 0.4606062844716868
Energy: 0.4640455296826714
Energy: 0.4606062844716868
Energy: 0.46404552968342305
Energy: 0.4606062844720627
Energy: 0.46404552968342305
Energy: 0.46377858895819773
Energy: 0.48057615839833584
Energy: 0.46377858895782187
Energy: 0.4805761584020947
Energy: 0.46377858895782187
Energy: 0.48057615839908757
Energy: 0.5794140539809124
Energy: 0.4275596602363216
Energy: 0.5794140539809124
Energy: 0.4275596602412081
Energy: 0.5794140539775294
Energy: 0.4275596602412081
Energy: 0.4618438575387936
Energy: 0.42823057022230737
Energy: 0.4618438575369141
Energy: 0.4282305702193003
Energy: 0.4618438575395454
Energy: 0.4282305702196762
Energy: 0.5176572671188319
Energy: 0.4319025386797204
Energy: 0.5174365820902366
Energy: 0.43190253868272743
Energy: 0.5176572671158247
Energy: 0.4319025386819757
Energy: 0.47387013206300843
Energy: 0.5033355615187838
Energy: 0.4738698613812677
Energy: 0.5033355615112659
Energy: 0.47387013206413614
Energy: 0.5033355615150248
Energy: 0.4864082821578102
Energy: 0.45758959447377573
Energy: 0.4864082821551789
Energy: 0.4575895943490145
Energy: 0.4864082821578102
Energy: 0.4575895944947914
Energy: 0.46592922104403267
Energy: 0.494289785820097
Energy: 0.46592922104140144
Energy: 0.4942897858185935
Energy: 0.4659292210470397
Energy: 0.4942897858185935
Energy: 0.4355182530977231
Energy: 0.46407053872611315
Energy: 0.4355182530988508
Energy: 0.4640705387242337
Energy: 0.435518253098099
Energy: 0.4640705387246096
Energy: 0.492398270212752
Energy: 0.4606853154995164
Energy: 0.4430088698068001
Energy: 0.4606853154998923
Energy: 0.49239827021162436
Energy: 0.46068531550026826
Energy: 0.48171649295118246
Energy: 0.47504015474597483
Energy: 0.4508078294142506
Energy: 0.47504015475010963
Energy: 0.48171649295193425
Energy: 0.47504015474823014
Energy: 0.4608772542690278
Energy: 0.4594908195782713
Energy: 0.46087725426677245
Energy: 0.4594908195767678
Energy: 0.46087725426677245
Energy: 0.4594908195767678
Energy: 0.4618333674003483
Energy: 0.507701350684133
Energy: 0.4618333674033554
Energy: 0.5077013506867641
Energy: 0.46183336740410724
Energy: 0.5077013506878576
Energy: 0.5780962280729125
Energy: 0.5601797229938845
Energy: 0.5780962280714088
Energy: 0.5601797229983951
Energy: 0.578096228071033
Energy: 0.5601797229983951
Energy: 0.4861115593064435
Energy: 0.4215443148683168
Energy: 0.4861115593056917
Energy: 0.4215443148581678
Energy: 0.4861115593068194
Energy: 0.4215443148592954
Energy: 0.4376350620826445
Energy: 0.4322581533548681
Energy: 0.43763506208527575
Energy: 0.43225815335524403
Energy: 0.4376350620864034
Energy: 0.43225815335524403
Energy: 0.46639791810635334
Energy: 0.46167977007037303
Energy: 0.46639511977161097
Energy: 0.46167977006999716
Energy: 0.46639791811086395
Energy: 0.4616797700696213
Energy: 0.5497682827096995
Energy: 0.4623616124314008
Energy: 0.5497682827096995
Energy: 0.4623616124344079
Energy: 0.5497682827089477
Energy: 0.4623616124347838
Energy: 0.46719448159452137
Energy: 0.4963120584433375
Energy: 0.46719448159151417
Energy: 0.49631205844220977
Energy: 0.4671944815926419
Energy: 0.496312058441458
Energy: 0.4253448199128435
Energy: 0.4595504907181985
Energy: 0.42534481991397116
Energy: 0.45955049071406373
Energy: 0.4253448199162265
Energy: 0.45955049071406373
Energy: 0.39972519089064346
Energy: 0.5157051426066086
Energy: 0.39972519089177105
Energy: 0.5157051426081123
Energy: 0.3997251908891399
Energy: 0.5157051426077364
Energy: 0.5535171642695957
Energy: 0.46397854541337186
Energy: 0.5535171642722271
Energy: 0.4639785454186343
Energy: 0.5535171642744824
Energy: 0.4639785454178825
Energy: 0.49381787622372403
Energy: 0.6213811165790812
Energy: 0.49382242680403016
Energy: 0.621381116580209
Energy: 0.4938178762210928
Energy: 0.621381116580209
Energy: 0.5294294617699005
Energy: 0.5366464979381704
Energy: 0.5294294617710281
Energy: 0.5366464979370427
Energy: 0.5294294617721557
Energy: 0.5366464979362909
Energy: 0.46639116571625455
Energy: 0.4354468857038599
Energy: 0.4663911657170063
Energy: 0.4354468857057393
Energy: 0.46639116571663036
Energy: 0.43544688570536344
Energy: 0.4723276490539015
Energy: 0.5606129583277495
Energy: 0.4723276490561568
Energy: 0.5606129583239906
Energy: 0.47232764905578095
Energy: 0.5606129583239906

minimum gb energy = 0.3997251908891399 eV
minimum distance =  2.53638485305281 Angstroms
sigma value = 43


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

Energy: 0.5391626309979993
Energy: 0.43137217760899815
Energy: 0.5391626309979993
Energy: 0.43137217760899815
Energy: 0.5391626309979993
Energy: 0.43137217760899815
Energy: 0.5032559611829354
Energy: 0.403778652378682
Energy: 0.5032559611824735
Energy: 0.403778652378682
Energy: 0.5032559611824735
Energy: 0.4037786523782202
Energy: 0.45916693713316065
Energy: 0.5024474721967888
Energy: 0.45916693713316065
Energy: 0.5024474721963269
Energy: 0.45916693713316065
Energy: 0.5024474721958653
Energy: 0.49639599505592924
Energy: 0.41964775202808985
Energy: 0.4963959950568527
Energy: 0.41964775202855154
Energy: 0.49639599505592924
Energy: 0.419647752029454
Energy: 0.45384158293407534
Energy: 0.43374733991514547
Energy: 0.45384158293361365
Energy: 0.4337473399146837
Energy: 0.45384158293361365
Energy: 0.4337473399146837
Energy: 0.46518703727028843
Energy: 0.4383702868965247
Energy: 0.4651870372707502
Energy: 0.43837028689606294
Energy: 0.46518703727028843
Energy: 0.4383702868983715
Energy: 0.44513661938382443
Energy: 0.5819375857360266
Energy: 0.44513661938336274
Energy: 0.5819375857360266
Energy: 0.44513661938382443
Energy: 0.5819375857360266
Energy: 0.49436150781887117
Energy: 0.45903420995304073
Energy: 0.4943615078184095
Energy: 0.45903420995304073
Energy: 0.4943615078184095
Energy: 0.45903420995304073
Energy: 0.47907098873171344
Energy: 0.449279043527973
Energy: 0.47907098873171344
Energy: 0.449279043527973
Energy: 0.47907098873171344
Energy: 0.449279043527973
Energy: 0.46900464304915845
Energy: 0.5137046901256771
Energy: 0.46900464304869666
Energy: 0.5137046901256771
Energy: 0.46900464304869666
Energy: 0.513704690126139
Energy: 0.4982743184246539
Energy: 0.5022597784804048
Energy: 0.4982743184246539
Energy: 0.5022597784804048
Energy: 0.49827431842511566
Energy: 0.5022597784808666
Energy: 0.49419932585000576
Energy: 0.45271509206831356
Energy: 0.49419932585000576
Energy: 0.4527150920479981
Energy: 0.4941993258509292
Energy: 0.4527150920258569
Energy: 0.46244269317939996
Energy: 0.5303944727793936
Energy: 0.46244269242945146
Energy: 0.5303944727793936
Energy: 0.4624426886160138
Energy: 0.5303944727793936
Energy: 0.4010116983612591
Energy: 0.5175100154686663
Energy: 0.40101169836172085
Energy: 0.5175100154682045
Energy: 0.40101169836218253
Energy: 0.5175100154677428
Energy: 0.46891534939667345
Energy: 0.47590216533436763
Energy: 0.46891534939667345
Energy: 0.4759021653348293
Energy: 0.46891534939667345
Energy: 0.47590216533436763
Energy: 0.48662994902638096
Energy: 0.46339880283940416
Energy: 0.4866299490259192
Energy: 0.46339880283940416
Energy: 0.4866299490259192
Energy: 0.46339880283940416
Energy: 0.46092660731540025
Energy: 0.48639413232963147
Energy: 0.46092660731493856
Energy: 0.48639413232963147
Energy: 0.4609266073144768
Energy: 0.48639413232963147
Energy: 0.5510055238122158
Energy: 0.47266524921422776
Energy: 0.5510055238145244
Energy: 0.47266524921422776
Energy: 0.5510055238140626
Energy: 0.47266524921422776
Energy: 0.5057705450022097
Energy: 0.4372282749233051
Energy: 0.5057705450012863
Energy: 0.4372282749237668
Energy: 0.5057705450003629
Energy: 0.4372282749233051
Energy: 0.46023177892779255
Energy: 0.46191956816532964
Energy: 0.46023177892779255
Energy: 0.46191956816532964
Energy: 0.46023177892779255
Energy: 0.46191956816532964
Energy: 0.4881892650750337
Energy: 0.43977930003786353
Energy: 0.48818926507549537
Energy: 0.4397793000401721
Energy: 0.4881892650750337
Energy: 0.43977930003832527
Energy: 0.48582700538244183
Energy: 0.4621454852781102
Energy: 0.4858270053801333
Energy: 0.4621454852781102
Energy: 0.4858270053805949
Energy: 0.4621454852781102
Energy: 0.4014383151209744
Energy: 0.46082333991491664
Energy: 0.40143831512189776
Energy: 0.46082333991630176
Energy: 0.40143831512189776
Energy: 0.46082333991537827
Energy: 0.46598434787361326
Energy: 0.5185159532798007
Energy: 0.46598434787361326
Energy: 0.5185159532788772
Energy: 0.46598434787222814
Energy: 0.5185159532807241
Energy: 0.41525291967481887
Energy: 0.4415601203525071
Energy: 0.4152529196743572
Energy: 0.4415601203525071
Energy: 0.4152529196738954
Energy: 0.44156012035296877
Energy: 0.4860834586569474
Energy: 0.49128839415958064
Energy: 0.4860834586569474
Energy: 0.49128839415958064
Energy: 0.48608345865648567
Energy: 0.49128839415958064
Energy: 0.4451081122605425
Energy: 0.5354348875198549
Energy: 0.4451081122600807
Energy: 0.5354348875198549
Energy: 0.4451081122605425
Energy: 0.5354348875198549
Energy: 0.4769364285391513
Energy: 0.4506684499376365
Energy: 0.47693642853868956
Energy: 0.4506684499376365
Energy: 0.4769364285391513
Energy: 0.4506684499376365
Energy: 0.4939208485765991
Energy: 0.46057138107510387
Energy: 0.4939208485765991
Energy: 0.46057138107510387
Energy: 0.4939208485761374
Energy: 0.46057138107510387
Energy: 0.5767388078025754
Energy: 0.5488461594174876
Energy: 0.5767388078025754
Energy: 0.5488461594179495
Energy: 0.5767388078021136
Energy: 0.5488461594179495
Energy: 0.4743373698745839
Energy: 0.43729351887296103
Energy: 0.47433736987596903
Energy: 0.43729351887157586
Energy: 0.4743373698745839
Energy: 0.43729351887203755

minimum gb energy = 0.4010116983612591 eV
minimum distance =  2.67003164769877 Angstroms
sigma value = 57


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

Energy: 0.45997064638600343
Energy: 0.4011657080555354
Energy: 0.45997064638600343
Energy: 0.4011657080549375
Energy: 0.45997064638600343
Energy: 0.4011657080555354
Energy: 0.4206931796508895
Energy: 0.3718804755121423
Energy: 0.4206931796496939
Energy: 0.3718804755121423
Energy: 0.4206931796502916
Energy: 0.3718804755121423
Energy: 0.4708969516804139
Energy: 0.4746383640648663
Energy: 0.4708969516804139
Energy: 0.4746383640648663
Energy: 0.4708969516810117
Energy: 0.4746383640642685
Energy: 0.5980335594280444
Energy: 0.42714097332618384
Energy: 0.5980335594274465
Energy: 0.42714097332618384
Energy: 0.5980335594280444
Energy: 0.42714097332618384
Energy: 0.4825513305123012
Energy: 0.4631900284923454
Energy: 0.48255133051289906
Energy: 0.4631900284923454
Energy: 0.48255133051289906
Energy: 0.46319002849294316
Energy: 0.47183870024343905
Energy: 0.45782862359789317
Energy: 0.4718387002428412
Energy: 0.45782862359789317
Energy: 0.47183870024343905
Energy: 0.457828623598491
Energy: 0.5542072932723368
Energy: 0.524230826454254
Energy: 0.5542072932723368
Energy: 0.524230826454254
Energy: 0.5542072932723368
Energy: 0.524230826454254
Energy: 0.45988485936817936
Energy: 0.4030828552812914
Energy: 0.4598848593675815
Energy: 0.40308285528188925
Energy: 0.45988485936877715
Energy: 0.4030828552812914
Energy: 0.4447371315272024
Energy: 0.42494868376547995
Energy: 0.44473713152660455
Energy: 0.42494868376547995
Energy: 0.44473713152600675
Energy: 0.42494868376547995
Energy: 0.3819592251376572
Energy: 0.422801849726778
Energy: 0.38195922513705927
Energy: 0.422801849726778
Energy: 0.38195922513705927
Energy: 0.422801849726778
Energy: 0.44927083785377614
Energy: 0.5578174067588421
Energy: 0.44927083785377614
Energy: 0.5578174067582442
Energy: 0.4492708378531783
Energy: 0.5578174067588421
Energy: 0.4827712532896915
Energy: 0.4630757063505441
Energy: 0.48277125328849585
Energy: 0.46307570634815287
Energy: 0.48277125328849585
Energy: 0.46307570634635936
Energy: 0.44306679545911465
Energy: 0.4245315298042838
Energy: 0.4430667954597125
Energy: 0.4245315298042838
Energy: 0.44306679545911465
Energy: 0.4245315298042838
Energy: 0.5563437600555192
Energy: 0.4025475108585231
Energy: 0.5563437600561172
Energy: 0.40254751085971874
Energy: 0.5563437600561172
Energy: 0.4025475108585231
Energy: 0.5601905451855473
Energy: 0.4021415660770067
Energy: 0.560190545183156
Energy: 0.4021415660770067
Energy: 0.5601905451837539
Energy: 0.4021415660764089
Energy: 0.44464260112969345
Energy: 0.4240120660086199
Energy: 0.44464260066181777
Energy: 0.4240120660080221
Energy: 0.4446426002937237
Energy: 0.4240120660086199
Energy: 0.38176689149918813
Energy: 0.42113836290613865
Energy: 0.3817668914985903
Energy: 0.42113836290613865
Energy: 0.38176689149918813
Energy: 0.42113836290613865
Energy: 0.4481090492713496
Energy: 0.5173819252001888
Energy: 0.4481090492719475
Energy: 0.5173819252007866
Energy: 0.4481090492713496
Energy: 0.5173819252001888
Energy: 0.3816718992553283
Energy: 0.4207737340344834
Energy: 0.38167189925473044
Energy: 0.4207737340344834
Energy: 0.3816718992553283
Energy: 0.4207737340344834
Energy: 0.44484046324568044
Energy: 0.42401310313747476
Energy: 0.444840463243887
Energy: 0.42401310313807256
Energy: 0.444840463243887
Energy: 0.42401310313807256
Energy: 0.5602062685488476
Energy: 0.40191070644884475
Energy: 0.5602062685470541
Energy: 0.40191070644884475
Energy: 0.5602062685500433
Energy: 0.40191070644944266
Energy: 0.5563310100980982
Energy: 0.5550371113549635
Energy: 0.5563310100980982
Energy: 0.5550371113543656
Energy: 0.556331010098696
Energy: 0.5550371113549635
Energy: 0.44310206032757393
Energy: 0.4246683275475783
Energy: 0.4431020603269761
Energy: 0.4246683275475783
Energy: 0.44310206032817173
Energy: 0.4246683275475783
Energy: 0.4826714297304446
Energy: 0.46304304839517896
Energy: 0.4826714297304446
Energy: 0.4630430483921899
Energy: 0.4826714297334337
Energy: 0.4630430483909943

minimum gb energy = 0.3718804755121423 eV
minimum distance =  2.63530780322681 Angstroms
sigma value = 17


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

Energy: 0.45487534142209546
Energy: 0.39655680657812137
Energy: 0.45487534142209546
Energy: 0.39655680657812137
Energy: 0.45487534142125
Energy: 0.39655680657812137
Energy: 0.40205521886255413
Energy: 0.4802842277504239
Energy: 0.4020552188617087
Energy: 0.4802842277504239
Energy: 0.40205521886255413
Energy: 0.4802842277504239
Energy: 0.43893949546811734
Energy: 0.4354793979776351
Energy: 0.43893949546811734
Energy: 0.4354793979776351
Energy: 0.43893949546811734
Energy: 0.4354793979776351
Energy: 0.41476186070418497
Energy: 0.5122282260548865
Energy: 0.41476186070418497
Energy: 0.5122282260540411
Energy: 0.41476186070418497
Energy: 0.5122282260548865
Energy: 0.4518714658163677
Energy: 0.5042135437892601
Energy: 0.4518714658172132
Energy: 0.5042135437892601
Energy: 0.45187146581552223
Energy: 0.5042135437892601
Energy: 0.4871327959943788
Energy: 0.4413224600095601
Energy: 0.4871327959943788
Energy: 0.4413224600104056
Energy: 0.4871327959943788
Energy: 0.4413224600095601
Energy: 0.43251242291580305
Energy: 0.4812085603167535
Energy: 0.4325124229174939
Energy: 0.4812085603167535
Energy: 0.43251242291918485
Energy: 0.4812085603167535
Energy: 0.4147149821370824
Energy: 0.47375808653650064
Energy: 0.4147149821370824
Energy: 0.47375808653650064
Energy: 0.4147149821379279
Energy: 0.47375808653650064
Energy: 0.4173721328938966
Energy: 0.47922633976527634
Energy: 0.4173721328938966
Energy: 0.4792263397669672
Energy: 0.41737213289474207
Energy: 0.4792263397669672
Energy: 0.4858089582773595
Energy: 0.4842358456060278
Energy: 0.4858089582782049
Energy: 0.4842358456060278
Energy: 0.4858089582773595
Energy: 0.4842358456060278
Energy: 0.4851941546015291
Energy: 0.4134566267435011
Energy: 0.4851941546015291
Energy: 0.413456626745192
Energy: 0.4851941546015291
Energy: 0.41345662674603745
Energy: 0.4438460067923931
Energy: 0.4272106583879687
Energy: 0.44384600667493385
Energy: 0.427210658388814
Energy: 0.44384600640619754
Energy: 0.4272106583879687
Energy: 0.4463685594979866
Energy: 0.4363337811281096
Energy: 0.4463685594979866
Energy: 0.4363337811281096
Energy: 0.44636855949714116
Energy: 0.4363337811281096
Energy: 0.4034106543468646
Energy: 0.4236094228364234
Energy: 0.40341065434601914
Energy: 0.4236094228364234
Energy: 0.40341065434601914
Energy: 0.4236094228364234
Energy: 0.3993481844044252
Energy: 0.4526790383977396
Energy: 0.3993481844027344
Energy: 0.4526790383977396
Energy: 0.3993481844027344
Energy: 0.4526790383977396
Energy: 0.4868964074682817
Energy: 0.5678918653983734
Energy: 0.4868964074682817
Energy: 0.5678918653983734
Energy: 0.4868964074682817
Energy: 0.5678918654000644
Energy: 0.4025585099346597
Energy: 0.4223562958278835
Energy: 0.4025585099338142
Energy: 0.4223562958278835
Energy: 0.4025585099346597
Energy: 0.4223562958278835

minimum gb energy = 0.39655680657812137 eV
minimum distance =  2.67626952271272 Angstroms
sigma value = 17


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

Energy: 0.42346071564189686
Energy: 0.38260238424666915
Energy: 0.4234607156405909
Energy: 0.3826023842469957
Energy: 0.4234607156428763
Energy: 0.3826023842469957
Energy: 0.40049322784385394
Energy: 0.4387337442664158
Energy: 0.4004932278405891
Energy: 0.4387337442660893
Energy: 0.4004932278412421
Energy: 0.4387337442660893
Energy: 0.42031264964395865
Energy: 0.43679211283186303
Energy: 0.4203126496433058
Energy: 0.43679211283121006
Energy: 0.42031264964199977
Energy: 0.43679211283121006
Energy: 0.4005561208164637
Energy: 0.38734581241534494
Energy: 0.4005561208115665
Energy: 0.3873458124156714
Energy: 0.4005561208151578
Energy: 0.3873458124156714
Energy: 0.5123112441883051
Energy: 0.457867822201685
Energy: 0.4524719215790166
Energy: 0.45786782220201144
Energy: 0.4499452434811956
Energy: 0.45786782220070554
Energy: 0.39260267676502075
Energy: 0.38207073708099704
Energy: 0.39260267676502075
Energy: 0.38207073708099704
Energy: 0.39260267676502075
Energy: 0.38207073708099704
Energy: 0.3855363006381002
Energy: 0.44342444919883134
Energy: 0.3855363006377736
Energy: 0.4434244491991578
Energy: 0.3855363006377736
Energy: 0.44342444919883134
Energy: 0.42785880950926525
Energy: 0.490038905303551
Energy: 0.42785880951122424
Energy: 0.4900389053038774
Energy: 0.4278588095128566
Energy: 0.49003890530289795
Energy: 0.4680740250625336
Energy: 0.3988071861270157
Energy: 0.46807402506318657
Energy: 0.3988071861247304
Energy: 0.46807402506318657
Energy: 0.3988071861260363
Energy: 0.38610917647930404
Energy: 0.4096819798534524
Energy: 0.38610917647930404
Energy: 0.40968197985312593
Energy: 0.38610917648060994
Energy: 0.4096819798534524
Energy: 0.4353652937032491
Energy: 0.4964803464906028
Energy: 0.43536529370422855
Energy: 0.49648034649092926
Energy: 0.43536529370259613
Energy: 0.49648034649092926
Energy: 0.42229730195624093
Energy: 0.44736609699183744
Energy: 0.4222973019559145
Energy: 0.44736609699053154
Energy: 0.4222973019572204
Energy: 0.44736609698824614
Energy: 0.4479222481279143
Energy: 0.44462015836001867
Energy: 0.4479222481285672
Energy: 0.4446201583603451
Energy: 0.4479222481279143
Energy: 0.44462015836001867
Energy: 0.4481089296971938
Energy: 0.3868431552936401
Energy: 0.44810892969752025
Energy: 0.38684315528939583
Energy: 0.4481089296971938
Energy: 0.38684315529102825
Energy: 0.4227324998044328
Energy: 0.4138357257268193
Energy: 0.4227324997965972
Energy: 0.4138357257284517
Energy: 0.4227324997718144
Energy: 0.4138357257271458
Energy: 0.43526620612821854
Energy: 0.4208413956239931
Energy: 0.435266206129198
Energy: 0.4208413956239931
Energy: 0.43526620612821854
Energy: 0.42084139562366657
Energy: 0.3805141755862712
Energy: 0.38870390930530846
Energy: 0.38051417558725065
Energy: 0.388703909304982
Energy: 0.3805141755869241
Energy: 0.388703909304982
Energy: 0.4759962309759383
Energy: 0.41619439589489343
Energy: 0.47599623097724425
Energy: 0.41619439589064927
Energy: 0.4759962309762648
Energy: 0.41619439589260815
Energy: 0.46828523565812474
Energy: 0.3960788857321366
Energy: 0.46828523565779834
Energy: 0.39607888573801325
Energy: 0.46828523565812474
Energy: 0.39607888573442196
Energy: 0.38011649024405286
Energy: 0.42160005762901887
Energy: 0.38011649024307337
Energy: 0.4216000576286924
Energy: 0.3801164902447058
Energy: 0.42160005762901887
Energy: 0.4682788116426418
Energy: 0.39574368261844933
Energy: 0.46827881164198887
Energy: 0.39574368315951686
Energy: 0.4682788116429683
Energy: 0.39574368370286966
Energy: 0.47595782359868904
Energy: 0.41631137166699084
Energy: 0.47595782359868904
Energy: 0.41631137166568494
Energy: 0.4759578235977095
Energy: 0.4163113716663379
Energy: 0.3808950551892883
Energy: 0.3886684715546699
Energy: 0.3808950551909207
Energy: 0.38866847155499634
Energy: 0.38089505518961475
Energy: 0.38866847155499634
Energy: 0.4352677973669344
Energy: 0.44142478653009054
Energy: 0.43526779736595494
Energy: 0.4414247865258462
Energy: 0.4352677973666078
Energy: 0.4414247865375996
Energy: 0.4225681280980628
Energy: 0.4142042342691663
Energy: 0.42256812808957434
Energy: 0.41420423426818687
Energy: 0.422568128057609
Energy: 0.4142042342714517
Energy: 0.44816300903589723
Energy: 0.3836714369450973
Energy: 0.4481630090378561
Energy: 0.38367143694379136
Energy: 0.44816300903589723
Energy: 0.3836714369428119
Energy: 0.4479234178038726
Energy: 0.4446156190067108
Energy: 0.4479234178022402
Energy: 0.4446156190067108
Energy: 0.44792341780321965
Energy: 0.4446156190067108
Energy: 0.42217498858952646
Energy: 0.4474095208637069
Energy: 0.4221749885892
Energy: 0.447409520862401
Energy: 0.4221749885892
Energy: 0.4474095208633804
Energy: 0.43511608776898314
Energy: 0.49630925758614436
Energy: 0.43511608776702426
Energy: 0.49630925758581784
Energy: 0.4351160877663713
Energy: 0.4963092575854914
Energy: 0.3859602293578808
Energy: 0.40968953315893863
Energy: 0.3859602293601663
Energy: 0.4096895331592651
Energy: 0.38596022935886026
Energy: 0.4096895331592651
Energy: 0.4680062711392999
Energy: 0.39899211864620454
Energy: 0.4680062711392999
Energy: 0.3989921186488164
Energy: 0.4680062711392999
Energy: 0.3989921186475105
Energy: 0.42792402925357165
Energy: 0.4900765368646465
Energy: 0.4279240292490009
Energy: 0.4900765368633406
Energy: 0.42792402925030687
Energy: 0.4900765368662789
Energy: 0.384367135771942
Energy: 0.4433890432153848
Energy: 0.3843671357784716
Energy: 0.4433890432160378
Energy: 0.38436713577096254
Energy: 0.4433890432157113
Energy: 0.39268753081391433
Energy: 0.3676697830668918
Energy: 0.39268753081391433
Energy: 0.3676697830701567
Energy: 0.39268753081424074
Energy: 0.36766978306983017
Energy: 0.45012235436993686
Energy: 0.45786582858937985
Energy: 0.45203688981613976
Energy: 0.4578658285854621
Energy: 0.4498805797121226
Energy: 0.4578658285991743
Energy: 0.40109332990060914
Energy: 0.460490824180028
Energy: 0.40109332990060914
Energy: 0.46049082418035453
Energy: 0.40109332989930324
Energy: 0.46049082417970155
Energy: 0.42031957326508723
Energy: 0.43699546023497915
Energy: 0.42031957326476077
Energy: 0.43699546023497915
Energy: 0.42031957326443425
Energy: 0.43699546023497915
Energy: 0.39915447335315324
Energy: 0.4387376134191747
Energy: 0.3991544733436853
Energy: 0.4387376134191747
Energy: 0.39915447335119436
Energy: 0.4387376134195011
Energy: 0.42346071564157034
Energy: 0.3826023842502605
Energy: 0.4234607156399379
Energy: 0.38260238424993404
Energy: 0.4234607156425498
Energy: 0.38260238424993404
Energy: 0.4004932278458128
Energy: 0.4480944487510084
Energy: 0.40049322783863023
Energy: 0.4480944487510084
Energy: 0.400493227842548
Energy: 0.44809444875068194
Energy: 0.42031264964102033
Energy: 0.43679211283414837
Energy: 0.4203126496413469
Energy: 0.4367921128344748
Energy: 0.42031264964036735
Energy: 0.43679211283414837
Energy: 0.40055612081711667
Energy: 0.38734581241469196
Energy: 0.40055612081548425
Energy: 0.3873458124143655
Energy: 0.4005561208180961
Energy: 0.38734581241469196
Energy: 0.5123082758771442
Energy: 0.45786782220135847
Energy: 0.4522869434348671
Energy: 0.457867822201685
Energy: 0.44992383759038845
Energy: 0.4578678222029909

minimum gb energy = 0.3676697830668918 eV
minimum distance =  2.62549986814801 Angstroms
sigma value = 57


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

Energy: 0.40048910274761756
Energy: 0.3617690060347473
Energy: 0.4004891027444281
Energy: 0.3617690060347473
Energy: 0.40048910274495964
Energy: 0.3617690060336842
Energy: 0.38025626896526976
Energy: 0.4134321926145072
Energy: 0.38025626897324355
Energy: 0.4134321926150388
Energy: 0.38025626896845927
Energy: 0.41343219261397557
Energy: 0.4106291202077722
Energy: 0.4126103307744744
Energy: 0.41062912020830383
Energy: 0.4126103307734112
Energy: 0.4106291202072407
Energy: 0.41261033077394277
Energy: 0.3839252575285515
Energy: 0.39655179726741185
Energy: 0.3839252575312095
Energy: 0.39655179726741185
Energy: 0.3839252575306779
Energy: 0.39655179726741185
Energy: 0.46550406293404034
Energy: 0.40886615189423214
Energy: 0.46546716997240845
Energy: 0.40886615189370057
Energy: 0.4113660214300758
Energy: 0.40886615189370057
Energy: 0.38017549979081244
Energy: 0.3529566724153507
Energy: 0.38017549979081244
Energy: 0.3529566724153507
Energy: 0.380175499791344
Energy: 0.3529566724153507
Energy: 0.4209757140947603
Energy: 0.4187181012721797
Energy: 0.42097571409529194
Energy: 0.4187181012727113
Energy: 0.4209757140958235
Energy: 0.4187181012727113
Energy: 0.4285938366437384
Energy: 0.4473016506026686
Energy: 0.4285938366474595
Energy: 0.4473016506016055
Energy: 0.4285938366517122
Energy: 0.447301650602137
Energy: 0.4068814831791849
Energy: 0.35402999049605866
Energy: 0.4068814831786533
Energy: 0.35402999049499545
Energy: 0.40688148317971656
Energy: 0.3540299904955271
Energy: 0.3634383912757795
Energy: 0.40979567390302857
Energy: 0.3634383912763111
Energy: 0.40979567390302857
Energy: 0.36343839127524796
Energy: 0.40979567390302857
Energy: 0.4211926573657819
Energy: 0.4878443692050386
Energy: 0.42119265736525024
Energy: 0.4878443692061017
Energy: 0.42119265736206074
Energy: 0.48784436920557017
Energy: 0.3713988126281264
Energy: 0.4223819938553681
Energy: 0.37139881262865804
Energy: 0.4223819938558997
Energy: 0.37139881262972113
Energy: 0.4223819938564313
Energy: 0.3623428984591426
Energy: 0.40258982092057055
Energy: 0.3623428984602057
Energy: 0.4025898209211021
Energy: 0.36234289845967416
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Energy: 0.4118286317644809
Energy: 0.3794191556523702
Energy: 0.4118286317639493
Energy: 0.3794191556518386
Energy: 0.4118286317634177
Energy: 0.37941915564758594
Energy: 0.40832798426284617
Energy: 0.39863710396019714
Energy: 0.4083279842623146
Energy: 0.39863710396338664
Energy: 0.40832798426284617
Energy: 0.398637103956476
Energy: 0.42537309745444574
Energy: 0.4300717947680273
Energy: 0.42537309745550894
Energy: 0.4300717947680273
Energy: 0.42537309745444574
Energy: 0.4300717947680273
Energy: 0.4264778372049386
Energy: 0.4308556669813542
Energy: 0.4264778372060018
Energy: 0.4308556669813542
Energy: 0.4264778372065333
Energy: 0.4308556669813542
Energy: 0.40245642635880347
Energy: 0.3977924302212607
Energy: 0.4024564261792231
Energy: 0.3977924302191343
Energy: 0.40245642537048354
Energy: 0.3977924302191343
Energy: 0.4128053463986206
Energy: 0.39059195952676906
Energy: 0.41280534640021543
Energy: 0.39059195953846404
Energy: 0.41280534639915223
Energy: 0.3905919595427167
Energy: 0.4124892197856883
Energy: 0.3867223552509684
Energy: 0.41248921978515674
Energy: 0.38672235525149995
Energy: 0.4124892197856883
Energy: 0.3867223552509684
Energy: 0.42544181456164903
Energy: 0.3932775873124062
Energy: 0.42544181456005425
Energy: 0.3932775873150641
Energy: 0.42544181456005425
Energy: 0.3932775873150641
Energy: 0.38863362906082244
Energy: 0.3897360845158698
Energy: 0.38863362906135407
Energy: 0.38973608451640135
Energy: 0.38863362906135407
Energy: 0.3897360845143233
Energy: 0.36446921238872326
Energy: 0.36750889403932424
Energy: 0.3644692123871284
Energy: 0.36750889403932424
Energy: 0.36446921238659685
Energy: 0.36750889403932424
Energy: 0.41594711382602606
Energy: 0.49657962707673436
Energy: 0.4159471138254945
Energy: 0.49657963118572096
Energy: 0.41594711382655764
Energy: 0.49657962854435383
Energy: 0.45167153979629837
Energy: 0.49775703197444243
Energy: 0.4516715397952352
Energy: 0.49775703197444243
Energy: 0.45167153979576674
Energy: 0.49775703197497395
Energy: 0.36099733604515527
Energy: 0.3684456326197398
Energy: 0.36099733604515527
Energy: 0.3684456326197398
Energy: 0.3609973360446237
Energy: 0.3684456326197398
Energy: 0.39698282520268885
Energy: 0.3894941605001395
Energy: 0.3969828252032204
Energy: 0.38949416050067115
Energy: 0.39698282520481515
Energy: 0.3894941605001395

minimum gb energy = 0.3529566724153507 eV
minimum distance =  2.64979610022007 Angstroms
sigma value = 43


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

Energy: 0.45465629010539255
Energy: 0.34193431288719944
Energy: 0.4546562901042306
Energy: 0.34193431288719944
Energy: 0.45465629010500525
Energy: 0.34193431288719944
Energy: 0.38516384270968956
Energy: 0.376952525763251
Energy: 0.38516384270968956
Energy: 0.376952525763251
Energy: 0.38516384270852766
Energy: 0.3769525257636383
Energy: 0.37384846196505384
Energy: 0.37707312544776506
Energy: 0.37384846196544125
Energy: 0.37707312544776506
Energy: 0.3738484619646666
Energy: 0.37707312544776506
Energy: 0.4096243433313925
Energy: 0.3509346632233146
Energy: 0.4096243433383643
Energy: 0.3509346632229274
Energy: 0.40962434333720227
Energy: 0.3509346632229274
Energy: 0.44073259950906124
Energy: 0.36533313655338195
Energy: 0.4407325995078993
Energy: 0.36533313655376926
Energy: 0.4407325995067374
Energy: 0.36533313655376926
Energy: 0.34520782384953946
Energy: 0.32768441340486265
Energy: 0.34520782384953946
Energy: 0.32768441340486265
Energy: 0.3452078238499268
Energy: 0.32768441340408805
Energy: 0.3960495313893853
Energy: 0.3706958225330814
Energy: 0.39604953138861065
Energy: 0.370695822533856
Energy: 0.39604953139128674
Energy: 0.370695822533856
Energy: 0.45718272232691237
Energy: 0.36305406288152203
Energy: 0.45718272232768703
Energy: 0.36305406288152203
Energy: 0.4571827223222646
Energy: 0.36305406288113473
Energy: 0.3313622460638061
Energy: 0.3272796229712664
Energy: 0.3313622460638061
Energy: 0.3272796229716537
Energy: 0.3313622460638061
Energy: 0.3272796229716537
Energy: 0.3733774211907693
Energy: 0.3558964122362365
Energy: 0.3733774212166843
Energy: 0.3558964122366238
Energy: 0.3733774212139731
Energy: 0.3558964122362365
Energy: 0.4289579330678988
Energy: 0.3802181379234448
Energy: 0.4289579330640257
Energy: 0.3802181379230575
Energy: 0.4289579330655749
Energy: 0.3802181379234448
Energy: 0.3616643613178003
Energy: 0.32768873377359814
Energy: 0.3616643613181877
Energy: 0.32768873377476015
Energy: 0.36166436131741303
Energy: 0.32768873377476015
Energy: 0.33563031126429377
Energy: 0.3495909311840539
Energy: 0.33563031126390647
Energy: 0.3495909311840539
Energy: 0.3356303112631318
Energy: 0.3495909311840539
Energy: 0.42340759668825695
Energy: 0.41026966689765487
Energy: 0.4234075966874823
Energy: 0.4102696668972675
Energy: 0.4234075966878697
Energy: 0.4102696668972675
Energy: 0.3570830459473759
Energy: 0.32856018314615854
Energy: 0.3570830459477632
Energy: 0.32856018314654584
Energy: 0.3570830459477632
Energy: 0.3285601831449966
Energy: 0.34037239019257026
Energy: 0.3439488479664582
Energy: 0.34037239019063376
Energy: 0.3439488479664582
Energy: 0.340372390192183
Energy: 0.3439488479664582
Energy: 0.3710902643720774
Energy: 0.41115315006674463
Energy: 0.37109026437052817
Energy: 0.411153150064808
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Energy: 0.41115315006674463
Energy: 0.3353647241083256
Energy: 0.3582452172092157
Energy: 0.3353647241083256
Energy: 0.3582452172103777
Energy: 0.3353647241087129
Energy: 0.35824521721115227
Energy: 0.3654957949469857
Energy: 0.36522223698428613
Energy: 0.3654957949469857
Energy: 0.3652222369838987
Energy: 0.36549579494659845
Energy: 0.3652222369838987
Energy: 0.37875319621941295
Energy: 0.4297532205583758
Energy: 0.37875319622018755
Energy: 0.4297532205521787
Energy: 0.37875319621941295
Energy: 0.42975322054172116
Energy: 0.37004450502702435
Energy: 0.38073352578147346
Energy: 0.370044505027799
Energy: 0.3807335257799242
Energy: 0.3700445050289609
Energy: 0.38073352578069886
Energy: 0.3822935548273741
Energy: 0.3814509608760511
Energy: 0.3822935548277615
Energy: 0.3814509608748891
Energy: 0.3822935548273741
Energy: 0.38145096087566377
Energy: 0.3720470628904312
Energy: 0.3854373322325708
Energy: 0.37204706289004386
Energy: 0.3854373322333455
Energy: 0.3720470628892692
Energy: 0.3854373322337329
Energy: 0.3664980281193605
Energy: 0.3888585635421333
Energy: 0.36649802811974785
Energy: 0.38885856354406984
Energy: 0.36649802811858595
Energy: 0.38885856354097137
Energy: 0.3647185829397788
Energy: 0.37253014750182367
Energy: 0.3647185829397788
Energy: 0.3725301475014364
Energy: 0.3647185829397788
Energy: 0.37253014750182367
Energy: 0.3651474680825133
Energy: 0.3551818786976456
Energy: 0.36514746808096404
Energy: 0.3551818786976456
Energy: 0.3651474680817387
Energy: 0.3551818786976456
Energy: 0.3352239386271877
Energy: 0.43202890789860465
Energy: 0.3352239386271877
Energy: 0.43202890789821724
Energy: 0.33522393862680033
Energy: 0.43202890789821724
Energy: 0.3578868608160494
Energy: 0.3726582880031663
Energy: 0.3578868608156621
Energy: 0.37265828800239176
Energy: 0.3578868608160494
Energy: 0.37265828800394096
Energy: 0.32147503394695187
Energy: 0.33173626598816763
Energy: 0.3214750339461772
Energy: 0.33173626598778033
Energy: 0.32147503394695187
Energy: 0.33173626598778033
Energy: 0.35616798363842245
Energy: 0.38872994046324494
Energy: 0.3561679836388098
Energy: 0.38872994046673076
Energy: 0.35616798363842245
Energy: 0.3887299404663434
Energy: 0.36076328605881824
Energy: 0.4663828415862399
Energy: 0.3607632860592056
Energy: 0.46638284158814125
Energy: 0.36076328605881824
Energy: 0.4663828415869793
Energy: 0.3228399084605287
Energy: 0.32481043660988634
Energy: 0.3228399084605287
Energy: 0.32481043660988634
Energy: 0.32283990846091604
Energy: 0.32481043660988634
Energy: 0.3515245888861869
Energy: 0.3684968848948088
Energy: 0.3515245888869615
Energy: 0.368496884898682
Energy: 0.3515245888869615
Energy: 0.36849688489558347
Energy: 0.3957808931721509
Energy: 0.42219469123259656
Energy: 0.3957808931721509
Energy: 0.42219469123220926
Energy: 0.3957808931721509
Energy: 0.42219469123259656
Energy: 0.32372299811184224
Energy: 0.3527167997027466
Energy: 0.32372299811068034
Energy: 0.3527167997027466
Energy: 0.32372299811184224
Energy: 0.3527167997027466
Energy: 0.3332447245203796
Energy: 0.326023710633723
Energy: 0.3332447245211543
Energy: 0.3260237106341103
Energy: 0.333244724520767
Energy: 0.3260237106341103

minimum gb energy = 0.3214750339461772 eV
minimum distance =  2.6506472127629 Angstroms
sigma value = 81


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

Energy: 0.19298005365110446
Energy: 0.206245953164067
Energy: 0.08501428720022765
Energy: 0.20624595316419642
Energy: 0.19298005365110446
Energy: 0.20624595316377592
Energy: 0.43881062785132446
Energy: 0.08564133172037698
Energy: 0.4388106278516155
Energy: 0.08564133172037698
Energy: 0.4388106278511789
Energy: 0.08564133172094297
Energy: 0.4507690836145589
Energy: 0.0858287294210031
Energy: 0.45076908361384743
Energy: 0.08582872942114864
Energy: 0.45076908361441337
Energy: 0.08582872942085755
Energy: 0.08501428720022765
Energy: 0.206245953164067
Energy: 0.08501428720050255
Energy: 0.206245953164067
Energy: 0.08501428720035702
Energy: 0.20624595316377592
Energy: 0.4388106278509041
Energy: 0.08564133172037698
Energy: 0.43881062785132446
Energy: 0.08564133172023142
Energy: 0.4388106278510496
Energy: 0.08564133172165452
Energy: 0.45076908361413853
Energy: 0.08582872942228065
Energy: 0.45076908361355633
Energy: 0.08582872942200573
Energy: 0.4507690836142679
Energy: 0.08582872942186019
Energy: 0.19298005365053847
Energy: 0.20624595316392144
Energy: 0.08501428720035702
Energy: 0.20624595316377592
Energy: 0.19298005365053847
Energy: 0.2062459531643419
Energy: 0.43881062785046737
Energy: 0.08564133172094297
Energy: 0.43881062785132446
Energy: 0.08564133172094297
Energy: 0.43881062785046737
Energy: 0.0856413317219456
Energy: 0.4507690836145589
Energy: 0.08582872942286282
Energy: 0.4507690836137019
Energy: 0.08582872942271728
Energy: 0.45076908361441337
Energy: 0.08582872942186019
Energy: 0.08501428720035702
Energy: 0.206245953164067
Energy: 0.08501428720050255
Energy: 0.20624595316419642
Energy: 0.08501428720050255
Energy: 0.20624595316348485

minimum gb energy = 0.08501428720022765 eV
minimum distance =  2.77024006882511 Angstroms
sigma value = 3


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

Energy: 0.4139927424015885
Energy: 0.33119246360283877
Energy: 0.41399274240627304
Energy: 0.33119246360283877
Energy: 0.41399274240329187
Energy: 0.33119246360283877
Energy: 0.3130786916904944
Energy: 0.30911712929246726
Energy: 0.3130786916904944
Energy: 0.30911712929246726
Energy: 0.3130786916904944
Energy: 0.30911712929289314
Energy: 0.3894997405028633
Energy: 0.30735018261752794
Energy: 0.3894997404581668
Energy: 0.30735018261795377
Energy: 0.38949974030024814
Energy: 0.3073501826192314
Energy: 0.37866159224172846
Energy: 0.34447746592943157
Energy: 0.3786615922413026
Energy: 0.34447746592943157
Energy: 0.3786615922413026
Energy: 0.34447746592985745
Energy: 0.3575487494307397
Energy: 0.3845602272835977
Energy: 0.3575487494307397
Energy: 0.3845602272835977
Energy: 0.3575487494303139
Energy: 0.3845602272835977
Energy: 0.3478584888860578
Energy: 0.3524369321115342
Energy: 0.3478584888864837
Energy: 0.3524369321115342
Energy: 0.34785848888733545
Energy: 0.3524369321111083
Energy: 0.32565005638698447
Energy: 0.3700547977778011
Energy: 0.3256500563882621
Energy: 0.3700547977778011
Energy: 0.32565005638655864
Energy: 0.3700547977778011
Energy: 0.3490163405407908
Energy: 0.33389196261805615
Energy: 0.349016340539939
Energy: 0.3338919626197596
Energy: 0.3490163405407908
Energy: 0.33389196261848203
Energy: 0.3487201359334228
Energy: 0.33797469828745813
Energy: 0.3487201359334228
Energy: 0.33797469828660637
Energy: 0.3487201359351263
Energy: 0.33797469828703225
Energy: 0.32764612657293607
Energy: 0.35744644117737745
Energy: 0.327646126573362
Energy: 0.35744644117737745
Energy: 0.32764612657293607
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Energy: 0.35330034760510715
Energy: 0.3829463838741656
Energy: 0.3533003476055329
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Energy: 0.39914008936400275
Energy: 0.3742804528565017
Energy: 0.39914008936357687
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Energy: 0.3991400893644286
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Energy: 0.34035438449925354
Energy: 0.3304391303257956
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Energy: 0.3221027987993726
Energy: 0.3036626332249262
Energy: 0.322102798801502
Energy: 0.3036626332240745
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Energy: 0.3036626332245003
Energy: 0.35303693310139483
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Energy: 0.35303693310182066
Energy: 0.3569926919386798
Energy: 0.3530369331022465
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Energy: 0.35248081720739405
Energy: 0.330011458530195
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Energy: 0.38068578901246786
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Energy: 0.3519733191504724
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Energy: 0.34711427327532335
Energy: 0.35278316764219975
Energy: 0.38069484960929156
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Energy: 0.3806948496097175
Energy: 0.35157075343808286
Energy: 0.40057928167268214
Energy: 0.35157075343893457
Energy: 0.400579281673108
Energy: 0.35157075343893457
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Energy: 0.32724092216886735
Energy: 0.3121039891572464
Energy: 0.32724092217099665
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Energy: 0.3659333654240708
Energy: 0.32506578272372777
Energy: 0.3659333654232191
Energy: 0.3250657827245795
Energy: 0.3659333654236449
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Energy: 0.4476572698133854
Energy: 0.35541615257161324
Energy: 0.4476572698133854
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Energy: 0.3720794357983488
Energy: 0.35165688588250066
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Energy: 0.35165688598381795
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Energy: 0.33386802448746256
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Energy: 0.3255194124648282
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Energy: 0.3207437646861473
Energy: 0.33432685949724583
Energy: 0.3207437646857214
Energy: 0.33432685949724583
Energy: 0.3207437646861473
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Energy: 0.39728245887721403
Energy: 0.36751792950878875
Energy: 0.3972824588738072
Energy: 0.36751792950878875
Energy: 0.39728245887423297
Energy: 0.36751792950878875
Energy: 0.36501784738236465
Energy: 0.37272882683119096
Energy: 0.36501784738193876
Energy: 0.37272882683119096
Energy: 0.36501784738193876
Energy: 0.37272882683119096
Energy: 0.35307958623340846
Energy: 0.32320837790771095
Energy: 0.3530795862342602
Energy: 0.32320837790813683
Energy: 0.3530795862338344
Energy: 0.32320837790771095
Energy: 0.2994663125877539
Energy: 0.3283393633298664
Energy: 0.2994663125890315
Energy: 0.3283393633298664
Energy: 0.2994663125886057
Energy: 0.3283393633294405

minimum gb energy = 0.2994663125877539 eV
minimum distance =  2.66942142311453 Angstroms
sigma value = 67


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

Energy: 0.48562953809437565
Energy: 0.3938676260849904
Energy: 0.48562953809558923
Energy: 0.39386762608559717
Energy: 0.48562953809437565
Energy: 0.3938676260874176
Energy: 0.3565492680060394
Energy: 0.4077428415815398
Energy: 0.35654926800239856
Energy: 0.4077428415815398
Energy: 0.35654926800482584
Energy: 0.4077428415815398
Energy: 0.42714209126588165
Energy: 0.40954585735527843
Energy: 0.4271420843986375
Energy: 0.40954585735527843
Energy: 0.42714206073869126
Energy: 0.40954585735527843
Energy: 0.35345586953897234
Energy: 0.3900497203709244
Energy: 0.35345586954018593
Energy: 0.3900497203703176
Energy: 0.35345586953897234
Energy: 0.3900497203709244
Energy: 0.4044438597048053
Energy: 0.38398875297079793
Energy: 0.4044438597048053
Energy: 0.38398875297079793
Energy: 0.4044438597041985
Energy: 0.38398875297079793
Energy: 0.43651070263892877
Energy: 0.38170139957858057
Energy: 0.43651070263710834
Energy: 0.3817013995779737
Energy: 0.43651070263710834
Energy: 0.38170139957858057
Energy: 0.3708486237956754
Energy: 0.43053612870059765
Energy: 0.37084862379506867
Energy: 0.43053612870059765
Energy: 0.37084862379506867
Energy: 0.43053612870059765
Energy: 0.43383167693896196
Energy: 0.41481639822220956
Energy: 0.4338316769395688
Energy: 0.41481639822220956
Energy: 0.4338316769401756
Energy: 0.41481639822220956
Energy: 0.46286925404302776
Energy: 0.4149516306130622
Energy: 0.46286925404302776
Energy: 0.4149516306130622
Energy: 0.46286925404302776
Energy: 0.4149516306124554
Energy: 0.3695716745362429
Energy: 0.4064474185633139
Energy: 0.3695716745362429
Energy: 0.4064474185633139
Energy: 0.3695716745362429
Energy: 0.4064474185633139
Energy: 0.3926308459500627
Energy: 0.34481247831213746
Energy: 0.3926308459500627
Energy: 0.34481247831213746
Energy: 0.39263084595066955
Energy: 0.3448124783127443
Energy: 0.4018977983971256
Energy: 0.3967313996153233
Energy: 0.40189779839773243
Energy: 0.3967313124942212
Energy: 0.40189779839773243
Energy: 0.3967312458578203
Energy: 0.4046441126103388
Energy: 0.43489138456200394
Energy: 0.4046441126103388
Energy: 0.43489138456200394
Energy: 0.4046441126103388
Energy: 0.43489138456200394
Energy: 0.3973863123475276
Energy: 0.48055686884376236
Energy: 0.39738631234692073
Energy: 0.4805568688431555
Energy: 0.39738631234570715
Energy: 0.4805568688425488
Energy: 0.35412094706999947
Energy: 0.3548108459991912
Energy: 0.35412094706878594
Energy: 0.3548108459991912
Energy: 0.35412094706817915
Energy: 0.35481084599979806
Energy: 0.3530763824994485
Energy: 0.39802110743319047
Energy: 0.353076382497628
Energy: 0.39802110743376967
Energy: 0.35307638249884166
Energy: 0.39802110743376967
Energy: 0.39742883186517214
Energy: 0.377589846341192
Energy: 0.39742883186517214
Energy: 0.37758984634058523
Energy: 0.3974288318657514
Energy: 0.377589846341192
Energy: 0.3683149711337837
Energy: 0.4202922695289016
Energy: 0.3683149711319633
Energy: 0.4202922695295084
Energy: 0.36831497113317696
Energy: 0.4202922695282948
Energy: 0.36912216083785304
Energy: 0.45354009854936284
Energy: 0.36912216083785304
Energy: 0.45354009854936284
Energy: 0.36912216083785304
Energy: 0.45354009854936284
Energy: 0.421135854777676
Energy: 0.37652297058234035
Energy: 0.42113585477706916
Energy: 0.3765229705829471
Energy: 0.42113585477706916
Energy: 0.3765229705829471
Energy: 0.42866196945432183
Energy: 0.3555325523501273
Energy: 0.42866196945310814
Energy: 0.35553255234891384
Energy: 0.428661969453715
Energy: 0.3555325523495205
Energy: 0.3578078919489099
Energy: 0.45416113833031674
Energy: 0.35780789194830315
Energy: 0.45416113833031674
Energy: 0.3578078919489099
Energy: 0.45416113832971
Energy: 0.3738818337315759
Energy: 0.37591123878474186
Energy: 0.3738818337321827
Energy: 0.3759112387853486
Energy: 0.3738818337315759
Energy: 0.37591123878595545

minimum gb energy = 0.34481247831213746 eV
minimum distance =  2.69279276203402 Angstroms
sigma value = 33


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

Energy: 0.5156552453812749
Energy: 0.4164795805670024
Energy: 0.49682632790102105
Energy: 0.41647958056623247
Energy: 0.5156552453766554
Energy: 0.41647958056623247
Energy: 0.4496238982255911
Energy: 0.45694238348206345
Energy: 0.44962389822482124
Energy: 0.45694238348206345
Energy: 0.44962389822597604
Energy: 0.45694238348206345
Energy: 0.47656636866439034
Energy: 0.4535746226911727
Energy: 0.4765663686628506
Energy: 0.4535746226934824
Energy: 0.476566368659771
Energy: 0.45357462269309745
Energy: 0.4491980535278767
Energy: 0.42034966840635485
Energy: 0.4491980535278767
Energy: 0.42034966840635485
Energy: 0.44919805352518205
Energy: 0.42034966840635485
Energy: 0.46086780842709374
Energy: 0.45924982196171976
Energy: 0.4608678084267088
Energy: 0.4592498219594101
Energy: 0.46086780842709374
Energy: 0.4592498219594101
Energy: 0.5179258780478629
Energy: 0.4943336071406928
Energy: 0.5179258780459383
Energy: 0.49433360713761315
Energy: 0.5179258780459383
Energy: 0.4943336071372282
Energy: 0.4345609241231866
Energy: 0.46264661966596454
Energy: 0.4345609241235716
Energy: 0.4626466196640398
Energy: 0.4345609241251114
Energy: 0.4626466196640398
Energy: 0.43552170722343914
Energy: 0.3826094832178096
Energy: 0.4355217072253639
Energy: 0.3826094831862438
Energy: 0.43552170722690364
Energy: 0.382609483147364
Energy: 0.4457820918844727
Energy: 0.42933883491874164
Energy: 0.44579709548870616
Energy: 0.42933873428161273
Energy: 0.44578209188293294
Energy: 0.42933865236086927
Energy: 0.4286256526160944
Energy: 0.4764085622224408
Energy: 0.42862565261686436
Energy: 0.4764085622235957
Energy: 0.4286256526191391
Energy: 0.4764085622239806
Energy: 0.45926040879693164
Energy: 0.5193841999965157
Energy: 0.459275722634865
Energy: 0.5193841999969008
Energy: 0.4592604043712103
Energy: 0.5193841999972857
Energy: 0.43199360886036237
Energy: 0.39978630305969376
Energy: 0.43199360886036237
Energy: 0.39978630306123353
Energy: 0.4319936088584376
Energy: 0.39978630306123353
Energy: 0.45303839105091226
Energy: 0.41702825901805346
Energy: 0.453038391052452
Energy: 0.4170282590149739
Energy: 0.453038391052452
Energy: 0.41702825901535884
Energy: 0.4639010300006515
Energy: 0.45560744257909036
Energy: 0.4639010300029612
Energy: 0.4556074425802452
Energy: 0.4639010300002665
Energy: 0.45560744257986024
Energy: 0.42298481588125353
Energy: 0.4536279628035069
Energy: 0.4229848158831784
Energy: 0.4536279628058165
Energy: 0.4229848158820235
Energy: 0.4536279628058165
Energy: 0.45045187484362587
Energy: 0.47182263457851387
Energy: 0.45045187484401084
Energy: 0.47182263457504925
Energy: 0.45045187484632054
Energy: 0.4718226345762041
Energy: 0.46300690551316254
Energy: 0.4264463175591895
Energy: 0.46300690551162266
Energy: 0.4264463175588046
Energy: 0.46300690551239265
Energy: 0.42644631755841966
Energy: 0.4399787642563958
Energy: 0.48691162798474896
Energy: 0.43997876478584036
Energy: 0.48691162798243925
Energy: 0.43997876243215844
Energy: 0.48691162798166937
Energy: 0.37392540136441926
Energy: 0.4829782246736512
Energy: 0.37392540136634395
Energy: 0.4829782246744211
Energy: 0.37392540136826874
Energy: 0.4829782246740361
Energy: 0.49338862130491146
Energy: 0.4107616052148262
Energy: 0.49338862130452654
Energy: 0.41076160521713595
Energy: 0.4933886213052965
Energy: 0.41076160521713595
Energy: 0.510963328772443
Energy: 0.4932041632904962
Energy: 0.5109638677154565
Energy: 0.4932041632920361
Energy: 0.5109633287697484
Energy: 0.4932041632912662
Energy: 0.3950923021607548
Energy: 0.4564937649558976
Energy: 0.3950923021607548
Energy: 0.4564937649562825
Energy: 0.39509230216036983
Energy: 0.4564937649558976
Energy: 0.4620038350338571
Energy: 0.5206569540439329
Energy: 0.4527739224557156
Energy: 0.5206569540435478
Energy: 0.4620038350350119
Energy: 0.5206569540435478
Energy: 0.47417255599243663
Energy: 0.49041821427220444
Energy: 0.4549618143320061
Energy: 0.4942181988222456
Energy: 0.4741725559886222
Energy: 0.46694975560764396
Energy: 0.3873364008879755
Energy: 0.4621097910804256
Energy: 0.37328375861527135
Energy: 0.4621097910823504
Energy: 0.38733640088682064
Energy: 0.4621097910823504
Energy: 0.44740535631343814
Energy: 0.5034665173871241
Energy: 0.4474053563111285
Energy: 0.5034665173855842
Energy: 0.4474053563115134
Energy: 0.5034665173855842
Energy: 0.4346663999495607
Energy: 0.4634218365360441
Energy: 0.4346663999484059
Energy: 0.463421836536814
Energy: 0.4346663999484059
Energy: 0.463421836536814
Energy: 0.4470887304327909
Energy: 0.5208153247554123
Energy: 0.44708873043202096
Energy: 0.5208153247573368
Energy: 0.44708873043048125
Energy: 0.5208153247534874
Energy: 0.4733847904855757
Energy: 0.45872593930388234
Energy: 0.4733847904832659
Energy: 0.45872593930388234
Energy: 0.47338479048442084
Energy: 0.4587259393034974
Energy: 0.37422413567646523
Energy: 0.49094077873937864
Energy: 0.3742241356745405
Energy: 0.49094077873514413
Energy: 0.3742241356749254
Energy: 0.49094077873552905
Energy: 0.5265102265288875
Energy: 0.47792518862073063
Energy: 0.5265102265308123
Energy: 0.4779251886241952
Energy: 0.5265102265308123
Energy: 0.47792518862304034
Energy: 0.4639949130985257
Energy: 0.41108819490225623
Energy: 0.46395483075195454
Energy: 0.411088194903796
Energy: 0.463994913096601
Energy: 0.411088194904181
Energy: 0.38784786854831066
Energy: 0.49800374519855367
Energy: 0.38782396030182664
Energy: 0.4980037451962439
Energy: 0.3878478685513903
Energy: 0.498003745195859
Energy: 0.46935922389211554
Energy: 0.4569038980160312
Energy: 0.4693592238909607
Energy: 0.456903898017571
Energy: 0.46935922388980583
Energy: 0.456903898017571
Energy: 0.45836628697479315
Energy: 0.4560675797219789
Energy: 0.4583662869724835
Energy: 0.4560675797219789
Energy: 0.4583662869728684
Energy: 0.45606757972159395
Energy: 0.510403115664028
Energy: 0.41788373299607307
Energy: 0.5104031156636429
Energy: 0.4178837329906838
Energy: 0.5104031156659526
Energy: 0.41788373299106873
Energy: 0.3888929853849781
Energy: 0.45231017330624634
Energy: 0.3888929853869028
Energy: 0.45231017330547646
Energy: 0.38889298538459316
Energy: 0.45231017330547646

minimum gb energy = 0.37328375861527135 eV
minimum distance =  2.61335812509294 Angstroms
sigma value = 41


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

Energy: 0.5293628684185787
Energy: 0.45393973448551517
Energy: 0.5293628684185787
Energy: 0.45393973448551517
Energy: 0.5293628684196298
Energy: 0.45393973448551517
Energy: 0.4763132092824799
Energy: 0.4910578545956337
Energy: 0.4763132092824799
Energy: 0.4910578545956337
Energy: 0.4763132092824799
Energy: 0.4910578545956337
Energy: 0.5997632604338851
Energy: 0.4927901594353666
Energy: 0.599763260432834
Energy: 0.4927901594353666
Energy: 0.5997632604338851
Energy: 0.4927901594353666
Energy: 0.503279594088504
Energy: 0.5614635952203306
Energy: 0.5032795940874529
Energy: 0.5614635952203306
Energy: 0.503279594088504
Energy: 0.5614635952203306
Energy: 0.5328752918579795
Energy: 0.4982530673547703
Energy: 0.5328752918579795
Energy: 0.4982530673547703
Energy: 0.5328752918579795
Energy: 0.4982530673547703
Energy: 0.5452232196784006
Energy: 0.5118722790449722
Energy: 0.5452232196784006
Energy: 0.5118721768402208
Energy: 0.5452232196784006
Energy: 0.5118720582814296
Energy: 0.4793880032364552
Energy: 0.509140641545792
Energy: 0.4793880032364552
Energy: 0.509140641545792
Energy: 0.4793880032364552
Energy: 0.509140641545792
Energy: 0.4926076968562869
Energy: 0.5352349934743652
Energy: 0.4926076968562869
Energy: 0.5352349934743652
Energy: 0.4926076968562869
Energy: 0.5352349934743652
Energy: 0.4834522385255154
Energy: 0.474515707461757
Energy: 0.4834522385255154
Energy: 0.474515707461757
Energy: 0.4834522385255154
Energy: 0.474515707461757
Energy: 0.5326731514773255
Energy: 0.4555286944276995
Energy: 0.5326731514773255
Energy: 0.4555286944276995
Energy: 0.5326731514773255
Energy: 0.4555286944276995
Energy: 0.49797903722195686
Energy: 0.4927231200258141
Energy: 0.49797903722090586
Energy: 0.4927231200258141
Energy: 0.49797903722090586
Energy: 0.4927231200258141
Energy: 0.508417786212363
Energy: 0.4909063051166377
Energy: 0.508417786213414
Energy: 0.4909063051166377
Energy: 0.508417786213414
Energy: 0.4909063051166377
Energy: 0.5586751261299571
Energy: 0.565712191308586
Energy: 0.5586751261299571
Energy: 0.565712191308586
Energy: 0.5586751261299571
Energy: 0.565712191309637
Energy: 0.5635063199749599
Energy: 0.49881680500877185
Energy: 0.563506319976011
Energy: 0.49881680500877185
Energy: 0.563506319976011
Energy: 0.4988168050098229

minimum gb energy = 0.45393973448551517 eV
minimum distance =  2.65984569027701 Angstroms
sigma value = 11


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

Energy: 0.5803691113288809
Energy: 0.5382796587457457
Energy: 0.5803691113288809
Energy: 0.5382796587457457
Energy: 0.5803691113288809
Energy: 0.5382796587457457
Energy: 0.4938334381631662
Energy: 0.5561056700937007
Energy: 0.4938334381631662
Energy: 0.5561056700932391
Energy: 0.49383343816362796
Energy: 0.5561056700932391
Energy: 0.5522691702049625
Energy: 0.5585913699802789
Energy: 0.5522691702040389
Energy: 0.5585913699802789
Energy: 0.5522691702045007
Energy: 0.5585913699802789
Energy: 0.559559114923086
Energy: 0.5058739371240709
Energy: 0.559559114923086
Energy: 0.5058739371240709
Energy: 0.5595591149226241
Energy: 0.5058739371240709
Energy: 0.5555281511979573
Energy: 0.5577000189417319
Energy: 0.5555281511970339
Energy: 0.5577000189417319
Energy: 0.5555281511974957
Energy: 0.5577000189417319
Energy: 0.5222233973249607
Energy: 0.5545833430162704
Energy: 0.5222233973254223
Energy: 0.5545833430162704
Energy: 0.5222233973249607
Energy: 0.5545833430158088
Energy: 0.5553768341028168
Energy: 0.5282032382709128
Energy: 0.5553768341037402
Energy: 0.528203238270451
Energy: 0.5553768341028168
Energy: 0.5282032382709128
Energy: 0.5438192457587492
Energy: 0.5266123878108234
Energy: 0.5438192457592109
Energy: 0.5266123878112852
Energy: 0.5438192457592109
Energy: 0.5266123878108234
Energy: 0.5284306407118751
Energy: 0.5269073563275875
Energy: 0.5284306407123367
Energy: 0.5269073563275875
Energy: 0.5284306407118751
Energy: 0.5269073563275875
Energy: 0.5477909734688954
Energy: 0.5400659556685841
Energy: 0.5477909734693572
Energy: 0.5400659556681224
Energy: 0.5477909734693572
Energy: 0.5400659556685841
Energy: 0.5295077465053283
Energy: 0.5613663009804822
Energy: 0.5295077465053283
Energy: 0.561366300980944
Energy: 0.5295077465048666
Energy: 0.5613663009823291
Energy: 0.5454252818105124
Energy: 0.5679792046365671
Energy: 0.5454252818114358
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Energy: 0.5679792046365671
Energy: 0.5543741141478812
Energy: 0.528887670868994
Energy: 0.5543741141478812
Energy: 0.528887670868994
Energy: 0.5543741141478812
Energy: 0.528887670868994
Energy: 0.5114356891525195
Energy: 0.5613071620251668
Energy: 0.5114356891511344
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Energy: 0.5114356891525195
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Energy: 0.4941185558481936
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Energy: 0.5071194678795784
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Energy: 0.5127705937314797
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Energy: 0.5610671001162211
Energy: 0.5280452631587472
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Energy: 0.5280452631601323
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Energy: 0.5582005748801362
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Energy: 0.5582005748792127
Energy: 0.5104976962636805
Energy: 0.5582005748810596
Energy: 0.5854736845270105
Energy: 0.5780222939979414
Energy: 0.5854736845265488
Energy: 0.5780222939979414
Energy: 0.5854736845260872
Energy: 0.5780222939979414
Energy: 0.5187872477494542
Energy: 0.5085095641969121
Energy: 0.5187872477485307
Energy: 0.5085095641969121
Energy: 0.5187872477489923
Energy: 0.5085095641969121
Energy: 0.5347587358809275
Energy: 0.5603662720214834
Energy: 0.5347587358823127
Energy: 0.5603662720214834
Energy: 0.5347587358827744
Energy: 0.5603662720219451
Energy: 0.4950327367942038
Energy: 0.5129752260359384
Energy: 0.4950327367942038
Energy: 0.5129752260359384
Energy: 0.49503273679512716
Energy: 0.5129752260363999
Energy: 0.5728508003738919
Energy: 0.5383617725938514
Energy: 0.5728508003734302
Energy: 0.5383617725938514
Energy: 0.5728508003738919
Energy: 0.5383617725938514
Energy: 0.5223449328855447
Energy: 0.5578113149752144
Energy: 0.5223449328860065
Energy: 0.5578113149747528
Energy: 0.5223449328855447
Energy: 0.5578113149756763
Energy: 0.5674408492631772
Energy: 0.5519620790050693
Energy: 0.5674408492636389
Energy: 0.5519620790050693
Energy: 0.5674408492636389
Energy: 0.5519620790050693
Energy: 0.5388540486039609
Energy: 0.5496144684368719
Energy: 0.5388540486034991
Energy: 0.5496144684368719
Energy: 0.5388540486034991
Energy: 0.5496144684368719
Energy: 0.5164553864709321
Energy: 0.5622199060307889
Energy: 0.5164553864713938
Energy: 0.5622199060303271
Energy: 0.5164553864709321
Energy: 0.5622199060303271
Energy: 0.5268594047660811
Energy: 0.5411531844623135
Energy: 0.5268594047656193
Energy: 0.5411531844627752
Energy: 0.5268594047651576
Energy: 0.5411531844636986
Energy: 0.5510273965078925
Energy: 0.5283451732160059
Energy: 0.5510273965083541
Energy: 0.5283451732160059
Energy: 0.5510273965088159
Energy: 0.5283451732160059
Energy: 0.5092711865550555
Energy: 0.5686913276809532
Energy: 0.5092711865550555
Energy: 0.5686913276814148
Energy: 0.5092711865555173
Energy: 0.5686913276814148
Energy: 0.5090999100017324
Energy: 0.4943387185835093
Energy: 0.5090999100012706
Energy: 0.4943387185830476
Energy: 0.5090999100012706
Energy: 0.4943387185835093
Energy: 0.550537581328254
Energy: 0.5522335517703413
Energy: 0.5505375813287158
Energy: 0.552233551772188
Energy: 0.550537581328254
Energy: 0.5522335517694177

minimum gb energy = 0.4938334381631662 eV
minimum distance =  2.61007827612044 Angstroms
sigma value = 57


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

Energy: 0.512058988048216
Energy: 0.4545928336476736
Energy: 0.5120589880490376
Energy: 0.4545928336476736
Energy: 0.5120589880498593
Energy: 0.4545928336476736
Energy: 0.5463389224718042
Energy: 0.5694110168435661
Energy: 0.5463389224718042
Energy: 0.5694110168435661
Energy: 0.5463389224718042
Energy: 0.5694110168435661
Energy: 0.5425001980857822
Energy: 0.5467054211090004
Energy: 0.5425001980857822
Energy: 0.5467054211081789
Energy: 0.5425001980857822
Energy: 0.5467054211081789
Energy: 0.5243638934735452
Energy: 0.6658123229941988
Energy: 0.5243638934735452
Energy: 0.6658123229950204
Energy: 0.5243638934735452
Energy: 0.6658123229950204
Energy: 0.5424443832528476
Energy: 0.5444931798337015
Energy: 0.5424443832528476
Energy: 0.5444931798337015
Energy: 0.5424443832528476
Energy: 0.5444931798337015
Energy: 0.5462458271656698
Energy: 0.5696749963153661
Energy: 0.5462458271656698
Energy: 0.5696749963137228
Energy: 0.5462458271656698
Energy: 0.5696749963153661
Energy: 0.5120589880506808
Energy: 0.4545928336476736
Energy: 0.5120589880498593
Energy: 0.4545928336476736
Energy: 0.5120589880498593
Energy: 0.4545928336476736
Energy: 0.5463389224726257
Energy: 0.5694110168419229
Energy: 0.5463389224726257
Energy: 0.5694110168419229
Energy: 0.5463389224734474
Energy: 0.5694110168419229
Energy: 0.5425001980849605
Energy: 0.5467054211098221
Energy: 0.5425001980841389
Energy: 0.5467054211090004
Energy: 0.5425001980849605
Energy: 0.5467054211090004
Energy: 0.5243638934719018
Energy: 0.6330633708583767
Energy: 0.5243638934719018
Energy: 0.6330633708583767
Energy: 0.5243638934719018
Energy: 0.6330633708583767
Energy: 0.5424443832528476
Energy: 0.5444931798328799
Energy: 0.5424443832528476
Energy: 0.5444931798328799
Energy: 0.5424443832528476
Energy: 0.5444931798328799
Energy: 0.5462458271656698
Energy: 0.5696749963137228
Energy: 0.5462458271656698
Energy: 0.5696749963145443
Energy: 0.5462458271664915
Energy: 0.5696749963137228
Energy: 0.5120589880490376
Energy: 0.4545928336476736
Energy: 0.5120589880498593
Energy: 0.4545928336476736
Energy: 0.512058988048216
Energy: 0.4545928336476736
Energy: 0.5463389224718042
Energy: 0.5694110168435661
Energy: 0.5463389224718042
Energy: 0.5694110168435661
Energy: 0.5463389224718042
Energy: 0.5694110168435661
Energy: 0.5425001980866038
Energy: 0.5467054211081789
Energy: 0.5425001980857822
Energy: 0.5467054211081789
Energy: 0.5425001980866038
Energy: 0.5467054211081789
Energy: 0.5243638934727234
Energy: 0.5502641631660641
Energy: 0.5243638934735452
Energy: 0.550264163168529
Energy: 0.5243638934735452
Energy: 0.5502641631677073
Energy: 0.5424443832528476
Energy: 0.5444931798337015
Energy: 0.5424443832536692
Energy: 0.5444931798337015
Energy: 0.5424443832528476
Energy: 0.5444931798337015

minimum gb energy = 0.4545928336476736 eV
minimum distance =  2.67194370481002 Angstroms
sigma value = 9


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

Energy: 0.5169336330651177
Energy: 0.5718644331906363
Energy: 0.5169336330657885
Energy: 0.5718644331899655
Energy: 0.5169336330651177
Energy: 0.5718644331899655
Energy: 0.5305681587151592
Energy: 0.560322033389825
Energy: 0.5305681587151592
Energy: 0.560322033389825
Energy: 0.5305681587158301
Energy: 0.560322033389825
Energy: 0.5371571054940468
Energy: 0.518736729330252
Energy: 0.5371571054940468
Energy: 0.518736729330252
Energy: 0.5371571054940468
Energy: 0.518736729330252
Energy: 0.5239501887211725
Energy: 0.5931801248815725
Energy: 0.5239501887205015
Energy: 0.5931801248802613
Energy: 0.5239501887205015
Energy: 0.5931801248802613
Energy: 0.5189007176088328
Energy: 0.5534859297983032
Energy: 0.5189007176088328
Energy: 0.5534859297983032
Energy: 0.5189007176081619
Energy: 0.5534859297983032
Energy: 0.5858430507128002
Energy: 0.5056029517826994
Energy: 0.5858430507128002
Energy: 0.5056029517826994
Energy: 0.585843050713471
Energy: 0.5056029517813578
Energy: 0.5043820478375002
Energy: 0.533183489592223
Energy: 0.504382047838171
Energy: 0.533183489592223
Energy: 0.504382047838171
Energy: 0.533183489592223
Energy: 0.5673787106188829
Energy: 0.5285106484094005
Energy: 0.5673787106182121
Energy: 0.5285106484094005
Energy: 0.5673787106182121
Energy: 0.5285106484094005
Energy: 0.6240238132196139
Energy: 0.5261591211608724
Energy: 0.6240238132196139
Energy: 0.5261591211608724
Energy: 0.6240238132202847
Energy: 0.5261591211608724
Energy: 0.504803242105367
Energy: 0.5401115787640254
Energy: 0.504803242105367
Energy: 0.5401115787640254
Energy: 0.504803242105367
Energy: 0.5401115787640254
Energy: 0.5325280367315897
Energy: 0.5321443318160222
Energy: 0.5325280367315897
Energy: 0.532144331816693
Energy: 0.5325280367309188
Energy: 0.5321443318160222
Energy: 0.5597617627489466
Energy: 0.5090052716005568
Energy: 0.5597617627522705
Energy: 0.5090052716012275
Energy: 0.5597617627496175
Energy: 0.5090052716005568
Energy: 0.506497576755124
Energy: 0.6328726246222355
Energy: 0.506497576755124
Energy: 0.6328726246222355
Energy: 0.506497576755124
Energy: 0.6328726246222355
Energy: 0.521646080230037
Energy: 0.5269437839541943
Energy: 0.5216460802293662
Energy: 0.5269437839541943
Energy: 0.5216460802293662
Energy: 0.5269437839541943
Energy: 0.5716366701300919
Energy: 0.5228355874714748
Energy: 0.5716366701307627
Energy: 0.5228355874721458
Energy: 0.5716366701307627
Energy: 0.5228355874714748
Energy: 0.518363367632162
Energy: 0.560638868412279
Energy: 0.518363367632162
Energy: 0.560638868412279
Energy: 0.5183633676328329
Energy: 0.560638868412279
Energy: 0.5528065126918286
Energy: 0.5581463391225807
Energy: 0.5528065126924995
Energy: 0.5581463391225807
Energy: 0.5528065126918286
Energy: 0.5581463391225807
Energy: 0.632469492535956
Energy: 0.5126446159897424
Energy: 0.632469492535956
Energy: 0.5126446159904132
Energy: 0.632469492535956
Energy: 0.5126446159904132
Energy: 0.5155694576019422
Energy: 0.5298549475482818
Energy: 0.5155694576026132
Energy: 0.5298549475489527
Energy: 0.5155694576019422
Energy: 0.5298549475482818
Energy: 0.5402974110563773
Energy: 0.5457194010638152
Energy: 0.5402974110563773
Energy: 0.5457194010618026
Energy: 0.5402974110563773
Energy: 0.5457194010624734
Energy: 0.5608458401694842
Energy: 0.5079611132092109
Energy: 0.5608458401694842
Energy: 0.5079611132085401
Energy: 0.5608458401701552
Energy: 0.5079611132085401

minimum gb energy = 0.5043820478375002 eV
minimum distance =  2.61888629011836 Angstroms
sigma value = 27


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

Energy: 0.5064185957587874
Energy: 0.568954871594124
Energy: 0.5064185957587874
Energy: 0.568954871594124
Energy: 0.5064185957587874
Energy: 0.568954871594124
Energy: 0.5179725314173593
Energy: 0.5236683709613911
Energy: 0.5179725314167939
Energy: 0.5236683709613911
Energy: 0.5179725314173593
Energy: 0.5236683709613911
Energy: 0.5327060433926958
Energy: 0.4912927813442537
Energy: 0.5327060433921303
Energy: 0.4912927813425572
Energy: 0.5327060433921303
Energy: 0.4912927813425572
Energy: 0.459123956584684
Energy: 0.5095979130665214
Energy: 0.4591239565852495
Energy: 0.5095979130676523
Energy: 0.459123956584684
Energy: 0.5095979130676523
Energy: 0.4870365441768618
Energy: 0.5469126545123775
Energy: 0.4870365441774273
Energy: 0.5469126545123775
Energy: 0.4870365441768618
Energy: 0.546912654511812
Energy: 0.5353643965167995
Energy: 0.4924153816115335
Energy: 0.5353643965162339
Energy: 0.4924153816115335
Energy: 0.5353643965167995
Energy: 0.4924153816115335
Energy: 0.48514652531155616
Energy: 0.551224489084106
Energy: 0.48514652531325264
Energy: 0.5512244890835406
Energy: 0.48514652531212166
Energy: 0.551224489084106
Energy: 0.5027411111062751
Energy: 0.5533276234423993
Energy: 0.502741111107406
Energy: 0.5533276234418338
Energy: 0.5027411111068405
Energy: 0.5533276234418338
Energy: 0.5413332073687412
Energy: 0.4608919095573062
Energy: 0.5413332073693067
Energy: 0.4608919095573062
Energy: 0.5413332073687412
Energy: 0.4608919095567407
Energy: 0.4590836079168631
Energy: 0.5521678861026643
Energy: 0.4590836079162976
Energy: 0.5521678861020989
Energy: 0.4590836079168631
Energy: 0.5521678861026643
Energy: 0.45910605087473777
Energy: 0.6272023332999426
Energy: 0.45910605087473777
Energy: 0.6272023332999426
Energy: 0.45910605087473777
Energy: 0.6272023332999426
Energy: 0.5477238751598142
Energy: 0.4834955183140197
Energy: 0.5477238751598142
Energy: 0.4834955183140197
Energy: 0.5477238751598142
Energy: 0.4834955183134542
Energy: 0.5184518346524348
Energy: 0.5067829583697522
Energy: 0.5184518346524348
Energy: 0.5067829583697522
Energy: 0.5184518346530004
Energy: 0.5067829583691867
Energy: 0.45918740941984776
Energy: 0.5447770441554217
Energy: 0.45918740942041325
Energy: 0.5447770441554217
Energy: 0.45918740941984776
Energy: 0.5447770441554217
Energy: 0.5333865153310224
Energy: 0.4917607916159853
Energy: 0.5333865153315879
Energy: 0.4917607916154198
Energy: 0.5333865153310224
Energy: 0.4917607916154198
Energy: 0.5260236298063382
Energy: 0.5408416677614177
Energy: 0.5260236298057727
Energy: 0.5408416677608523
Energy: 0.5260236298063382
Energy: 0.5408416677602867
Energy: 0.48507820183656375
Energy: 0.5318140437299332
Energy: 0.48507820183543277
Energy: 0.5318140437299332
Energy: 0.48507820183656375
Energy: 0.5318140437299332
Energy: 0.505913188126015
Energy: 0.4989020099813079
Energy: 0.5059131881271459
Energy: 0.49890200998243883
Energy: 0.5059131881282769
Energy: 0.49890200998243883
Energy: 0.5110121195877824
Energy: 0.5001110775625787
Energy: 0.5110121195872168
Energy: 0.5001110775620131
Energy: 0.5110121195877824
Energy: 0.5001110775620131
Energy: 0.5064185957576565
Energy: 0.5689548715901654
Energy: 0.506418595758222
Energy: 0.5689548715901654
Energy: 0.506418595758222
Energy: 0.5689548715901654
Energy: 0.5179725314184903
Energy: 0.5236683709625221
Energy: 0.5179725314184903
Energy: 0.5236683709625221
Energy: 0.5179725314184903
Energy: 0.5236683709625221
Energy: 0.5327060433943922
Energy: 0.49129278134708104
Energy: 0.5327060433943922
Energy: 0.49129278134651555
Energy: 0.5327060433943922
Energy: 0.4912927813442537
Energy: 0.45912395658692035
Energy: 0.5095979130665214
Energy: 0.4591239565863805
Energy: 0.5095979130670869
Energy: 0.4591239565863805
Energy: 0.5095979130676523
Energy: 0.4870365441745999
Energy: 0.546912654511812
Energy: 0.4870365441757309
Energy: 0.546912654511812
Energy: 0.4870365441751654
Energy: 0.546912654511812
Energy: 0.5353643965156685
Energy: 0.49241538161266446
Energy: 0.5353643965156685
Energy: 0.49241538161266446
Energy: 0.5353643965156685
Energy: 0.49241538161266446

minimum gb energy = 0.4590836079162976 eV
minimum distance =  2.64236622194299 Angstroms
sigma value = 19


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

Energy: 0.47557532991259543
Energy: 0.5693598926625171
Energy: 0.4755753299121295
Energy: 0.5693598926634934
Energy: 0.4755753299121295
Energy: 0.5693598926630052
Energy: 0.5320335269935078
Energy: 0.5298123850501035
Energy: 0.5320335269935078
Energy: 0.5298123850496154
Energy: 0.532033526993996
Energy: 0.5298123850501035
Energy: 0.616077125690035
Energy: 0.46780910166038997
Energy: 0.616077125690035
Energy: 0.4678091016599018
Energy: 0.6160771256905232
Energy: 0.4678091016599018
Energy: 0.4657270596346566
Energy: 0.5709934362926279
Energy: 0.4657270596346566
Energy: 0.5709934362931159
Energy: 0.4657270596346566
Energy: 0.5709934362926279
Energy: 0.5109867462618106
Energy: 0.5320126846335579
Energy: 0.5109867462618106
Energy: 0.5320126846335579
Energy: 0.5109867462603465
Energy: 0.5320126846330697
Energy: 0.5586095423507804
Energy: 0.46356292794375437
Energy: 0.5586095423507804
Energy: 0.46356292794375437
Energy: 0.5586095423512686
Energy: 0.46356292794375437
Energy: 0.4823098582189184
Energy: 0.6136610302776647
Energy: 0.48230985821940653
Energy: 0.6136610302776647
Energy: 0.4823098582189184
Energy: 0.6136610302776647
Energy: 0.49778923727182006
Energy: 0.6177818129546077
Energy: 0.49778923727084384
Energy: 0.6177818129541196
Energy: 0.49778923727084384
Energy: 0.6177818129541196
Energy: 0.5827226357200233
Energy: 0.45728831182664353
Energy: 0.5827226357205114
Energy: 0.45728831182664353
Energy: 0.582722635719047
Energy: 0.45728831182713164
Energy: 0.524750124461203
Energy: 0.5108656204397751
Energy: 0.5247501244607148
Energy: 0.5108656204407513
Energy: 0.524750124461691
Energy: 0.5108656204402633
Energy: 0.45814550058481907
Energy: 0.5990617247196139
Energy: 0.45814550058433096
Energy: 0.5990617247196139
Energy: 0.45814550058433096
Energy: 0.5990617247196139
Energy: 0.5838898788298288
Energy: 0.4676099629549375
Energy: 0.5838898788293407
Energy: 0.4676099629554257
Energy: 0.5838898788293407
Energy: 0.4676099629554257
Energy: 0.5448137130712397
Energy: 0.5024187031617352
Energy: 0.5448137130707515
Energy: 0.5024187031622234
Energy: 0.5448137130717278
Energy: 0.502418703161247
Energy: 0.4628240058326114
Energy: 0.5619414769321315
Energy: 0.4628240058326114
Energy: 0.5619414769331077
Energy: 0.4628240058321233
Energy: 0.5619414769326196
Energy: 0.5218078521213568
Energy: 0.4619520097577443
Energy: 0.5218078521203806
Energy: 0.4619520097577443
Energy: 0.5218078521194044
Energy: 0.4619520097582324
Energy: 0.5994470557795089
Energy: 0.457382965308201
Energy: 0.5994470557795089
Energy: 0.457382965308201
Energy: 0.5994470557795089
Energy: 0.457382965308201
Energy: 0.47153615464924364
Energy: 0.5630375341237226
Energy: 0.47153615464826737
Energy: 0.5630375341227463
Energy: 0.47153615464924364
Energy: 0.5630375341232344
Energy: 0.5118119284993443
Energy: 0.5491766559919404
Energy: 0.5118119284993443
Energy: 0.5491766559919404
Energy: 0.5118119284983681
Energy: 0.5491766559914523
Energy: 0.5664742330852827
Energy: 0.46307098597980445
Energy: 0.5664742330852827
Energy: 0.46307098597980445
Energy: 0.5664742330852827
Energy: 0.46307098597980445
Energy: 0.4697579278208893
Energy: 0.585967832081572
Energy: 0.4697579278204012
Energy: 0.585967832081572
Energy: 0.4697579278208893
Energy: 0.585967832081572
Energy: 0.4659588097928396
Energy: 0.6063356843883386
Energy: 0.4659588097923515
Energy: 0.6063356843883386
Energy: 0.4659588097923515
Energy: 0.6063356843883386
Energy: 0.6056136648499199
Energy: 0.46780236729680386
Energy: 0.6056136648499199
Energy: 0.46780236729680386
Energy: 0.6056136648494317
Energy: 0.4678023672963157
Energy: 0.5369709797750983
Energy: 0.507822479313343
Energy: 0.5369709797755864
Energy: 0.5078224793148074
Energy: 0.5369709797760746
Energy: 0.5078224793138312
Energy: 0.4768628060004619
Energy: 0.5751528641600663
Energy: 0.4768628060004619
Energy: 0.5751528641595781
Energy: 0.4768628059999737
Energy: 0.5751528641595781
Energy: 0.581752021836774
Energy: 0.4678535971923417
Energy: 0.581752021836774
Energy: 0.4678535971923417
Energy: 0.581752021836774
Energy: 0.4678535971923417
Energy: 0.53512186583441
Energy: 0.4724087641685554
Energy: 0.5351218658339219
Energy: 0.4724087641685554
Energy: 0.53512186583441
Energy: 0.4724087641685554
Energy: 0.4589567286341606
Energy: 0.5593570782765297
Energy: 0.45895672863367243
Energy: 0.5593570782760415
Energy: 0.4589567286341606
Energy: 0.5593570782765297
Energy: 0.5602164591564419
Energy: 0.4631246519292909
Energy: 0.5602164591564419
Energy: 0.4631246519292909
Energy: 0.5602164591564419
Energy: 0.4631246519292909
Energy: 0.5917770889217129
Energy: 0.4630053418229361
Energy: 0.5917770889207368
Energy: 0.4630053418229361
Energy: 0.5917770889212248
Energy: 0.46300534182342423

minimum gb energy = 0.45728831182664353 eV
minimum distance =  2.62484094910196 Angstroms
sigma value = 101


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

Energy: 0.46044596720359804
Energy: 0.5766936207748187
Energy: 0.46044596720359804
Energy: 0.5766936207748187
Energy: 0.46044596720318853
Energy: 0.5766936207748187
Energy: 0.5483617155115086
Energy: 0.49716688353184585
Energy: 0.5483617155115086
Energy: 0.50236446609078
Energy: 0.5483617155115086
Energy: 0.49716688353227495
Energy: 0.5825197571507976
Energy: 0.44997125967833695
Energy: 0.5825197571507976
Energy: 0.4499712596779079
Energy: 0.5825197571499394
Energy: 0.44997125967833695
Energy: 0.44422796111373963
Energy: 0.6345929816266247
Energy: 0.4442279611141687
Energy: 0.6345929816266247
Energy: 0.44422796111373963
Energy: 0.6345929816266247
Energy: 0.5089709007846629
Energy: 0.5209010880255411
Energy: 0.5089709007855211
Energy: 0.5209010880263993
Energy: 0.5089709007846629
Energy: 0.520901088025112
Energy: 0.5666741987444976
Energy: 0.44270718759818944
Energy: 0.5666741987444976
Energy: 0.44270718759818944
Energy: 0.5666741987444976
Energy: 0.44270718759818944
Energy: 0.45405485054863703
Energy: 0.6529703377575434
Energy: 0.45405485054906614
Energy: 0.6529703377571143
Energy: 0.45405485054863703
Energy: 0.6529703377571143
Energy: 0.44994080228440636
Energy: 0.6540147926537303
Energy: 0.44994080228440636
Energy: 0.6540147926537303
Energy: 0.4499408022839773
Energy: 0.6540147926537303
Energy: 0.5665839482928008
Energy: 0.44410952159871425
Energy: 0.5665839482923716
Energy: 0.44410952159871425
Energy: 0.5665839482928008
Energy: 0.4441095215991433
Energy: 0.5088766209969616
Energy: 0.5464945192825007
Energy: 0.5088766209978196
Energy: 0.5464945192816426
Energy: 0.5088766209978196
Energy: 0.5464945192820717
Energy: 0.44280853689892774
Energy: 0.6221333690073354
Energy: 0.44280853689592414
Energy: 0.6221333690073354
Energy: 0.44280853689806954
Energy: 0.6221333690073354
Energy: 0.6372133370193701
Energy: 0.4870330238654625
Energy: 0.6372133370189411
Energy: 0.4870330238658916
Energy: 0.6372133370193701
Energy: 0.4870330238654625
Energy: 0.5708304709476256
Energy: 0.4497827462621341
Energy: 0.5708304709480547
Energy: 0.4497827462625632
Energy: 0.5708304709484837
Energy: 0.4497827462625632
Energy: 0.4615225658709899
Energy: 0.5968353211169464
Energy: 0.4615225658705609
Energy: 0.5968353211169464
Energy: 0.4615225658705609
Energy: 0.5968353211169464
Energy: 0.5223093414525575
Energy: 0.49460297235880846
Energy: 0.5223093414521283
Energy: 0.4946029723592375
Energy: 0.5223093414529865
Energy: 0.4946029723592375
Energy: 0.5986978823928403
Energy: 0.4513501190227317
Energy: 0.5986978823924112
Energy: 0.4513501190227317
Energy: 0.5986978823928403
Energy: 0.45135011902230265
Energy: 0.4430601245348345
Energy: 0.6453516630121742
Energy: 0.4430601245348345
Energy: 0.6453516630117452
Energy: 0.44306012453311816
Energy: 0.6453516630117452
Energy: 0.44311051046383126
Energy: 0.5206233666014608
Energy: 0.44311051046426037
Energy: 0.520623366602319
Energy: 0.44311051046468947
Energy: 0.520623366602319
Energy: 0.565633278824362
Energy: 0.4441890132488508
Energy: 0.5656332788256493
Energy: 0.44418901324842175
Energy: 0.5656332788265074
Energy: 0.44418901324842175
Energy: 0.4546962473956197
Energy: 0.47567147651893
Energy: 0.4546962473964779
Energy: 0.47567147651893
Energy: 0.45469624739604886
Energy: 0.47567147651807185
Energy: 0.4517270662144034
Energy: 0.6379205459532615
Energy: 0.45172706621483244
Energy: 0.6379205459532615
Energy: 0.4517270662144034
Energy: 0.6379205459532615
Energy: 0.6318983023689113
Energy: 0.44339824057896854
Energy: 0.6318983023689113
Energy: 0.4433982405785395
Energy: 0.6318983023689113
Energy: 0.44339824057896854
Energy: 0.5634394730280812
Energy: 0.4432191946875981
Energy: 0.5634394730285103
Energy: 0.4432191946875981
Energy: 0.5634394730280812
Energy: 0.4432191946875981
Energy: 0.444519162351595
Energy: 0.5699810860781261
Energy: 0.444519162351595
Energy: 0.5699810860785551
Energy: 0.44451916235202404
Energy: 0.5699810860781261
Energy: 0.4816898139632032
Energy: 0.4630816470633713
Energy: 0.48168981396534866
Energy: 0.46308164706294225
Energy: 0.48168981396449045
Energy: 0.4630816470633713
Energy: 0.5714793036650818
Energy: 0.45142338221714207
Energy: 0.5714793036650818
Energy: 0.45142338221714207
Energy: 0.5714793036655108
Energy: 0.45142338221714207
Energy: 0.46063705891099405
Energy: 0.5962632369050154
Energy: 0.46063705891099405
Energy: 0.5962632369045863
Energy: 0.46063705891099405
Energy: 0.5962632369050154
Energy: 0.46078390419950044
Energy: 0.5870422000758043
Energy: 0.46078390420207493
Energy: 0.5870422000753753
Energy: 0.4607839042012168
Energy: 0.5870422000753753
Energy: 0.5700075458799894
Energy: 0.4496297993082682
Energy: 0.5700075458795603
Energy: 0.4496297993078391
Energy: 0.5700075458808476
Energy: 0.4496297993082682
Energy: 0.44304501131257645
Energy: 0.4670027700170807
Energy: 0.4430450113117183
Energy: 0.4670027700157934
Energy: 0.44304501131257645
Energy: 0.4670027700166515
Energy: 0.4432158274120258
Energy: 0.5642463336588598
Energy: 0.4432158274120258
Energy: 0.5642463336584307
Energy: 0.4432158274124549
Energy: 0.5642463336588598
Energy: 0.5723153718400408
Energy: 0.4434408028050477
Energy: 0.5723153718404699
Energy: 0.4434408028046186
Energy: 0.5723153718408989
Energy: 0.4434408028046186
Energy: 0.5356845671665187
Energy: 0.4431522402468029
Energy: 0.5356845671665187
Energy: 0.4431522402463738
Energy: 0.5356845671665187
Energy: 0.4431522402463738

minimum gb energy = 0.44270718759818944 eV
minimum distance =  2.63791507747672 Angstroms
sigma value = 33


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

Energy: 0.011811654726137167
Energy: 0.6781317639558104
Energy: 0.011811654726137167
Energy: 0.6781317639558104
Energy: 0.011811654726137167
Energy: 0.6781317639558104
Energy: 0.012392683962943504
Energy: 0.17551717654598092
Energy: 0.012392683962586996
Energy: 0.17551717654564425
Energy: 0.012392683962586996
Energy: 0.17551717654564425
Energy: 0.8923682143316951
Energy: 0.17601249102482444
Energy: 0.8923682143324081
Energy: 0.17601249102377475
Energy: 0.8923682143327448
Energy: 0.17601249102413125
Energy: 0.012392683962943504
Energy: 0.17551717654495103
Energy: 0.012392683962586996
Energy: 0.1755171765445945
Energy: 0.012392683962943504
Energy: 0.1755171765445945

minimum gb energy = 0.011811654726137167 eV
minimum distance =  2.82883861320811 Angstroms
sigma value = 1