Model name: model_name=EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_AlAgAuCuNiPdPt__MO_115316750986_001
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=3.9946166351437573
cohesive_energy=3.28511992291482
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: -6.30324000329931e-20 eV

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

Energy: 0.010392893158569718
Energy: 0.4463327332720915
Energy: 0.010392893158312884
Energy: 0.4463327332720915
Energy: 0.010392893158569718
Energy: 0.4463327332720915
Energy: 0.4463327332720915
Energy: 0.4235328035851163
Energy: 0.4463327332720915
Energy: 0.4235328035853445
Energy: 0.4463327332720915
Energy: 0.4235328035851163
Energy: 0.010392893158569718
Energy: 0.4463327332720915
Energy: 0.010392893158569718
Energy: 0.4463327332720915
Energy: 0.010392893158569718
Energy: 0.4463327332720915
Energy: 0.4463327332720915
Energy: 0.4235328035851163
Energy: 0.4463327332720915
Energy: 0.4235328035851163
Energy: 0.4463327332720915
Energy: 0.4235328035851163
Energy: 0.010392893158569718
Energy: 0.4463327332720915
Energy: 0.010392893158312884
Energy: 0.4463327332720915
Energy: 0.010392893158569718
Energy: 0.4463327332720915
Energy: 0.4463327332720915
Energy: 0.4235328035853445
Energy: 0.4463327332720915
Energy: 0.4235328035853445
Energy: 0.4463327332720915
Energy: 0.4235328035851163

minimum gb energy = 0.010392893158312884 eV
minimum distance =  2.63641194941919 Angstroms
sigma value = 1


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

Energy: 0.5028700045061143
Energy: 0.4585342107384351
Energy: 0.5028700045061143
Energy: 0.4585342107384351
Energy: 0.5028700045061143
Energy: 0.45853421073905337
Energy: 0.5304291304338311
Energy: 0.4191265414419595
Energy: 0.5304291304344494
Energy: 0.4191265414419595
Energy: 0.5304291304338311
Energy: 0.4191265414419595
Energy: 0.4890492618373709
Energy: 0.4848187593051631
Energy: 0.4890492618373709
Energy: 0.4848187593051631
Energy: 0.4890492618373709
Energy: 0.4848187593051631
Energy: 0.5216512027007841
Energy: 0.4475244720633127
Energy: 0.5216512027007841
Energy: 0.4475244720633127
Energy: 0.5216512027007841
Energy: 0.4475244720633127
Energy: 0.475440118432072
Energy: 0.5004400590718119
Energy: 0.475440118432072
Energy: 0.5004400590718119
Energy: 0.475440118432072
Energy: 0.5004400590718119
Energy: 0.4950441949489272
Energy: 0.4415984133883181
Energy: 0.4950441949489272
Energy: 0.4415984133883181
Energy: 0.4950441949489272
Energy: 0.4415984133883181
Energy: 0.44470197183973226
Energy: 0.5029588772331726
Energy: 0.44470197183973226
Energy: 0.5029588772337907
Energy: 0.44470197183973226
Energy: 0.5029588772331726
Energy: 0.44996022889670895
Energy: 0.5372375509883774
Energy: 0.44996022889670895
Energy: 0.5372375509883774
Energy: 0.44996022889670895
Energy: 0.5372375509883774
Energy: 0.5030708926508982
Energy: 0.49607929305035753
Energy: 0.5030708926508982
Energy: 0.49607929305035753
Energy: 0.5030708926508982
Energy: 0.49607929305035753
Energy: 0.4152930011095654
Energy: 0.5286527759874124
Energy: 0.4152930011095654
Energy: 0.5286527759874124
Energy: 0.4152930011095654
Energy: 0.5286527759874124
Energy: 0.4882912539556832
Energy: 0.4361083354949524
Energy: 0.4882912539556832
Energy: 0.4361083354949524
Energy: 0.4882912539556832
Energy: 0.4361083354949524
Energy: 0.3971126182837391
Energy: 0.5156555031838528
Energy: 0.3971126182837391
Energy: 0.5156555031838528
Energy: 0.3971126182837391
Energy: 0.5156555031838528
Energy: 0.542630967805609
Energy: 0.3936596721811316
Energy: 0.542630967805609
Energy: 0.3936596721811316
Energy: 0.542630967805609
Energy: 0.3936596721811316
Energy: 0.4444791069838627
Energy: 0.4547655478973143
Energy: 0.4444791069838627
Energy: 0.4547655478973143
Energy: 0.4444791069838627
Energy: 0.4547655478973143
Energy: 0.5590625322524497
Energy: 0.4184703819904332
Energy: 0.5590625322524497
Energy: 0.4184703819904332
Energy: 0.5590625322524497
Energy: 0.4184703819904332
Energy: 0.5564386491914571
Energy: 0.4915022112591035
Energy: 0.5564386491914571
Energy: 0.4915022112591035
Energy: 0.5564386491914571
Energy: 0.4915022112591035
Energy: 0.4975420233421282
Energy: 0.48076309844259885
Energy: 0.4975420233421282
Energy: 0.48076309844321713
Energy: 0.4975420233421282
Energy: 0.48076309844321713
Energy: 0.48686540178229526
Energy: 0.4569651728181015
Energy: 0.48686540178167703
Energy: 0.4569651728181015
Energy: 0.48686540178167703
Energy: 0.4569651728181015
Energy: 0.4694698364553587
Energy: 0.44766754787676183
Energy: 0.4694698364547405
Energy: 0.44766754787676183
Energy: 0.4694698364553587
Energy: 0.44766754787676183
Energy: 0.4832542626567443
Energy: 0.4414526322902547
Energy: 0.4832542626567443
Energy: 0.4414526322902547
Energy: 0.4832542626567443
Energy: 0.4414526322902547
Energy: 0.42381629814409316
Energy: 0.5230860173364121
Energy: 0.42381629814409316
Energy: 0.5230860173357939
Energy: 0.42381629814409316
Energy: 0.5230860173357939
Energy: 0.4987400711846527
Energy: 0.49356049524709145
Energy: 0.4987400711846527
Energy: 0.49356049524709145
Energy: 0.4987400711846527
Energy: 0.49356049524709145
Energy: 0.41357125791647675
Energy: 0.5441663625473514
Energy: 0.41357125791647675
Energy: 0.5441663625473514
Energy: 0.41357125791647675
Energy: 0.5441663625473514

minimum gb energy = 0.3936596721811316 eV
minimum distance =  2.60000267873677 Angstroms
sigma value = 33


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

Energy: 0.5285666876878211
Energy: 0.5315744741575452
Energy: 0.5067592313134942
Energy: 0.5315744741575452
Energy: 0.5285666876878211
Energy: 0.5315744741575452
Energy: 0.5148531000337775
Energy: 0.4596372793117102
Energy: 0.5148531000334259
Energy: 0.4596372793117102
Energy: 0.5148531000337775
Energy: 0.4596372793117102
Energy: 0.4209255284945864
Energy: 0.4580625246023645
Energy: 0.42092552849493803
Energy: 0.4580625246027162
Energy: 0.42092552849493803
Energy: 0.4580625246027162
Energy: 0.5319743057947914
Energy: 0.5289391854201629
Energy: 0.5319743057944398
Energy: 0.5289391854201629
Energy: 0.5319743057944398
Energy: 0.5289391854201629
Energy: 0.4814485470193039
Energy: 0.4815954225639784
Energy: 0.4814485470193039
Energy: 0.4815954225639784
Energy: 0.4814485470193039
Energy: 0.4815954225639784
Energy: 0.46447511391940116
Energy: 0.42037627304667063
Energy: 0.46447511391940116
Energy: 0.42037627304667063
Energy: 0.46447511391940116
Energy: 0.42037627304667063
Energy: 0.5354588228972285
Energy: 0.5172022176899507
Energy: 0.5354588228972285
Energy: 0.5172022176899507
Energy: 0.5354588228972285
Energy: 0.5172022176899507
Energy: 0.397133532223836
Energy: 0.5293607672957922
Energy: 0.3971335322241876
Energy: 0.5293607672954406
Energy: 0.3971335322241876
Energy: 0.5293607672957922
Energy: 0.42803158081616516
Energy: 0.4216437926262081
Energy: 0.42803158081616516
Energy: 0.4216437926262081
Energy: 0.42803158081616516
Energy: 0.4216437926262081
Energy: 0.4079267560465217
Energy: 0.4870461342484073
Energy: 0.4079255475662349
Energy: 0.48704613424664905
Energy: 0.4079267560465217
Energy: 0.48704613424313264
Energy: 0.5403933704511207
Energy: 0.4093106045097409
Energy: 0.5403933704511207
Energy: 0.4093106045097409
Energy: 0.5403933704511207
Energy: 0.4093106045097409
Energy: 0.420522623700401
Energy: 0.44673278410502887
Energy: 0.4205233085960862
Energy: 0.44673278410502887
Energy: 0.42052262370004945
Energy: 0.44673278410502887
Energy: 0.5075382433191369
Energy: 0.41726140526828437
Energy: 0.5075382433194885
Energy: 0.41726140526828437
Energy: 0.5075382433184336
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Energy: 0.5109618181750449
Energy: 0.5343083175962073
Energy: 0.5109618181750449
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Energy: 0.5343083175962073
Energy: 0.4838035730235476
Energy: 0.4584611765546757
Energy: 0.4838035730235476
Energy: 0.4584611765546757
Energy: 0.4838035730235476
Energy: 0.4584611765546757
Energy: 0.4202431899026192
Energy: 0.45817793268582174
Energy: 0.4202431899026192
Energy: 0.4581779326854701
Energy: 0.4202431899026192
Energy: 0.45817793268582174
Energy: 0.5463211628717984
Energy: 0.5066643557584448
Energy: 0.5463211628714467
Energy: 0.5066643557584448
Energy: 0.5463211628714467
Energy: 0.5066643557584448
Energy: 0.47869165231733546
Energy: 0.42036769096598886
Energy: 0.47869165231733546
Energy: 0.42036769096598886
Energy: 0.47869165231733546
Energy: 0.42036769096598886
Energy: 0.4665374278397854
Energy: 0.4684102694838056
Energy: 0.4665374278397854
Energy: 0.4684102694838056
Energy: 0.4665374278397854
Energy: 0.46841026948415726
Energy: 0.5324079830038528
Energy: 0.5080601976119159
Energy: 0.5324079830038528
Energy: 0.5080601976122676
Energy: 0.5324079830038528
Energy: 0.5080601976119159
Energy: 0.39705834400934353
Energy: 0.5582273696546042
Energy: 0.39705834400934353
Energy: 0.5582273696546042
Energy: 0.39705834400934353
Energy: 0.5582273696546042
Energy: 0.48037081570732426
Energy: 0.42184067144454346
Energy: 0.48037081570732426
Energy: 0.42184067144454346
Energy: 0.48037081570732426
Energy: 0.42184067144454346
Energy: 0.40745902022996394
Energy: 0.5336113852457571
Energy: 0.4074590067361529
Energy: 0.5336113852461087
Energy: 0.40745902022996394
Energy: 0.5336113852457571
Energy: 0.49043154385888577
Energy: 0.47957582251297554
Energy: 0.49043154385853405
Energy: 0.47957582251297554
Energy: 0.49043154385853405
Energy: 0.47957582251297554
Energy: 0.4246444209157793
Energy: 0.46380573048823126
Energy: 0.4242243962946452
Energy: 0.46380573048858287
Energy: 0.42464442091542765
Energy: 0.46380573048893453
Energy: 0.5287355242281008
Energy: 0.5266887277659905
Energy: 0.5071323050736452
Energy: 0.5266887277663421
Energy: 0.5287355242281008
Energy: 0.5266887277663421
Energy: 0.5288778890279615
Energy: 0.5205789288951308
Energy: 0.5072492229637819
Energy: 0.5205789288951308
Energy: 0.5288778890279615
Energy: 0.5205789288951308
Energy: 0.4206704177712527
Energy: 0.47365305342831515
Energy: 0.4206704177712527
Energy: 0.47365305342831515
Energy: 0.4206704177712527
Energy: 0.47365305342831515
Energy: 0.48353435113798177
Energy: 0.4591461583723969
Energy: 0.4835343511334103
Energy: 0.4591461583723969
Energy: 0.48353435112500276
Energy: 0.4591461583723969
Energy: 0.4075672202589177
Energy: 0.5437154964232978
Energy: 0.4075672202592693
Energy: 0.5437154964232978
Energy: 0.4075672202589177
Energy: 0.5437154964232978
Energy: 0.4793684513505107
Energy: 0.4218016392412104
Energy: 0.4793684513508623
Energy: 0.4218016392412104
Energy: 0.4793684513508623
Energy: 0.4218016392412104
Energy: 0.4164601048578772
Energy: 0.5380444892755193
Energy: 0.4164601048578772
Energy: 0.5380444892755193
Energy: 0.4164601048578772
Energy: 0.5380444892755193
Energy: 0.5328620651253018
Energy: 0.5080529897852168
Energy: 0.5328620651253018
Energy: 0.5080529897848651
Energy: 0.53286206512495
Energy: 0.5080529897848651
Energy: 0.46132866824133095
Energy: 0.4835582639996195
Energy: 0.46132866824133095
Energy: 0.4835582639996195
Energy: 0.46132866824133095
Energy: 0.4835582639996195
Energy: 0.4578502334544241
Energy: 0.42049264535163194
Energy: 0.4578502334544241
Energy: 0.42049264535163194
Energy: 0.4578502334544241
Energy: 0.42049264535163194
Energy: 0.5289892305585467
Energy: 0.5446190379494397
Energy: 0.5289892305585467
Energy: 0.5446190379494397
Energy: 0.5289892305585467
Energy: 0.544619037950143
Energy: 0.4205782441647453
Energy: 0.4781158908285907
Energy: 0.42056642263145416
Energy: 0.4781158908285907
Energy: 0.4205782441647453
Energy: 0.478115890828239
Energy: 0.4685793051301668
Energy: 0.46401450639910047
Energy: 0.4685793051301668
Energy: 0.46401450639945213
Energy: 0.4685793051301668
Energy: 0.46401450639910047
Energy: 0.5109541937432994
Energy: 0.5334348949855287
Energy: 0.5109541937432994
Energy: 0.5334348949858804
Energy: 0.5109541937432994
Energy: 0.5334348949858804
Energy: 0.5293709337041699
Energy: 0.39746968521062
Energy: 0.5293709337041699
Energy: 0.39746968521062
Energy: 0.5293709337041699
Energy: 0.39746968521062
Energy: 0.420538337329386
Energy: 0.42511264618995503
Energy: 0.420538337329386
Energy: 0.42511264619030664
Energy: 0.420538337329386
Energy: 0.42511264618995503

minimum gb energy = 0.39705834400934353 eV
minimum distance =  2.6411219085494 Angstroms
sigma value = 51


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

Energy: 0.4902552846972663
Energy: 0.4950086055420262
Energy: 0.4902552846972663
Energy: 0.4950086055420262
Energy: 0.4902552846972663
Energy: 0.4950086055420262
Energy: 0.5206211325284382
Energy: 0.4493092191094653
Energy: 0.5206211325284382
Energy: 0.4493092191094653
Energy: 0.5206211325284382
Energy: 0.4493092191094653
Energy: 0.4665310689521483
Energy: 0.48093777687708333
Energy: 0.4665310689521483
Energy: 0.48093777687708333
Energy: 0.4665310689521483
Energy: 0.48093777687708333
Energy: 0.4806563810197802
Energy: 0.4065781267166844
Energy: 0.4806563810197802
Energy: 0.40657812671749916
Energy: 0.4806563810197802
Energy: 0.40657812671749916
Energy: 0.48541083457771056
Energy: 0.47426200303342675
Energy: 0.48541083457771056
Energy: 0.47426200303342675
Energy: 0.48541083457771056
Energy: 0.47426200303342675
Energy: 0.4971860014410603
Energy: 0.47406249035988013
Energy: 0.4971860014410603
Energy: 0.47406249035988013
Energy: 0.4971860014410603
Energy: 0.47406249035988013
Energy: 0.4794857961863273
Energy: 0.4740946743342973
Energy: 0.4794857961863273
Energy: 0.4740946743342973
Energy: 0.4794857961863273
Energy: 0.4740946743342973
Energy: 0.44229049857209407
Energy: 0.47429063564694013
Energy: 0.44229049857209407
Energy: 0.47429063564694013
Energy: 0.44229049857209407
Energy: 0.47429063564694013
Energy: 0.5452270786752318
Energy: 0.4049745213736698
Energy: 0.5452270786752318
Energy: 0.4049745213736698
Energy: 0.5452270786752318
Energy: 0.4049745213736698
Energy: 0.41851418035001137
Energy: 0.5447962072853254
Energy: 0.41851418035001137
Energy: 0.5447962072853254
Energy: 0.41851418035001137
Energy: 0.5447962072853254
Energy: 0.4997646974407317
Energy: 0.4102102561689299
Energy: 0.4997646974407317
Energy: 0.4102102561689299
Energy: 0.49976469743991697
Energy: 0.4102102561689299
Energy: 0.4913205682061208
Energy: 0.49576382176080797
Energy: 0.4913205682061208
Energy: 0.49576382176080797
Energy: 0.4913205682061208
Energy: 0.49576382176080797
Energy: 0.51850480524488
Energy: 0.443181272285896
Energy: 0.51850480524488
Energy: 0.443181272285896
Energy: 0.51850480524488
Energy: 0.443181272285896
Energy: 0.46651051116436093
Energy: 0.45436911919517825
Energy: 0.46651051116436093
Energy: 0.45436911919517825
Energy: 0.46651051116436093
Energy: 0.45436911919517825
Energy: 0.47678120095277926
Energy: 0.48991003136697203
Energy: 0.47678120095277926
Energy: 0.48991003136697203
Energy: 0.47678120095277926
Energy: 0.48991003136697203
Energy: 0.48550809373416337
Energy: 0.4740588874073403
Energy: 0.48550809373416337
Energy: 0.4740588874073403
Energy: 0.48550809373416337
Energy: 0.4740588874073403
Energy: 0.48599534188400634
Energy: 0.517619041891548
Energy: 0.48599534188400634
Energy: 0.517619041891548
Energy: 0.48599534188400634
Energy: 0.517619041891548
Energy: 0.47918727583904486
Energy: 0.4764858080738152
Energy: 0.4791872758398596
Energy: 0.4764858080738152
Energy: 0.47918727583904486
Energy: 0.4764858080738152

minimum gb energy = 0.4049745213736698 eV
minimum distance =  2.51663148765308 Angstroms
sigma value = 19


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

Energy: 0.40021883574219963
Energy: 0.39603656914034724
Energy: 0.40021883574219963
Energy: 0.39603656914034724
Energy: 0.40021883574219963
Energy: 0.39603656914034724
Energy: 0.4389470844216944
Energy: 0.4899711161403263
Energy: 0.4389470844216944
Energy: 0.4899711161403263
Energy: 0.4389470844216944
Energy: 0.4899711161408096
Energy: 0.3740630812966882
Energy: 0.4892474577758516
Energy: 0.37406308129620486
Energy: 0.4892474577758516
Energy: 0.3740630812966882
Energy: 0.4892474577758516
Energy: 0.41817492789637073
Energy: 0.37637136330614607
Energy: 0.41817492789637073
Energy: 0.37637136330614607
Energy: 0.41817492789637073
Energy: 0.37637136330614607
Energy: 0.3901923548336441
Energy: 0.39840925662668664
Energy: 0.3901923548336441
Energy: 0.39840925662668664
Energy: 0.3901923548336441
Energy: 0.39840925662668664
Energy: 0.390124857793522
Energy: 0.39831616411019066
Energy: 0.390124857793522
Energy: 0.39831616411019066
Energy: 0.390124857793522
Energy: 0.39831616411019066
Energy: 0.41816423938119146
Energy: 0.37417502093426774
Energy: 0.41816423938119146
Energy: 0.37417502093426774
Energy: 0.41816423938119146
Energy: 0.37417502093426774
Energy: 0.37406166065932295
Energy: 0.48935215094115664
Energy: 0.37406166065932295
Energy: 0.4893521509416399
Energy: 0.37406166065932295
Energy: 0.4893521509416399
Energy: 0.43891940146167946
Energy: 0.4898899381240534
Energy: 0.43891940146167946
Energy: 0.4898899381240534
Energy: 0.4389194014611962
Energy: 0.4898899381240534
Energy: 0.40021883574219963
Energy: 0.39603656914034724
Energy: 0.40021883574219963
Energy: 0.39603656914034724
Energy: 0.40021883574219963
Energy: 0.39603656914034724
Energy: 0.4389470844216944
Energy: 0.4899711161403263
Energy: 0.4389470844216944
Energy: 0.4899711161408096
Energy: 0.4389470844216944
Energy: 0.4899711161403263
Energy: 0.3740630812966882
Energy: 0.4892474577758516
Energy: 0.37406308129620486
Energy: 0.4892474577758516
Energy: 0.3740630812966882
Energy: 0.4892474577758516
Energy: 0.41817492789637073
Energy: 0.37637136330614607
Energy: 0.41817492789637073
Energy: 0.37637136330614607
Energy: 0.41817492789637073
Energy: 0.37637136330614607
Energy: 0.3901923548331608
Energy: 0.39840925662668664
Energy: 0.3901923548336441
Energy: 0.39840925662668664
Energy: 0.3901923548336441
Energy: 0.39840925662668664
Energy: 0.390124857793522
Energy: 0.39831616411019066
Energy: 0.390124857793522
Energy: 0.39831616411019066
Energy: 0.390124857793522
Energy: 0.39831616411019066
Energy: 0.4181642393816748
Energy: 0.37417502093426774
Energy: 0.4181642393816748
Energy: 0.37417502093426774
Energy: 0.41816423938119146
Energy: 0.37417502093426774
Energy: 0.37406166065932295
Energy: 0.4893521509416399
Energy: 0.37406166065932295
Energy: 0.48935215094115664
Energy: 0.37406166065932295
Energy: 0.4893521509416399
Energy: 0.43891940146167946
Energy: 0.4898899381240534
Energy: 0.43891940146167946
Energy: 0.4898899381240534
Energy: 0.43891940146167946
Energy: 0.4898899381240534
Energy: 0.40021883574219963
Energy: 0.39603656914034724
Energy: 0.40021883574219963
Energy: 0.39603656914034724
Energy: 0.40021883574219963
Energy: 0.39603656914034724
Energy: 0.4389470844216944
Energy: 0.4899711161403263
Energy: 0.4389470844216944
Energy: 0.4899711161403263
Energy: 0.43894708442121105
Energy: 0.4899711161403263
Energy: 0.37406308129620486
Energy: 0.4892474577758516
Energy: 0.37406308129620486
Energy: 0.4892474577758516
Energy: 0.37406308129620486
Energy: 0.4892474577758516
Energy: 0.41817492789637073
Energy: 0.37637136330614607
Energy: 0.41817492789637073
Energy: 0.37637136330614607
Energy: 0.41817492789637073
Energy: 0.37637136330614607
Energy: 0.3901923548336441
Energy: 0.39840925662668664
Energy: 0.3901923548336441
Energy: 0.39840925662668664
Energy: 0.3901923548336441
Energy: 0.39840925662668664
Energy: 0.390124857793522
Energy: 0.39831616411019066
Energy: 0.390124857793522
Energy: 0.39831616411019066
Energy: 0.390124857793522
Energy: 0.3983161641097073
Energy: 0.41816423938119146
Energy: 0.37417502093426774
Energy: 0.41816423938119146
Energy: 0.37417502093426774
Energy: 0.4181642393816748
Energy: 0.37417502093426774
Energy: 0.37406166065932295
Energy: 0.4893521509416399
Energy: 0.37406166065932295
Energy: 0.4893521509416399
Energy: 0.37406166065932295
Energy: 0.48935215094115664
Energy: 0.43891940146167946
Energy: 0.4898899381240534
Energy: 0.4389194014611962
Energy: 0.4898899381240534
Energy: 0.43891940146167946
Energy: 0.4898899381240534
Energy: 0.40021883574219963
Energy: 0.39603656914034724
Energy: 0.40021883574219963
Energy: 0.39603656914034724
Energy: 0.40021883574219963
Energy: 0.39603656914034724
Energy: 0.4389470844216944
Energy: 0.4899711161408096
Energy: 0.4389470844216944
Energy: 0.4899711161403263
Energy: 0.4389470844216944
Energy: 0.4899711161403263
Energy: 0.3740630812966882
Energy: 0.4892474577758516
Energy: 0.37406308129620486
Energy: 0.4892474577758516
Energy: 0.3740630812966882
Energy: 0.4892474577758516

minimum gb energy = 0.37406166065932295 eV
minimum distance =  2.53689060737761 Angstroms
sigma value = 27


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

Energy: 0.39795984858303574
Energy: 0.3812870515102367
Energy: 0.39795984858303574
Energy: 0.3812870515102367
Energy: 0.39795984858303574
Energy: 0.3812870515102367
Energy: 0.4454856039889438
Energy: 0.3957847193035198
Energy: 0.4454856039889438
Energy: 0.3957847193035198
Energy: 0.4454856039889438
Energy: 0.3957847193035198
Energy: 0.36239324881067314
Energy: 0.4397271192190579
Energy: 0.36239324881067314
Energy: 0.4397271192190579
Energy: 0.36239324881067314
Energy: 0.4397271192190579
Energy: 0.4374011717547603
Energy: 0.37428007766095645
Energy: 0.4374011717547603
Energy: 0.37428007766095645
Energy: 0.4374011717547603
Energy: 0.3742800776621403
Energy: 0.43579476955088664
Energy: 0.37099559584810915
Energy: 0.4357947695449676
Energy: 0.37099559584810915
Energy: 0.4357947695461513
Energy: 0.37099559584810915
Energy: 0.44623801497573634
Energy: 0.4655783440505932
Energy: 0.44623801497573634
Energy: 0.4655783440505932
Energy: 0.44623801497573634
Energy: 0.4655783440505932
Energy: 0.37264440965441564
Energy: 0.39724318960184113
Energy: 0.37264440965441564
Energy: 0.39724318960184113
Energy: 0.37264440965441564
Energy: 0.39724318960184113
Energy: 0.39836787294107606
Energy: 0.3828669833842047
Energy: 0.39836787294107606
Energy: 0.3828669833842047
Energy: 0.3983678729422599
Energy: 0.3828669833842047
Energy: 0.44560951717983527
Energy: 0.3882000869867917
Energy: 0.44560951717983527
Energy: 0.3882000870211227
Energy: 0.44560951717983527
Energy: 0.38820008672409007
Energy: 0.42479149646693176
Energy: 0.456641052907334
Energy: 0.42479149646693176
Energy: 0.456641052907334
Energy: 0.42479149646693176
Energy: 0.456641052907334
Energy: 0.41064199761183395
Energy: 0.3719328914927067
Energy: 0.41064199761183395
Energy: 0.3719328914927067
Energy: 0.41064199761183395
Energy: 0.3719328914927067
Energy: 0.46665603896168617
Energy: 0.43211402284569556
Energy: 0.46665603896168617
Energy: 0.43211402284569556
Energy: 0.46665603896168617
Energy: 0.43211402284569556

minimum gb energy = 0.36239324881067314 eV
minimum distance =  2.51798294435766 Angstroms
sigma value = 9


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

Energy: 0.40129796711749377
Energy: 0.35419766684438714
Energy: 0.40129796711749377
Energy: 0.3541976668447198
Energy: 0.40129796711749377
Energy: 0.35419766684438714
Energy: 0.3770211324536266
Energy: 0.3723723845510225
Energy: 0.3770211324522961
Energy: 0.35486536178625483
Energy: 0.3770211324526287
Energy: 0.35486536178625483
Energy: 0.3414419988258997
Energy: 0.3859908050650614
Energy: 0.3414419988258997
Energy: 0.3859908050650614
Energy: 0.3414419988258997
Energy: 0.3859908050650614
Energy: 0.35540637844632716
Energy: 0.3490425264444237
Energy: 0.35540637844632716
Energy: 0.3490425264444237
Energy: 0.35540637844632716
Energy: 0.3490425264444237
Energy: 0.36201179884317314
Energy: 0.35382298408676555
Energy: 0.36201179884317314
Energy: 0.35382298408709817
Energy: 0.36201179884317314
Energy: 0.35382298408709817
Energy: 0.3839332884683074
Energy: 0.40898452359607246
Energy: 0.3839332884683074
Energy: 0.3780382977522521
Energy: 0.3839332884683074
Energy: 0.3780382977522521
Energy: 0.36656694267640727
Energy: 0.3800882863718638
Energy: 0.36656694267640727
Energy: 0.3800882863718638
Energy: 0.36656694267640727
Energy: 0.3800882863718638
Energy: 0.3358141971557614
Energy: 0.36600114424709573
Energy: 0.335814197156094
Energy: 0.36600114424709573
Energy: 0.335814197156094
Energy: 0.36600114424709573
Energy: 0.3747768789071492
Energy: 0.3539149783804448
Energy: 0.3747768789071492
Energy: 0.3539149783804448
Energy: 0.37477687890648403
Energy: 0.3539149783804448
Energy: 0.3597280130965608
Energy: 0.43411391840202807
Energy: 0.35972801309622815
Energy: 0.43411391840202807
Energy: 0.35972801309622815
Energy: 0.4341139184023607
Energy: 0.35619883180207723
Energy: 0.3470403317094572
Energy: 0.35619883180207723
Energy: 0.3470403317094572
Energy: 0.35619883180207723
Energy: 0.3470403317094572
Energy: 0.3615018211710723
Energy: 0.38905380892543606
Energy: 0.3615018211710723
Energy: 0.4134421049779264
Energy: 0.3615018211710723
Energy: 0.38905380892510344
Energy: 0.37719409749178195
Energy: 0.36882352007808145
Energy: 0.37719409749178195
Energy: 0.3688235200777489
Energy: 0.37719409749178195
Energy: 0.3688235200777489
Energy: 0.40735001381503516
Energy: 0.4152288788332876
Energy: 0.40735001381503516
Energy: 0.4152288788332876
Energy: 0.40735001381503516
Energy: 0.4152288788332876
Energy: 0.34988010179879525
Energy: 0.3725535349663512
Energy: 0.3498801017991279
Energy: 0.3725535349663512
Energy: 0.3498801017991279
Energy: 0.3725535349663512
Energy: 0.345962854385896
Energy: 0.3665942180968823
Energy: 0.34596285438656127
Energy: 0.3665942180968823
Energy: 0.34596285438622865
Energy: 0.3665942180968823
Energy: 0.4428453093595899
Energy: 0.34389995192944023
Energy: 0.4428453093592572
Energy: 0.34389995192944023
Energy: 0.4428453093595899
Energy: 0.34389995192944023
Energy: 0.35458944390589187
Energy: 0.35892854861102164
Energy: 0.35458944390589187
Energy: 0.35892854861102164
Energy: 0.35458944390589187
Energy: 0.35892854861068896
Energy: 0.3368319546469707
Energy: 0.43178536687768665
Energy: 0.3368319546469707
Energy: 0.43178536687768665
Energy: 0.3368319546469707
Energy: 0.43178536687768665
Energy: 0.4092176618675603
Energy: 0.3538224974017196
Energy: 0.40921766186689507
Energy: 0.33339849161263185
Energy: 0.40921766186722763
Energy: 0.33339849161263185
Energy: 0.3368327162058006
Energy: 0.43192044356490616
Energy: 0.3368327162058006
Energy: 0.43192044356490616
Energy: 0.3368327162058006
Energy: 0.4319204435645735
Energy: 0.35459580875217067
Energy: 0.35890838958176025
Energy: 0.35459580875217067
Energy: 0.35890838958176025
Energy: 0.35459580875217067
Energy: 0.35890838958176025
Energy: 0.4428929692856914
Energy: 0.34393208320925384
Energy: 0.4428929692856914
Energy: 0.34393208320925384
Energy: 0.4428929692856914
Energy: 0.34393208320925384
Energy: 0.3453831030676343
Energy: 0.39180355822961876
Energy: 0.3453831030676343
Energy: 0.39180355822961876
Energy: 0.3453831030676343
Energy: 0.3918035582292862
Energy: 0.3498012642498766
Energy: 0.37252909065688544
Energy: 0.3498012642498766
Energy: 0.37252909065688544
Energy: 0.3498012642498766
Energy: 0.37252909065688544
Energy: 0.39888195490154005
Energy: 0.3768184881195881
Energy: 0.3988819549008748
Energy: 0.3768184881189228
Energy: 0.3988819549012075
Energy: 0.3768184881189228
Energy: 0.3774400096030127
Energy: 0.3703392521684502
Energy: 0.3774400096030127
Energy: 0.3703392521684502
Energy: 0.3774400096030127
Energy: 0.3703392521684502
Energy: 0.36161750168346984
Energy: 0.3744445560717244
Energy: 0.36161750168346984
Energy: 0.3744445560717244
Energy: 0.3616175016831373
Energy: 0.3744445560713918
Energy: 0.3562770511379971
Energy: 0.3469870549413866
Energy: 0.3562770511379971
Energy: 0.3469870549413866
Energy: 0.3562770511379971
Energy: 0.3469870549413866
Energy: 0.35979628933531804
Energy: 0.3652785756847529
Energy: 0.35979628933531804
Energy: 0.36527857568508554
Energy: 0.35979628933531804
Energy: 0.3652785756857508
Energy: 0.3751276725955002
Energy: 0.3537403471508263
Energy: 0.3751276725955002
Energy: 0.35374034715115893
Energy: 0.3751276725955002
Energy: 0.3537403471508263
Energy: 0.33582707353259894
Energy: 0.3661764690426542
Energy: 0.33582707353259894
Energy: 0.3661764690426542
Energy: 0.33582707353259894
Energy: 0.3661764690426542
Energy: 0.36648859405352835
Energy: 0.38002145221076256
Energy: 0.36648859405352835
Energy: 0.38002145221076256
Energy: 0.36648859405352835
Energy: 0.38002145221076256
Energy: 0.38394149613899986
Energy: 0.37357662983169304
Energy: 0.38394149613899986
Energy: 0.37357662983169304
Energy: 0.38394149613899986
Energy: 0.37357662983169304
Energy: 0.3620145289963973
Energy: 0.35378084461779363
Energy: 0.3620145289963973
Energy: 0.35378084461779363
Energy: 0.3620145289963973
Energy: 0.353780844617461
Energy: 0.35538185827651375
Energy: 0.34903168847415444
Energy: 0.35538185827651375
Energy: 0.34903168847415444
Energy: 0.35538185827651375
Energy: 0.34903168847415444
Energy: 0.34214473168440646
Energy: 0.38596048239527075
Energy: 0.34214473168440646
Energy: 0.38596048239527075
Energy: 0.34214473168440646
Energy: 0.38596048239527075
Energy: 0.376996570086997
Energy: 0.33876554834515765
Energy: 0.37699657008666443
Energy: 0.33876554834515765
Energy: 0.37699657008732973
Energy: 0.33876554834515765
Energy: 0.40129796711749377
Energy: 0.35419766684438714
Energy: 0.40129796711749377
Energy: 0.35419766684438714
Energy: 0.40129796711749377
Energy: 0.3541976668447198
Energy: 0.3770211324522961
Energy: 0.35486536178625483
Energy: 0.377021132453294
Energy: 0.35486536178625483
Energy: 0.3770211324522961
Energy: 0.35486536178625483
Energy: 0.3414419988258997
Energy: 0.38599080506539396
Energy: 0.3414419988258997
Energy: 0.38599080506539396
Energy: 0.3414419988258997
Energy: 0.3859908050650614
Energy: 0.35540637844599454
Energy: 0.3490425264444237
Energy: 0.35540637844632716
Energy: 0.3490425264444237
Energy: 0.35540637844632716
Energy: 0.3490425264444237
Energy: 0.36201179884317314
Energy: 0.35382298408676555
Energy: 0.36201179884317314
Energy: 0.35382298408709817
Energy: 0.36201179884317314
Energy: 0.35382298408709817

minimum gb energy = 0.33339849161263185 eV
minimum distance =  2.59671728574234 Angstroms
sigma value = 57


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

Energy: 0.3327365679040255
Energy: 0.3089520962578934
Energy: 0.18671620886112572
Energy: 0.3089520962578934
Energy: 0.3327365679040255
Energy: 0.3089520962578934
Energy: 0.3498765221034572
Energy: 0.30549672061754996
Energy: 0.3498765221034572
Energy: 0.30528818021541976
Energy: 0.3498765221034572
Energy: 0.30549672061754996
Energy: 0.32668824522477025
Energy: 0.3133306576430603
Energy: 0.326688245224013
Energy: 0.3046439046372539
Energy: 0.326688245224013
Energy: 0.3133306576438175
Energy: 0.3106399590201161
Energy: 0.263788028566656
Energy: 0.3106399590201161
Energy: 0.19036476927475693
Energy: 0.3106399590201161
Energy: 0.263788028566656
Energy: 0.22834028510183696
Energy: 0.350299350803211
Energy: 0.22834028510183696
Energy: 0.350299350803211
Energy: 0.22834028510183696
Energy: 0.350299350803211
Energy: 0.18654893525594138
Energy: 0.3260936836100352
Energy: 0.18654893525594138
Energy: 0.3260936836100352
Energy: 0.18654893525594138
Energy: 0.3260936836100352
Energy: 0.18666816239817263
Energy: 0.20609077584874116
Energy: 0.18666816239817263
Energy: 0.20609077584874116
Energy: 0.18666816239817263
Energy: 0.20609077584874116
Energy: 0.34970474074836433
Energy: 0.22901096506713853
Energy: 0.34970474074836433
Energy: 0.22901096506713853
Energy: 0.34970474074836433
Energy: 0.22901096506713853
Energy: 0.3109351122235555
Energy: 0.19033749551330617
Energy: 0.3109351122235555
Energy: 0.26377047570218654
Energy: 0.3109351122235555
Energy: 0.19033749551330617
Energy: 0.20696517961750957
Energy: 0.3509070530828172
Energy: 0.20696517961750957
Energy: 0.3509070530828172
Energy: 0.20696517961750957
Energy: 0.3509070530828172
Energy: 0.2284842760431498
Energy: 0.3057958254477391
Energy: 0.2284842760431498
Energy: 0.3057958254477391
Energy: 0.2284842760423927
Energy: 0.3057958254477391
Energy: 0.3327365679040255
Energy: 0.3089520962578934
Energy: 0.18671620886112572
Energy: 0.3089520962578934
Energy: 0.3327365679040255
Energy: 0.3089520962578934
Energy: 0.3498765221034572
Energy: 0.30549672061754996
Energy: 0.3498765221034572
Energy: 0.30528818021541976
Energy: 0.3498765221034572
Energy: 0.30549672061754996
Energy: 0.326688245224013
Energy: 0.3133306576430603
Energy: 0.326688245224013
Energy: 0.30464390464936875
Energy: 0.326688245224013
Energy: 0.3133306576430603
Energy: 0.3106399590201161
Energy: 0.263788028566656
Energy: 0.3106399590201161
Energy: 0.19036476927475693
Energy: 0.3106399590201161
Energy: 0.263788028566656
Energy: 0.22834028510183696
Energy: 0.350299350803211
Energy: 0.22834028510183696
Energy: 0.350299350803211
Energy: 0.22834028510183696
Energy: 0.350299350803211
Energy: 0.18654893525594138
Energy: 0.3260936836100352
Energy: 0.18654893525594138
Energy: 0.3260936836100352
Energy: 0.18654893525594138
Energy: 0.3260936836100352
Energy: 0.18666816239817263
Energy: 0.20609077584874116
Energy: 0.18666816239817263
Energy: 0.20609077584874116
Energy: 0.18666816239817263
Energy: 0.20609077584874116
Energy: 0.34970474074836433
Energy: 0.22901096506713853
Energy: 0.34970474074836433
Energy: 0.22901096506713853
Energy: 0.34970474074836433
Energy: 0.22901096506713853

minimum gb energy = 0.18654893525594138 eV
minimum distance =  2.66529247802655 Angstroms
sigma value = 11


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

Energy: 0.3081303007656015
Energy: 0.38551332558732276
Energy: 0.3081303007656015
Energy: 0.38551332558732276
Energy: 0.3081303007656015
Energy: 0.38551332558732276
Energy: 0.3761052707697802
Energy: 0.32197324865443083
Energy: 0.3761052707697802
Energy: 0.32197324865443083
Energy: 0.3761052707697802
Energy: 0.32197324865443083
Energy: 0.3824373500148156
Energy: 0.4218327530629222
Energy: 0.3824373500148156
Energy: 0.4218327530629222
Energy: 0.3824373500148156
Energy: 0.4218327530629222
Energy: 0.39828017519951575
Energy: 0.28926656542727247
Energy: 0.39828017519896114
Energy: 0.28926656542727247
Energy: 0.39828017519951575
Energy: 0.28926656542727247
Energy: 0.3691168698634171
Energy: 0.2810207620565114
Energy: 0.3691168698634171
Energy: 0.2810207620565114
Energy: 0.3691168698634171
Energy: 0.2810207620565114
Energy: 0.29847839047220787
Energy: 0.2849777863899217
Energy: 0.29847839047276253
Energy: 0.2849777863899217
Energy: 0.29847839047220787
Energy: 0.28497778638936705
Energy: 0.2743829138538466
Energy: 0.29784910057263925
Energy: 0.2743829138538466
Energy: 0.29784910057263925
Energy: 0.2743829138538466
Energy: 0.29784910057263925
Energy: 0.33455841026594435
Energy: 0.2688118590514118
Energy: 0.334558410266499
Energy: 0.26881185905196653
Energy: 0.334558410266499
Energy: 0.26881185905196653
Energy: 0.389183521483057
Energy: 0.2712228267713777
Energy: 0.389183521483057
Energy: 0.2712228267713777
Energy: 0.389183521483057
Energy: 0.2712228267713777
Energy: 0.2728351052493437
Energy: 0.39767876893667625
Energy: 0.2728351052498983
Energy: 0.39767876893667625
Energy: 0.2728351052498983
Energy: 0.39767876893667625
Energy: 0.30038042810788007
Energy: 0.3632513235111032
Energy: 0.3003804281128719
Energy: 0.3632513235111032
Energy: 0.3003804281145358
Energy: 0.3632513235111032
Energy: 0.3299663764879116
Energy: 0.27994101673289934
Energy: 0.3299663764879116
Energy: 0.279941016733454
Energy: 0.3299663764879116
Energy: 0.279941016733454
Energy: 0.33622034030447334
Energy: 0.2911731747141482
Energy: 0.33622034030447334
Energy: 0.2911731747141482
Energy: 0.33622034030447334
Energy: 0.2911731747141482
Energy: 0.37793409050550014
Energy: 0.40997023193286125
Energy: 0.37793409050550014
Energy: 0.40997023193286125
Energy: 0.37793409050605475
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Energy: 0.3813918528561331
Energy: 0.27775937458036276
Energy: 0.3813918528561331
Energy: 0.27775937457980815
Energy: 0.3813918528561331
Energy: 0.27775937458036276
Energy: 0.30429169496722924
Energy: 0.38508889631863297
Energy: 0.30429169496722924
Energy: 0.38508889631863297
Energy: 0.30429169496722924
Energy: 0.38508889631863297
Energy: 0.34003447590052255
Energy: 0.3261338309938084
Energy: 0.34003447590052255
Energy: 0.326133830994363
Energy: 0.34003447590052255
Energy: 0.3261338309938084
Energy: 0.44009008941105693
Energy: 0.3122846902993137
Energy: 0.440090089409393
Energy: 0.31228469030375094
Energy: 0.44009008941050226
Energy: 0.31228469030153233
Energy: 0.3479434359522328
Energy: 0.2883023911786647
Energy: 0.3479434359522328
Energy: 0.28830239117977396
Energy: 0.3479434359522328
Energy: 0.28830239117921935
Energy: 0.32974158480246263
Energy: 0.3436383050508095
Energy: 0.32974158480246263
Energy: 0.3436383050508095
Energy: 0.32974158480246263
Energy: 0.3436383050508095
Energy: 0.27309187192162043
Energy: 0.28592236947459676
Energy: 0.27309187192162043
Energy: 0.28592236947459676
Energy: 0.27309187192162043
Energy: 0.28592236947459676
Energy: 0.2852387976207002
Energy: 0.2998956602904789
Energy: 0.2852387976207002
Energy: 0.29989566028992426
Energy: 0.2852387976218095
Energy: 0.2998956602904789
Energy: 0.3358295028212249
Energy: 0.33824240252462856
Energy: 0.3358295028212249
Energy: 0.33824240252462856
Energy: 0.3358295028212249
Energy: 0.33824240252407395
Energy: 0.38795100031221835
Energy: 0.3272311311231962
Energy: 0.38795100031221835
Energy: 0.32723113112264157
Energy: 0.38795100031221835
Energy: 0.32723113112264157
Energy: 0.27322531211118417
Energy: 0.39783153561684076
Energy: 0.27322531211118417
Energy: 0.39783153561684076
Energy: 0.27322531211118417
Energy: 0.39783153561684076
Energy: 0.5194823341226459
Energy: 0.36124774971488044
Energy: 0.5194823341226459
Energy: 0.36124774971488044
Energy: 0.5194823341226459
Energy: 0.36124774971488044

minimum gb energy = 0.2688118590514118 eV
minimum distance =  2.58196664236585 Angstroms
sigma value = 41


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

Energy: 0.3392383580523175
Energy: 0.3101571617176519
Energy: 0.3392383580523175
Energy: 0.3101571617176519
Energy: 0.3392383580527546
Energy: 0.3101571617176519
Energy: 0.3252321158023828
Energy: 0.3212221862865018
Energy: 0.32523211580281997
Energy: 0.3212221862865018
Energy: 0.3252321158023828
Energy: 0.3212221862878133
Energy: 0.3625857757911992
Energy: 0.3406387904302106
Energy: 0.3625857757916364
Energy: 0.3406387904302106
Energy: 0.3625857757911992
Energy: 0.3406387904302106
Energy: 0.32343272080939056
Energy: 0.30600502522303097
Energy: 0.32343272080982766
Energy: 0.30600502522303097
Energy: 0.32343272080982766
Energy: 0.30600502522303097
Energy: 0.29692314391937985
Energy: 0.3253928277893755
Energy: 0.29692314391937985
Energy: 0.3253928277893755
Energy: 0.29692314391937985
Energy: 0.3253928277898127
Energy: 0.31973376869321984
Energy: 0.30912068363770306
Energy: 0.31973376869321984
Energy: 0.30912068363770306
Energy: 0.31973376869321984
Energy: 0.30912068363770306
Energy: 0.29580082564004173
Energy: 0.4408543971966859
Energy: 0.2958008256404789
Energy: 0.4408543971966859
Energy: 0.29580082564004173
Energy: 0.4408543971966859
Energy: 0.2855340248427721
Energy: 0.3060612747181274
Energy: 0.2855340248427721
Energy: 0.3060612747181274
Energy: 0.2855340248427721
Energy: 0.3060612747181274
Energy: 0.3033474829067416
Energy: 0.32389027491516803
Energy: 0.3033474829063044
Energy: 0.32389027491516803
Energy: 0.3033474829063044
Energy: 0.32389027491516803
Energy: 0.31952574863288685
Energy: 0.32216994848943037
Energy: 0.31952574863288685
Energy: 0.32216994848943037
Energy: 0.31952574863288685
Energy: 0.32216994848943037
Energy: 0.31730919462528234
Energy: 0.32058732851355337
Energy: 0.31730919462528234
Energy: 0.32058732851355337
Energy: 0.31730919462528234
Energy: 0.32058732851311617
Energy: 0.28524272975666864
Energy: 0.3763007725630193
Energy: 0.28524272975666864
Energy: 0.3763007725630193
Energy: 0.28524272975666864
Energy: 0.3763007725625821
Energy: 0.2857139771776216
Energy: 0.3022840039706452
Energy: 0.2857139771776216
Energy: 0.3022840039702081
Energy: 0.2857139771776216
Energy: 0.3022840039706452
Energy: 0.2791545808926658
Energy: 0.32157782009170827
Energy: 0.2791545808926658
Energy: 0.32157782009170827
Energy: 0.2791545808926658
Energy: 0.32157782009170827
Energy: 0.3173983460219011
Energy: 0.3061966460955351
Energy: 0.3173983460219011
Energy: 0.30619664609640934
Energy: 0.3173983460214639
Energy: 0.30619664609640934
Energy: 0.277125112993506
Energy: 0.35571909526252316
Energy: 0.277125112993506
Energy: 0.3015063488733315
Energy: 0.277125112993506
Energy: 0.3015063488728943
Energy: 0.2865922334016048
Energy: 0.29775969662847235
Energy: 0.2865922334016048
Energy: 0.29775969662847235
Energy: 0.2865922334016048
Energy: 0.29775969662847235
Energy: 0.4122203688173409
Energy: 0.3419309280911409
Energy: 0.4122203688173409
Energy: 0.34193092809070375
Energy: 0.4122203688173409
Energy: 0.3419309280911409
Energy: 0.3225252035814059
Energy: 0.3212646037575234
Energy: 0.3225252035814059
Energy: 0.3212646037575234
Energy: 0.3225252035814059
Energy: 0.3212646037575234
Energy: 0.3135761445119751
Energy: 0.29590531969855555
Energy: 0.3135761445115379
Energy: 0.29590531969855555
Energy: 0.3135761445119751
Energy: 0.29590531969855555
Energy: 0.2886490450917208
Energy: 0.3213628222253418
Energy: 0.2886490450917208
Energy: 0.3213628222253418
Energy: 0.2886490450917208
Energy: 0.3213628222253418
Energy: 0.3032618489792735
Energy: 0.33933418891879286
Energy: 0.3032618489797107
Energy: 0.33933418891879286
Energy: 0.3032618489792735
Energy: 0.33933418891922995
Energy: 0.3196382314978648
Energy: 0.29933683669345995
Energy: 0.319638231498302
Energy: 0.29933683669345995
Energy: 0.3196382314978648
Energy: 0.29933683669345995
Energy: 0.2772156264925811
Energy: 0.32411167142381103
Energy: 0.2772156264925811
Energy: 0.32411167142381103
Energy: 0.2772156264925811
Energy: 0.32411167142381103
Energy: 0.2852243345527823
Energy: 0.3822191634544004
Energy: 0.2852243345527823
Energy: 0.3822191634544004
Energy: 0.2852243345527823
Energy: 0.3822191634544004
Energy: 0.2941823322277869
Energy: 0.3181737160060458
Energy: 0.2941823322277869
Energy: 0.3181737160060458
Energy: 0.2941823322277869
Energy: 0.3181737160060458
Energy: 0.29303859918265507
Energy: 0.3026424381629039
Energy: 0.29303859918221786
Energy: 0.3026424381629039
Energy: 0.29303859918221786
Energy: 0.3026424381629039
Energy: 0.30342763659163763
Energy: 0.3222749542659564
Energy: 0.30342763659163763
Energy: 0.3222749542659564
Energy: 0.30342763659163763
Energy: 0.3222749542659564
Energy: 0.31655987733516777
Energy: 0.29741495858764094
Energy: 0.3165598773347307
Energy: 0.2974149585872038
Energy: 0.31655987733516777
Energy: 0.29741495858764094
Energy: 0.3429433833407179
Energy: 0.2994232640686525
Energy: 0.3429433833407179
Energy: 0.2994232640686525
Energy: 0.3429433833407179
Energy: 0.29942326406908965
Energy: 0.28525302278723613
Energy: 0.2979884028890539
Energy: 0.28525302278723613
Energy: 0.2979884028890539
Energy: 0.28525302278723613
Energy: 0.2979884028890539
Energy: 0.30433205140186387
Energy: 0.31692098088349907
Energy: 0.30433205140186387
Energy: 0.31692098088349907
Energy: 0.30433205140186387
Energy: 0.31692098088349907
Energy: 0.28502053292458374
Energy: 0.3032634524450023
Energy: 0.28502053292458374
Energy: 0.3032634524450023
Energy: 0.28502053292458374
Energy: 0.3032634524450023

minimum gb energy = 0.277125112993506 eV
minimum distance =  2.61743774721748 Angstroms
sigma value = 33


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

Energy: 0.3569935351490509
Energy: 0.31552872605980103
Energy: 0.3569935351490509
Energy: 0.3155287260594942
Energy: 0.35699353514935767
Energy: 0.31552872605980103
Energy: 0.34429913397375794
Energy: 0.2955227647659976
Energy: 0.34429913397375794
Energy: 0.2955227647659976
Energy: 0.34429913397375794
Energy: 0.2955227647659976
Energy: 0.31689195483251337
Energy: 0.35607160030978585
Energy: 0.31689195483251337
Energy: 0.356071600309479
Energy: 0.31689195483220656
Energy: 0.356071600309479
Energy: 0.31488653754951346
Energy: 0.30816509506707807
Energy: 0.3148865375501271
Energy: 0.3081650950673848
Energy: 0.31488653755043383
Energy: 0.3081650950673848
Energy: 0.3205291680989231
Energy: 0.31626561964057864
Energy: 0.3205291680989231
Energy: 0.3162656196408854
Energy: 0.3205291680989231
Energy: 0.3162656196411922
Energy: 0.3318094887877705
Energy: 0.3158246857411929
Energy: 0.3318094887877705
Energy: 0.3158246857411929
Energy: 0.3318094887877705
Energy: 0.3158246857411929
Energy: 0.3056158479752562
Energy: 0.3393219106116692
Energy: 0.305615847975563
Energy: 0.3393219106116692
Energy: 0.3056158479752562
Energy: 0.33932191061197603
Energy: 0.32758845031021117
Energy: 0.3234033794528638
Energy: 0.32758845031021117
Energy: 0.323403379452557
Energy: 0.32758845031021117
Energy: 0.3234033794528638
Energy: 0.3300528787244124
Energy: 0.33004274152458074
Energy: 0.33005287872502603
Energy: 0.33004274152458074
Energy: 0.3300528787244124
Energy: 0.33004274152458074
Energy: 0.35999917753622696
Energy: 0.3038257474496441
Energy: 0.3599991775365338
Energy: 0.30382574744933727
Energy: 0.35999917753622696
Energy: 0.30382574744933727
Energy: 0.32840799086461864
Energy: 0.3254422323686778
Energy: 0.32840799086461864
Energy: 0.3254422323686778
Energy: 0.32840799086492545
Energy: 0.3254422323686778
Energy: 0.31865565083746217
Energy: 0.3083792876444537
Energy: 0.3186556508343941
Energy: 0.3083792876447605
Energy: 0.3186556508343941
Energy: 0.3083792876444537
Energy: 0.3306966980977952
Energy: 0.3297176332242039
Energy: 0.3306966980977952
Energy: 0.3297176332242039
Energy: 0.3306966980977952
Energy: 0.3297176332242039
Energy: 0.33377057275381433
Energy: 0.3328894219253979
Energy: 0.3337705727541211
Energy: 0.3328894219253979
Energy: 0.33377057275381433
Energy: 0.3328894219253979
Energy: 0.3281806598316846
Energy: 0.30380079578134145
Energy: 0.3281806598316846
Energy: 0.30380079578134145
Energy: 0.3281806598316846
Energy: 0.30380079578134145
Energy: 0.3101363757921469
Energy: 0.322117467929372
Energy: 0.3101363757921469
Energy: 0.3221174679290652
Energy: 0.3101363757921469
Energy: 0.322117467929372
Energy: 0.2960916599919083
Energy: 0.2999524417831533
Energy: 0.29609165999221504
Energy: 0.2999524417831533
Energy: 0.29609165999313547
Energy: 0.2999524417831533
Energy: 0.30561585358968396
Energy: 0.31367277220625484
Energy: 0.30561585358968396
Energy: 0.31367277220594797
Energy: 0.30561585358968396
Energy: 0.31367277220625484
Energy: 0.35788406198082034
Energy: 0.3172263453919046
Energy: 0.3578840619811271
Energy: 0.3172263453919046
Energy: 0.3578840619805135
Energy: 0.3172263453919046
Energy: 0.2965742443830508
Energy: 0.31180842731725433
Energy: 0.2965742443833576
Energy: 0.3118084273169475
Energy: 0.2965742443830508
Energy: 0.31180842731725433
Energy: 0.29992468927672394
Energy: 0.3342960391942901
Energy: 0.29992468927672394
Energy: 0.33429603919398326
Energy: 0.29992468927672394
Energy: 0.33429603919398326
Energy: 0.29195626426956955
Energy: 0.3443826727854979
Energy: 0.29195626426956955
Energy: 0.3443826727858047
Energy: 0.2919562642692628
Energy: 0.3443826727858047
Energy: 0.32858276595694297
Energy: 0.2852595572780907
Energy: 0.32858276595724967
Energy: 0.2852595572774771
Energy: 0.3285827659566361
Energy: 0.2852595572783975
Energy: 0.3111830270887239
Energy: 0.32755510665015597
Energy: 0.3111830270887239
Energy: 0.3275551066498492
Energy: 0.3111830270887239
Energy: 0.3275551066498492
Energy: 0.33421716440263616
Energy: 0.3005052720699713
Energy: 0.33421716440263616
Energy: 0.3005052720702781
Energy: 0.33421716440263616
Energy: 0.3005052720702781
Energy: 0.31410245688582067
Energy: 0.33072813269895585
Energy: 0.31410245688582067
Energy: 0.33072813269956947
Energy: 0.31410245688582067
Energy: 0.33072813269956947
Energy: 0.34388384202093747
Energy: 0.30842576239506186
Energy: 0.3438838420212442
Energy: 0.30842576239506186
Energy: 0.3438838420212442
Energy: 0.30842576239506186
Energy: 0.3336421608726965
Energy: 0.30267643896068713
Energy: 0.3336421608726965
Energy: 0.30267643896068713
Energy: 0.3336421608726965
Energy: 0.30267643896099394
Energy: 0.31398827780578714
Energy: 0.3295605875492327
Energy: 0.31398827780578714
Energy: 0.3295605875495395
Energy: 0.31398827780578714
Energy: 0.3295605875495395
Energy: 0.30111071374247683
Energy: 0.35945863664435085
Energy: 0.30111071374247683
Energy: 0.35945863664251004
Energy: 0.30111071374247683
Energy: 0.3594586366440441
Energy: 0.31248983875804126
Energy: 0.30390132515915436
Energy: 0.31248983875804126
Energy: 0.30390132515915436
Energy: 0.31248983875804126
Energy: 0.30390132515915436
Energy: 0.30165785888773056
Energy: 0.29791649372060464
Energy: 0.30165785888773056
Energy: 0.2979164937218318
Energy: 0.30165785888773056
Energy: 0.2979164937209114
Energy: 0.2966019525936012
Energy: 0.30829183132595234
Energy: 0.2966019525929876
Energy: 0.30829183132595234
Energy: 0.2966019525929876
Energy: 0.30829183132595234
Energy: 0.3303478699473056
Energy: 0.3306320782093262
Energy: 0.3303478699473056
Energy: 0.33063207820901935
Energy: 0.3303478699476124
Energy: 0.3306320782093262
Energy: 0.3302168168908217
Energy: 0.33071518835727187
Energy: 0.3302168168905149
Energy: 0.33071518835727187
Energy: 0.3302168168905149
Energy: 0.33071518835727187
Energy: 0.325353163873317
Energy: 0.3084546806969747
Energy: 0.325353163873317
Energy: 0.3084546806969747
Energy: 0.325353163873317
Energy: 0.30845468069728155
Energy: 0.30166645740049547
Energy: 0.29830377223340204
Energy: 0.30166645740080233
Energy: 0.2983037722346293
Energy: 0.30166645740049547
Energy: 0.2983037722337089
Energy: 0.3125110522175975
Energy: 0.3038342793865408
Energy: 0.3125110522175975
Energy: 0.30383427938684754
Energy: 0.3125110522175975
Energy: 0.3038342793865408
Energy: 0.30110099349891895
Energy: 0.3597111852888766
Energy: 0.30110099349891895
Energy: 0.3597111852885697
Energy: 0.30110099349891895
Energy: 0.3597111852888766
Energy: 0.314085620348557
Energy: 0.32936184786866113
Energy: 0.314085620348557
Energy: 0.3293618478695815
Energy: 0.314085620348557
Energy: 0.32936184787019507
Energy: 0.3336921897466038
Energy: 0.30309039756111017
Energy: 0.3336921897466038
Energy: 0.30309039756111017
Energy: 0.3336921897466038
Energy: 0.30309039756111017
Energy: 0.34370514918781847
Energy: 0.3084758632033095
Energy: 0.34370514918812534
Energy: 0.30847586320300274
Energy: 0.34370514918812534
Energy: 0.3084758632033095
Energy: 0.3140308708239518
Energy: 0.33105691170575585
Energy: 0.3140308708239518
Energy: 0.33105691170575585
Energy: 0.3140308708239518
Energy: 0.3310569117060626
Energy: 0.3339180325567485
Energy: 0.30052437308518115
Energy: 0.3339180325570554
Energy: 0.30052437308518115
Energy: 0.3339180325567485
Energy: 0.30052437308518115
Energy: 0.3112260858188658
Energy: 0.3142476479463605
Energy: 0.3112260858188658
Energy: 0.3142476479463605
Energy: 0.3112260858188658
Energy: 0.31424764794605375
Energy: 0.32840966045418124
Energy: 0.2850873929413819
Energy: 0.3284096604535677
Energy: 0.2850873929416888
Energy: 0.32840966045418124
Energy: 0.2850873929416888
Energy: 0.29195629058016903
Energy: 0.34410782445169297
Energy: 0.29195629058016903
Energy: 0.34410782445169297
Energy: 0.29195629058016903
Energy: 0.3441078244519997

minimum gb energy = 0.2850873929413819 eV
minimum distance =  2.61227620172652 Angstroms
sigma value = 67


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

Energy: 0.38513602009792103
Energy: 0.32940003725892036
Energy: 0.38513602009792103
Energy: 0.32940003725892036
Energy: 0.38513602009792103
Energy: 0.32940003725871064
Energy: 0.35135421855779697
Energy: 0.28917794529623364
Energy: 0.35135421855800664
Energy: 0.28917794529623364
Energy: 0.35135421855800664
Energy: 0.28917794529623364
Energy: 0.2967862041776288
Energy: 0.39252876682911003
Energy: 0.4694310440029321
Energy: 0.39252876682911003
Energy: 0.33995294302069684
Energy: 0.39252876682929644
Energy: 0.3513652154283175
Energy: 0.2890926061905548
Energy: 0.3513652154283175
Energy: 0.2890926061905548
Energy: 0.3513652154283175
Energy: 0.2890926061905548
Energy: 0.38513602009792103
Energy: 0.32940003725871064
Energy: 0.38513602009792103
Energy: 0.32940003725892036
Energy: 0.3851360200981308
Energy: 0.32940003725892036
Energy: 0.35135421855779697
Energy: 0.2891779452964433
Energy: 0.35135421855800664
Energy: 0.28917794529623364
Energy: 0.35135421855779697
Energy: 0.28917794529623364
Energy: 0.4950196928359205
Energy: 0.39252876682911003
Energy: 0.33995294302069684
Energy: 0.39252876682911003
Energy: 0.33995294302069684
Energy: 0.39252876682911003

minimum gb energy = 0.2890926061905548 eV
minimum distance =  2.62860824103843 Angstroms
sigma value = 3


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

Energy: 0.44417752910683045
Energy: 0.41636910382603987
Energy: 0.44417752910683045
Energy: 0.41636910382603987
Energy: 0.44417752910683045
Energy: 0.41636910382603987
Energy: 0.3907985443955078
Energy: 0.3382248558609723
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Energy: 0.39079854439581224
Energy: 0.3382248558609723
Energy: 0.37107803262512556
Energy: 0.43083426943656816
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Energy: 0.43083426943626374
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Energy: 0.43083426943626374
Energy: 0.3977873161059432
Energy: 0.3643538922993794
Energy: 0.3977873161059432
Energy: 0.36435389229907506
Energy: 0.3977873161059432
Energy: 0.3643538922993794
Energy: 0.40582529757399205
Energy: 0.3968068404137361
Energy: 0.40582529757399205
Energy: 0.3968160226886462
Energy: 0.40582529757399205
Energy: 0.39681171041301166
Energy: 0.38034692345369703
Energy: 0.37746285133231505
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Energy: 0.38034692345339266
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Energy: 0.4087384187708825
Energy: 0.39425808460666545
Energy: 0.40873841877032446
Energy: 0.394258084606361
Energy: 0.4087384187706289
Energy: 0.394258084606361
Energy: 0.3588944413820657
Energy: 0.37140114744417013
Energy: 0.3588944413820657
Energy: 0.37140114744442376
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Energy: 0.3714011474438657
Energy: 0.4021338078155938
Energy: 0.38100873979245053
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Energy: 0.38100873979219685
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Energy: 0.3810087397918924
Energy: 0.3897639304259227
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Energy: 0.38976393041369617
Energy: 0.37788915308412757
Energy: 0.38976393036265894
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Energy: 0.37990324588613245
Energy: 0.43034725559487674
Energy: 0.37990324588643687
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Energy: 0.37990324588613245
Energy: 0.43034725559518117
Energy: 0.36344262849567494
Energy: 0.3707733643195967
Energy: 0.3634426284959793
Energy: 0.3707733638197772
Energy: 0.36344262849567494
Energy: 0.3707733638197772
Energy: 0.41407370075071
Energy: 0.35493165580543373
Energy: 0.41407370075040556
Energy: 0.35493165576525343
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Energy: 0.3549316556882917
Energy: 0.39561943351969675
Energy: 0.3651556563603232
Energy: 0.39561943351969675
Energy: 0.36515565643530634
Energy: 0.39561943351969675
Energy: 0.36515565639740893
Energy: 0.4145004586266962
Energy: 0.3783285106010037
Energy: 0.41450045862588447
Energy: 0.3783285106010037
Energy: 0.4145004586255801
Energy: 0.3783285106010037
Energy: 0.3825156701156278
Energy: 0.4076383357281627
Energy: 0.3825156701156278
Energy: 0.40763833572846714
Energy: 0.38251567011532345
Energy: 0.40763833572846714
Energy: 0.42433214380358414
Energy: 0.3505907288440134
Energy: 0.42433214380358414
Energy: 0.3505907288440134
Energy: 0.42433214380358414
Energy: 0.3505907288440134
Energy: 0.39209249471472807
Energy: 0.35730958231024407
Energy: 0.39209249471472807
Energy: 0.3573095823099397
Energy: 0.3920924947149817
Energy: 0.35730958231049775
Energy: 0.4045112133028004
Energy: 0.385238614122157
Energy: 0.4045112133033584
Energy: 0.385238614122157
Energy: 0.40451121330249595
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Energy: 0.3628971534460194
Energy: 0.3835050024997268
Energy: 0.3628971534460194
Energy: 0.3835050024997268
Energy: 0.3628971534460194
Energy: 0.38350500250003117
Energy: 0.42946806546704686
Energy: 0.37608791048207196
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Energy: 0.42946806546704686
Energy: 0.37608791048207196
Energy: 0.3707263158342021
Energy: 0.42625339531457057
Energy: 0.3707263158342021
Energy: 0.42625339531457057
Energy: 0.3707263158342021
Energy: 0.4262533953143169
Energy: 0.39579770209190085
Energy: 0.3677733158730081
Energy: 0.3957977020910891
Energy: 0.3677733158733125
Energy: 0.39579770209190085
Energy: 0.3677733158730081
Energy: 0.36082615084873015
Energy: 0.3808249293748785
Energy: 0.36082615084873015
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Energy: 0.3808249293748785
Energy: 0.44175438680646334
Energy: 0.37537777262134897
Energy: 0.44175438680646334
Energy: 0.37537777262079086
Energy: 0.44175438680646334
Energy: 0.37537777262104455
Energy: 0.38115493356002594
Energy: 0.39389900854618554
Energy: 0.38115493356002594
Energy: 0.39389900854618554
Energy: 0.38115493356002594
Energy: 0.39389900854618554
Energy: 0.37720961213751836
Energy: 0.3988061838297715
Energy: 0.3772096121378227
Energy: 0.3988061838297715
Energy: 0.37720961213751836
Energy: 0.3988061838297715
Energy: 0.3698893669348002
Energy: 0.35028289869201573
Energy: 0.3698893669348002
Energy: 0.35028289869201573
Energy: 0.3698893669348002
Energy: 0.35028289869201573
Energy: 0.38545988977344686
Energy: 0.3513509279102978
Energy: 0.38545988977430934
Energy: 0.3513509279102978
Energy: 0.38545988964489003
Energy: 0.3513509279102978
Energy: 0.39700736370604395
Energy: 0.3810688727132269
Energy: 0.3970073637062977
Energy: 0.3810688727129225
Energy: 0.3970073637062977
Energy: 0.3810688727132269
Energy: 0.41212158191019044
Energy: 0.3684043044426955
Energy: 0.41212158187807657
Energy: 0.3684043044424419
Energy: 0.412121581896797
Energy: 0.36840430444213745
Energy: 0.3800716774259139
Energy: 0.3481279465254256
Energy: 0.3800716774177966
Energy: 0.3481279465254256
Energy: 0.3800716774110999
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Energy: 0.3803963112161486
Energy: 0.3747238618324031
Energy: 0.38039631121640227
Energy: 0.374723841229309
Energy: 0.38039631121584416
Energy: 0.3747236425441214
Energy: 0.3818574857387584
Energy: 0.4025715178693233
Energy: 0.3818574857359681
Energy: 0.4025715178693233
Energy: 0.3818574857395701
Energy: 0.4025715178693233
Energy: 0.35574802905729946
Energy: 0.3813166544812094
Energy: 0.35574802905729946
Energy: 0.3813166544812094
Energy: 0.35574802905729946
Energy: 0.38131665448095575
Energy: 0.4074559890597458
Energy: 0.37652310240612125
Energy: 0.4074559890597458
Energy: 0.3765231024064256
Energy: 0.4074559890597458
Energy: 0.37652310240612125
Energy: 0.36097811061320073
Energy: 0.43401068845263424
Energy: 0.36097811061320073
Energy: 0.43401068845263424
Energy: 0.36097811061320073
Energy: 0.43401068845263424
Energy: 0.3821054030569985
Energy: 0.38030562312957733
Energy: 0.3821054030569985
Energy: 0.38030562312957733
Energy: 0.38210540305725216
Energy: 0.38030562312957733
Energy: 0.3549602256526493
Energy: 0.40543611443125077
Energy: 0.3549602256526493
Energy: 0.4054361144315044
Energy: 0.3549602256526493
Energy: 0.4054361144334831
Energy: 0.4091018925858661
Energy: 0.3765625782564774
Energy: 0.40910189258642415
Energy: 0.3765625782562237
Energy: 0.409101892585308
Energy: 0.3765625782564774
Energy: 0.3657581566700026
Energy: 0.4389588333809589
Energy: 0.3657581566700026
Energy: 0.4389588333703558
Energy: 0.3657581566700026
Energy: 0.43895883335082364
Energy: 0.434517312153728
Energy: 0.35882455131322805
Energy: 0.43451731215342365
Energy: 0.35882455131322805
Energy: 0.43451731215342365
Energy: 0.35882455131322805
Energy: 0.36062285506911357
Energy: 0.3566856918219738
Energy: 0.36062285506911357
Energy: 0.3566856918225319
Energy: 0.36062285506911357
Energy: 0.3566856918225319
Energy: 0.4130853599147259
Energy: 0.33898168677517976
Energy: 0.4130830889508442
Energy: 0.33898168677517976
Energy: 0.4130829436793213
Energy: 0.33898168677517976
Energy: 0.3832416228114723
Energy: 0.41473917934039695
Energy: 0.3832416228114723
Energy: 0.41473917934039695
Energy: 0.3832416228114723
Energy: 0.41473917934039695
Energy: 0.4206884705551893
Energy: 0.3638312737481005
Energy: 0.4206884705551893
Energy: 0.3638312737481005
Energy: 0.4206884705551893
Energy: 0.3638312737481005
Energy: 0.3781679331633623
Energy: 0.35649405357012864
Energy: 0.3781679331633623
Energy: 0.3564940535709403
Energy: 0.3781679331633623
Energy: 0.35649405357012864
Energy: 0.41916638829209496
Energy: 0.3433247510024784
Energy: 0.4191663882918413
Energy: 0.3433247509929913
Energy: 0.4191663882918413
Energy: 0.343324751002732
Energy: 0.3652006954266779
Energy: 0.3947084119066289
Energy: 0.3652006954266779
Energy: 0.39470840046613065
Energy: 0.3652006954266779
Energy: 0.3947083680583277
Energy: 0.3937241795819274
Energy: 0.3767714505227761
Energy: 0.3937241795819274
Energy: 0.37677145052221805
Energy: 0.3937241795819274
Energy: 0.37677145052221805
Energy: 0.39270895945207535
Energy: 0.37873663469849156
Energy: 0.3927089594517709
Energy: 0.37873663469849156
Energy: 0.3927089594517709
Energy: 0.37873663469849156

minimum gb energy = 0.3382248558609723 eV
minimum distance =  2.57516393543747 Angstroms
sigma value = 81


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

Energy: 0.47161639969657176
Energy: 0.427770399394613
Energy: 0.47161639969657176
Energy: 0.427770399394613
Energy: 0.47161639969657176
Energy: 0.42777039939423
Energy: 0.4100887946727659
Energy: 0.42089340602145275
Energy: 0.41008879467238285
Energy: 0.42089340602145275
Energy: 0.4100887946727659
Energy: 0.42089340602145275
Energy: 0.34381588081494263
Energy: 0.3425012803445595
Energy: 0.34381588081494263
Energy: 0.34250128034417654
Energy: 0.34381588081494263
Energy: 0.3425012803445595
Energy: 0.4225266468190158
Energy: 0.36034297976980595
Energy: 0.4225266468186329
Energy: 0.36034297976980595
Energy: 0.4225266468190158
Energy: 0.36034297976980595
Energy: 0.4426755021863366
Energy: 0.4214132554444415
Energy: 0.4426755021863366
Energy: 0.4214132554444415
Energy: 0.4426755021863366
Energy: 0.4214132554444415
Energy: 0.3885724454183486
Energy: 0.3817663926185582
Energy: 0.3885724454183486
Energy: 0.3817663926185582
Energy: 0.3885724454183486
Energy: 0.3817663926185582
Energy: 0.384528008402284
Energy: 0.3789465697163246
Energy: 0.384528008402284
Energy: 0.3789465697163246
Energy: 0.384528008402284
Energy: 0.3789465697163246
Energy: 0.4181219001581712
Energy: 0.42176587861180914
Energy: 0.4181219001581712
Energy: 0.42176587861142617
Energy: 0.4181219001581712
Energy: 0.42176587861180914
Energy: 0.41580736039466976
Energy: 0.4009177104255545
Energy: 0.41580736039466976
Energy: 0.4009177104255545
Energy: 0.41580736039466976
Energy: 0.4009177104255545
Energy: 0.39538368679766556
Energy: 0.4306416458679514
Energy: 0.39538368679766556
Energy: 0.4306416458675685
Energy: 0.39538368679766556
Energy: 0.4306416458675685
Energy: 0.38916508979848347
Energy: 0.40123587589481746
Energy: 0.38916508979810044
Energy: 0.4012358758952004
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Energy: 0.4012358758952004
Energy: 0.3869407306011742
Energy: 0.3919545811412591
Energy: 0.3869407306011742
Energy: 0.3919545791384536
Energy: 0.3869407306011742
Energy: 0.39195457928930727
Energy: 0.4343907138056603
Energy: 0.4191190425574548
Energy: 0.4343907138056603
Energy: 0.4191190425574548
Energy: 0.4343907138056603
Energy: 0.4191190425574548
Energy: 0.39910826791316123
Energy: 0.3453519054763699
Energy: 0.39910826791316123
Energy: 0.3453519054763699
Energy: 0.39910826791354426
Energy: 0.3453519054763699
Energy: 0.4197755791753807
Energy: 0.36764492206686933
Energy: 0.4197755791753807
Energy: 0.36764492206686933
Energy: 0.4197755791753807
Energy: 0.36764492206686933
Energy: 0.4185593626531451
Energy: 0.4134293640464821
Energy: 0.4185593626531451
Energy: 0.4134293640464821
Energy: 0.4185593626531451
Energy: 0.4134293640464821
Energy: 0.43803982237161027
Energy: 0.38506539505205994
Energy: 0.43803982237161027
Energy: 0.38506539505244286
Energy: 0.43803982237122735
Energy: 0.38506539505244286
Energy: 0.34966754128173777
Energy: 0.4660821569408656
Energy: 0.34966754128212074
Energy: 0.46608215694124855
Energy: 0.34966754128173777
Energy: 0.4660821569408656
Energy: 0.34187875581888044
Energy: 0.3517348880594997
Energy: 0.34187875581888044
Energy: 0.3517348880594997
Energy: 0.34187875581888044
Energy: 0.3517348880594997
Energy: 0.3610881278646328
Energy: 0.463805602274391
Energy: 0.3610881278646328
Energy: 0.46380560227477396
Energy: 0.3610881278646328
Energy: 0.463805602274391
Energy: 0.42144540275170655
Energy: 0.41896113128035395
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Energy: 0.418961131280737
Energy: 0.42144540275170655
Energy: 0.41896113128035395
Energy: 0.40012479603014295
Energy: 0.4021873647151443
Energy: 0.40012479603014295
Energy: 0.4021873647151443
Energy: 0.40012479603014295
Energy: 0.4021873647151443
Energy: 0.3984586055169443
Energy: 0.3398763147776249
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Energy: 0.3398763147776249
Energy: 0.3984586055169443
Energy: 0.3398763147776249
Energy: 0.40428583793730655
Energy: 0.43980189388330215
Energy: 0.4042858379376896
Energy: 0.43980189388330215
Energy: 0.40428583793730655
Energy: 0.43980189388330215
Energy: 0.40085795207143626
Energy: 0.3526991613648858
Energy: 0.40085795207143626
Energy: 0.3526991612669163
Energy: 0.40085795207143626
Energy: 0.35269916099511517
Energy: 0.4190273459031183
Energy: 0.456621538468376
Energy: 0.4190273459027353
Energy: 0.456621538468376
Energy: 0.4190273459031183
Energy: 0.456621538468376
Energy: 0.3494362749384086
Energy: 0.3933148622313106
Energy: 0.3494362749384086
Energy: 0.3933148622313106
Energy: 0.3494362749384086
Energy: 0.3933148622313106
Energy: 0.42729605628945627
Energy: 0.38487454959317297
Energy: 0.42729605629022216
Energy: 0.38487454959317297
Energy: 0.42729605628792444
Energy: 0.38487454959317297
Energy: 0.4194882735522383
Energy: 0.41031448238540225
Energy: 0.4194882735522383
Energy: 0.41031448238501933
Energy: 0.4194882735522383
Energy: 0.41031448238540225
Energy: 0.344207797091389
Energy: 0.3381307907207066
Energy: 0.344207797091389
Energy: 0.3381307907207066
Energy: 0.344207797091389
Energy: 0.3381307907207066
Energy: 0.35806473626269025
Energy: 0.42055326885574296
Energy: 0.35806473626269025
Energy: 0.42055326885574296
Energy: 0.35806473626269025
Energy: 0.42055326885574296
Energy: 0.4216374092505553
Energy: 0.439872613705777
Energy: 0.4216374092505553
Energy: 0.439872613705777
Energy: 0.4216374092505553
Energy: 0.439872613705777
Energy: 0.38663574249299504
Energy: 0.380385133519235
Energy: 0.38663574249299504
Energy: 0.36884604852321884
Energy: 0.38663574249299504
Energy: 0.3689794201341842
Energy: 0.3826187376534814
Energy: 0.3446040680981097
Energy: 0.3826187376534814
Energy: 0.3446040680981097
Energy: 0.3826187376534814
Energy: 0.3446040680981097
Energy: 0.34589396516389526
Energy: 0.4915705223557217
Energy: 0.3458939651642783
Energy: 0.4915705223557217
Energy: 0.34589396516389526
Energy: 0.49157052235610466
Energy: 0.40098169865784405
Energy: 0.36014956128981024
Energy: 0.4009816986704819
Energy: 0.36014956128981024
Energy: 0.400981698269691
Energy: 0.36014956128981024
Energy: 0.4191167461486185
Energy: 0.4233403868829888
Energy: 0.4191167461486185
Energy: 0.4233403868833718
Energy: 0.4191167461482355
Energy: 0.4233403868833718
Energy: 0.40189895617757965
Energy: 0.3838251171651627
Energy: 0.40189895617757965
Energy: 0.3838251171651627
Energy: 0.40189895617757965
Energy: 0.3838251171651627

minimum gb energy = 0.3381307907207066 eV
minimum distance =  2.62645498431402 Angstroms
sigma value = 43


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

Energy: 0.4752044727885764
Energy: 0.4179660442798358
Energy: 0.4752044727885764
Energy: 0.4179660442798358
Energy: 0.4752044727885764
Energy: 0.4179660442798358
Energy: 0.41247554806055287
Energy: 0.3515426255346117
Energy: 0.41247554806055287
Energy: 0.3515426255346117
Energy: 0.41247554806055287
Energy: 0.35154262553508203
Energy: 0.41337177327812197
Energy: 0.4428761921881958
Energy: 0.41337177327812197
Energy: 0.4428761921881958
Energy: 0.4061495602317453
Energy: 0.4428761921881958
Energy: 0.3837964567133105
Energy: 0.38814879428198074
Energy: 0.3837964567133105
Energy: 0.38814879428198074
Energy: 0.3837964567133105
Energy: 0.38814879428198074
Energy: 0.4194060988736551
Energy: 0.3865347514997195
Energy: 0.41940609887318464
Energy: 0.3865347514997195
Energy: 0.4194060988736551
Energy: 0.3865347514992491
Energy: 0.3897222060113558
Energy: 0.39247558884721434
Energy: 0.3897222060113558
Energy: 0.39247558884721434
Energy: 0.3897222060113558
Energy: 0.39247558884721434
Energy: 0.3989213676624777
Energy: 0.42986154005679467
Energy: 0.3989213676624777
Energy: 0.42986154005679467
Energy: 0.3989213676624777
Energy: 0.42986154005679467
Energy: 0.37638132151003917
Energy: 0.4031729624041105
Energy: 0.37638132151003917
Energy: 0.4031729624041105
Energy: 0.37638132151003917
Energy: 0.4031729624041105
Energy: 0.4586397535171565
Energy: 0.34541171875066107
Energy: 0.4586397535171565
Energy: 0.34541171875066107
Energy: 0.4586397535171565
Energy: 0.34541171875066107
Energy: 0.35343413782601096
Energy: 0.3979233690731613
Energy: 0.35343413782601096
Energy: 0.3979233690731613
Energy: 0.35343413782601096
Energy: 0.3979233690731613
Energy: 0.425488898463522
Energy: 0.39737673651394323
Energy: 0.425488898463522
Energy: 0.39737673651394323
Energy: 0.425488898463522
Energy: 0.39737673651394323
Energy: 0.37650615647933605
Energy: 0.383837156673859
Energy: 0.37650615647933605
Energy: 0.3838371566715069
Energy: 0.37650615647933605
Energy: 0.38383715666962537
Energy: 0.43555415465044733
Energy: 0.3961233607758136
Energy: 0.43555415465044733
Energy: 0.396123360776284
Energy: 0.43555415465044733
Energy: 0.3961233607758136
Energy: 0.33743479388542696
Energy: 0.44308512226254865
Energy: 0.33743479388542696
Energy: 0.44308512226301905
Energy: 0.33743479388542696
Energy: 0.44308512226301905
Energy: 0.4002828857556324
Energy: 0.38344096284153584
Energy: 0.4002828857546916
Energy: 0.38344096283683177
Energy: 0.4002828857551621
Energy: 0.38344096282742374
Energy: 0.40320995347403615
Energy: 0.3565101337195771
Energy: 0.40320995347403615
Energy: 0.3565101248427436
Energy: 0.40320995347403615
Energy: 0.3565101238261779
Energy: 0.4191291301233515
Energy: 0.35346150946453714
Energy: 0.4191291301233515
Energy: 0.35346150946453714
Energy: 0.4191291301233515
Energy: 0.35346150946453714
Energy: 0.4249918723790768
Energy: 0.39158385622013797
Energy: 0.4249918723790768
Energy: 0.39158385622013797
Energy: 0.4249918723790768
Energy: 0.39158385622060843
Energy: 0.42472265576725726
Energy: 0.3912736029758633
Energy: 0.4247226557691389
Energy: 0.3912736029758633
Energy: 0.4247226557860521
Energy: 0.3912736029758633
Energy: 0.4067599943474763
Energy: 0.3542762122545951
Energy: 0.4067599943366784
Energy: 0.3542762122545951
Energy: 0.4067599941880948
Energy: 0.3542762122545951
Energy: 0.4029602537668728
Energy: 0.39365891547903875
Energy: 0.4029602537668728
Energy: 0.39365891547903875
Energy: 0.4029602537668728
Energy: 0.39365891547903875
Energy: 0.4178229952082271
Energy: 0.3669303798271277
Energy: 0.4178229952082271
Energy: 0.3669303798271277
Energy: 0.4178229952082271
Energy: 0.3669303798271277
Energy: 0.33728335708824425
Energy: 0.4182766999505576
Energy: 0.33728335708824425
Energy: 0.4182766999505576
Energy: 0.33728335708777385
Energy: 0.4182766999529096
Energy: 0.4352847967828926
Energy: 0.3961012830883908
Energy: 0.4352847967828926
Energy: 0.39610128308886117
Energy: 0.4352847967828926
Energy: 0.3961012830883908
Energy: 0.3762379569342375
Energy: 0.40836065189560483
Energy: 0.3762379569347079
Energy: 0.40836065189560483
Energy: 0.3762379569347079
Energy: 0.40836065189560483
Energy: 0.41727320825549014
Energy: 0.3867319293678091
Energy: 0.41727320825549014
Energy: 0.3867319293678091
Energy: 0.41727320825549014
Energy: 0.3867319293678091
Energy: 0.3532779676446729
Energy: 0.3531366395562177
Energy: 0.3532779676446729
Energy: 0.3531366395562177
Energy: 0.3532779676446729
Energy: 0.3531366395562177
Energy: 0.4265387392531878
Energy: 0.36903308239189536
Energy: 0.4265387392531878
Energy: 0.36903308239144633
Energy: 0.4265387392531878
Energy: 0.36903308239144633
Energy: 0.37638756518446753
Energy: 0.40335184259488327
Energy: 0.37638756518446753
Energy: 0.40335184259488327
Energy: 0.37638756518446753
Energy: 0.40335184259488327
Energy: 0.4074168942349878
Energy: 0.41407754793234347
Energy: 0.4074168942345174
Energy: 0.41407754793234347
Energy: 0.4074168942349878
Energy: 0.41407754793234347
Energy: 0.4018149107828394
Energy: 0.39560240130126423
Energy: 0.4018149107828394
Energy: 0.39560240130126423
Energy: 0.4018149107823689
Energy: 0.39560240130126423

minimum gb energy = 0.33728335708777385 eV
minimum distance =  2.59081931014924 Angstroms
sigma value = 57


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

Energy: 0.44031398645607667
Energy: 0.37645099947482136
Energy: 0.44031398645607667
Energy: 0.37645099947482136
Energy: 0.44031398645607667
Energy: 0.37645099947482136
Energy: 0.3943974268266045
Energy: 0.3539210075839777
Energy: 0.3943974268266045
Energy: 0.3539210075839777
Energy: 0.3943974268266045
Energy: 0.3539210075839777
Energy: 0.39403645085340344
Energy: 0.43872941188412956
Energy: 0.39403645085282213
Energy: 0.43872941188412956
Energy: 0.39403645085282213
Energy: 0.43872941188412956
Energy: 0.40277561380365734
Energy: 0.41509190216286934
Energy: 0.40277561380365734
Energy: 0.41509190216286934
Energy: 0.40277561380365734
Energy: 0.41509190216286934
Energy: 0.3775711433620351
Energy: 0.4152459679498925
Energy: 0.3775711433620351
Energy: 0.4152459679492834
Energy: 0.3775711433620351
Energy: 0.4152459679498925
Energy: 0.38913965650752325
Energy: 0.3937499306708561
Energy: 0.38913965650752325
Energy: 0.393749930670247
Energy: 0.38913965650752325
Energy: 0.3937499306708561
Energy: 0.38986844994828296
Energy: 0.4384219184498489
Energy: 0.38986844994828296
Energy: 0.4384219184498489
Energy: 0.38986844994828296
Energy: 0.4384219184498489
Energy: 0.40281020713124505
Energy: 0.37865997459494366
Energy: 0.40281020713124505
Energy: 0.37865997459494366
Energy: 0.40281020713124505
Energy: 0.37865997459494366
Energy: 0.3968718328715465
Energy: 0.35422973201934216
Energy: 0.3968718328715465
Energy: 0.35422973201934216
Energy: 0.3968718328715465
Energy: 0.35422973201934216
Energy: 0.3378962087691556
Energy: 0.3942814001581789
Energy: 0.3378962087691556
Energy: 0.3942814001581789
Energy: 0.3378962087691556
Energy: 0.3942814001581789
Energy: 0.39054610136759904
Energy: 0.41883360876600134
Energy: 0.39054610136759904
Energy: 0.41883360876600134
Energy: 0.39054610136759904
Energy: 0.41883360876600134
Energy: 0.39879031033473705
Energy: 0.44462431806932884
Energy: 0.39879031033473705
Energy: 0.44462431806932884
Energy: 0.39879031033473705
Energy: 0.44462431806932884
Energy: 0.3642905653240055
Energy: 0.35439388507701736
Energy: 0.3642905653240055
Energy: 0.35439388507701736
Energy: 0.3642905653240055
Energy: 0.35439388507701736
Energy: 0.39086107004245335
Energy: 0.3674730949812781
Energy: 0.3908610700418443
Energy: 0.36747309498188724
Energy: 0.39086107004245335
Energy: 0.3674730949812781
Energy: 0.371513359558503
Energy: 0.35694676800992825
Energy: 0.371513359558503
Energy: 0.35694676800992825
Energy: 0.371513359558503
Energy: 0.35694676800992825
Energy: 0.39957459368573367
Energy: 0.3907638285085907
Energy: 0.39957459368573367
Energy: 0.3907638285085907
Energy: 0.39957459368573367
Energy: 0.3907638285085907
Energy: 0.3372803994415424
Energy: 0.3941646114518716
Energy: 0.3372803994415424
Energy: 0.3941646114518716
Energy: 0.3372803994415424
Energy: 0.3941646114518716
Energy: 0.3889776167657126
Energy: 0.38184627955875605
Energy: 0.3889776167657126
Energy: 0.38184627955875605
Energy: 0.3889776167663216
Energy: 0.3818462795593652
Energy: 0.3372286251717043
Energy: 0.39416708134289397
Energy: 0.3372286251717043
Energy: 0.39416708134289397
Energy: 0.3372286251717043
Energy: 0.39416708134289397
Energy: 0.4000581459142721
Energy: 0.39089344058414666
Energy: 0.4000581459142721
Energy: 0.39089344058414666
Energy: 0.4000581459142721
Energy: 0.39089344058414666
Energy: 0.3714313022410389
Energy: 0.3569522629093564
Energy: 0.37143130224042975
Energy: 0.3569522629093564
Energy: 0.37143130223982074
Energy: 0.3569522629093564
Energy: 0.392660206043516
Energy: 0.3612181677842293
Energy: 0.39266020603986157
Energy: 0.3612181677842293
Energy: 0.3926602060349889
Energy: 0.3612181677842293
Energy: 0.36412239827116855
Energy: 0.3544497904702014
Energy: 0.36412239827116855
Energy: 0.3544497904702014
Energy: 0.36412239827116855
Energy: 0.3544497904702014
Energy: 0.39859684919975596
Energy: 0.44458617681128515
Energy: 0.39859684919975596
Energy: 0.44458617681128515
Energy: 0.39859684919975596
Energy: 0.44458617681128515

minimum gb energy = 0.3372286251717043 eV
minimum distance =  2.54099065340263 Angstroms
sigma value = 17


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

Energy: 0.39743038802245284
Energy: 0.37016124931704264
Energy: 0.39743038802245284
Energy: 0.37016124931704264
Energy: 0.39743038802245284
Energy: 0.37016124931704264
Energy: 0.3508678935643965
Energy: 0.35537757370890527
Energy: 0.3508678935643965
Energy: 0.35537757370890527
Energy: 0.3508678935643965
Energy: 0.35537757370890527
Energy: 0.4173807641606294
Energy: 0.41671663573183226
Energy: 0.4173807641606294
Energy: 0.41671663573183226
Energy: 0.4173807641606294
Energy: 0.41671663573183226
Energy: 0.33110437687207384
Energy: 0.4192535462208736
Energy: 0.33110437687207384
Energy: 0.4192535462208736
Energy: 0.3311043768729352
Energy: 0.4192535462200122
Energy: 0.3968652132153607
Energy: 0.39882341922403225
Energy: 0.3968652132153607
Energy: 0.39882341922403225
Energy: 0.3968652132153607
Energy: 0.39882341922403225
Energy: 0.37658796622856
Energy: 0.3965059684622465
Energy: 0.37658796622856
Energy: 0.3965059684622465
Energy: 0.37658796622856
Energy: 0.3965059684622465
Energy: 0.387282644396686
Energy: 0.34736417146034404
Energy: 0.3872826443958246
Energy: 0.34736417146034404
Energy: 0.387282644396686
Energy: 0.34736417146034404
Energy: 0.3310942750320019
Energy: 0.3728392182758018
Energy: 0.3310942750320019
Energy: 0.3728392182766631
Energy: 0.3310942750320019
Energy: 0.3728392182766631
Energy: 0.3975839788655288
Energy: 0.35529494837323694
Energy: 0.3975839788655288
Energy: 0.35529494837323694
Energy: 0.3975839788655288
Energy: 0.35529494837323694
Energy: 0.37244728877468
Energy: 0.35109091479181503
Energy: 0.37244728877468
Energy: 0.35109091479181503
Energy: 0.37244728877468
Energy: 0.35109091479181503
Energy: 0.370704050803
Energy: 0.3894819116745484
Energy: 0.370704050803
Energy: 0.3894819116745484
Energy: 0.370704050803
Energy: 0.38948191167368706
Energy: 0.3464545498928309
Energy: 0.35453361783411136
Energy: 0.3464545498928309
Energy: 0.35453361783411136
Energy: 0.3464545498928309
Energy: 0.35453361783411136
Energy: 0.3307846219219637
Energy: 0.3973375895190903
Energy: 0.3307846219219637
Energy: 0.3973375895190903
Energy: 0.3307846219219637
Energy: 0.3973375895190903
Energy: 0.37367034947021777
Energy: 0.3982679249377834
Energy: 0.37367034947021777
Energy: 0.3982679249377834
Energy: 0.37367034947021777
Energy: 0.3982679249377834
Energy: 0.3768131555230893
Energy: 0.43563625829760744
Energy: 0.3768131555230893
Energy: 0.43563625829760744
Energy: 0.3768131555230893
Energy: 0.43563625829760744
Energy: 0.37685313478479804
Energy: 0.3969497276908536
Energy: 0.37685313478479804
Energy: 0.3969497276908536
Energy: 0.37685313478479804
Energy: 0.3969497276908536
Energy: 0.3728937953564973
Energy: 0.3765697945225699
Energy: 0.3728937953564973
Energy: 0.3765697945225699
Energy: 0.3728937953564973
Energy: 0.3765697945225699

minimum gb energy = 0.3307846219219637 eV
minimum distance =  2.54186661781267 Angstroms
sigma value = 17


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

Energy: 0.3597493875820017
Energy: 0.3413964000687374
Energy: 0.36498190851891343
Energy: 0.3413964000687374
Energy: 0.3597493875820017
Energy: 0.3413964000687374
Energy: 0.34854796943197947
Energy: 0.3482732388699731
Energy: 0.33138619190276236
Energy: 0.3478866240202515
Energy: 0.34854796943197947
Energy: 0.3482732388699731
Energy: 0.390249548224149
Energy: 0.3722491868787911
Energy: 0.3692069387427208
Energy: 0.3722491868787911
Energy: 0.39024954822448155
Energy: 0.3722491868787911
Energy: 0.3223576436226949
Energy: 0.36952348470845253
Energy: 0.32243182048088437
Energy: 0.36952348470845253
Energy: 0.3223576436226949
Energy: 0.3695234847087851
Energy: 0.36754530908459576
Energy: 0.33064144874134815
Energy: 0.36754530908459576
Energy: 0.3306414487410155
Energy: 0.36754530908492844
Energy: 0.33064144874134815
Energy: 0.3608654459930806
Energy: 0.3318769555248629
Energy: 0.3607234411205124
Energy: 0.3318769555245303
Energy: 0.3608654459930806
Energy: 0.3318769555245303
Energy: 0.3309407572043562
Energy: 0.34846638772611993
Energy: 0.33094075720402355
Energy: 0.34846638772611993
Energy: 0.3309407572043562
Energy: 0.34846638772645255
Energy: 0.3956038264949085
Energy: 0.40689125005852333
Energy: 0.3956038264949085
Energy: 0.40689125005852333
Energy: 0.3956038264949085
Energy: 0.40689125005852333
Energy: 0.3408643021873413
Energy: 0.35063747003633494
Energy: 0.3408643021873413
Energy: 0.35063747003666756
Energy: 0.3408643021870087
Energy: 0.35063747003666756
Energy: 0.3304528482077944
Energy: 0.31414937174940555
Energy: 0.3304528482081271
Energy: 0.31414937174940555
Energy: 0.3304528482081271
Energy: 0.31414937174940555
Energy: 0.3223367935051055
Energy: 0.40412559718793983
Energy: 0.3223367935051055
Energy: 0.40412559718793983
Energy: 0.3223367935051055
Energy: 0.40412559718793983
Energy: 0.3862905613776689
Energy: 0.34319254716912706
Energy: 0.3862905613776689
Energy: 0.34319254716912706
Energy: 0.3862905613776689
Energy: 0.34319254716879444
Energy: 0.3544789075980711
Energy: 0.342899334578043
Energy: 0.3544789075980711
Energy: 0.342899334578043
Energy: 0.3544789075980711
Energy: 0.342899334578043
Energy: 0.336724065017153
Energy: 0.37113674084771353
Energy: 0.336724065017153
Energy: 0.37113674084771353
Energy: 0.336724065017153
Energy: 0.37113674084771353
Energy: 0.3552655297467463
Energy: 0.34352922394952096
Energy: 0.35520545221773003
Energy: 0.34352922394952096
Energy: 0.355265529747079
Energy: 0.34352922394952096
Energy: 0.3276613908154597
Energy: 0.3966140046494549
Energy: 0.3276551786529802
Energy: 0.3966140046494549
Energy: 0.3276613908154597
Energy: 0.3966140046494549
Energy: 0.3412553406607321
Energy: 0.37889728003975637
Energy: 0.3412553406607321
Energy: 0.37889728003975637
Energy: 0.3412553406607321
Energy: 0.37889728003975637
Energy: 0.37827155841819904
Energy: 0.4187052517317959
Energy: 0.37827155841819904
Energy: 0.4187052517317959
Energy: 0.37827155841819904
Energy: 0.4187052517317959
Energy: 0.34690097418322896
Energy: 0.38061721840795626
Energy: 0.34690097418322896
Energy: 0.38061721840795626
Energy: 0.34690097418322896
Energy: 0.38061721840828894
Energy: 0.3412193498628112
Energy: 0.29537011155800286
Energy: 0.3412193498628112
Energy: 0.29537011155800286
Energy: 0.3412193498628112
Energy: 0.29537011155800286
Energy: 0.362413428062849
Energy: 0.3805697920992778
Energy: 0.362413428062849
Energy: 0.3805697920992778
Energy: 0.362413428062849
Energy: 0.3805697920992778
Energy: 0.3578158453934707
Energy: 0.4188556460238293
Energy: 0.3578158453934707
Energy: 0.4188556460238293
Energy: 0.3578158453934707
Energy: 0.4188556460238293
Energy: 0.34136137021892016
Energy: 0.36016155154815455
Energy: 0.34136137021892016
Energy: 0.36016155154815455
Energy: 0.34136137021892016
Energy: 0.36016155154815455
Energy: 0.3278054439080687
Energy: 0.36660614619359655
Energy: 0.3278054439080687
Energy: 0.36660614619326387
Energy: 0.3278054439080687
Energy: 0.36660614619326387
Energy: 0.35596942280344157
Energy: 0.34363825487697724
Energy: 0.35596942280344157
Energy: 0.34363825487697724
Energy: 0.35596942280344157
Energy: 0.34363825487697724
Energy: 0.35249376625949136
Energy: 0.37722559155154606
Energy: 0.33651943623157976
Energy: 0.37722559155154606
Energy: 0.35249376625949136
Energy: 0.37722559155187874
Energy: 0.35845309597229524
Energy: 0.34115061218249865
Energy: 0.34230566280198216
Energy: 0.34115061218283127
Energy: 0.35845309597229524
Energy: 0.34115061218283127
Energy: 0.392729538655411
Energy: 0.34298521859928865
Energy: 0.3714982198143698
Energy: 0.34298521859928865
Energy: 0.39272953865507826
Energy: 0.34298521859928865
Energy: 0.3224751456582413
Energy: 0.4001513314713972
Energy: 0.3223508365569394
Energy: 0.40015133147206244
Energy: 0.3224751456582413
Energy: 0.4001513314717299
Energy: 0.3303521864282285
Energy: 0.3137660198857352
Energy: 0.3303521864282285
Energy: 0.3137660198857352
Energy: 0.3303521864282285
Energy: 0.3137660198857352
Energy: 0.35390243461063575
Energy: 0.3509215028934023
Energy: 0.35390243461063575
Energy: 0.3509215028934023
Energy: 0.35390243461030313
Energy: 0.3509215028934023
Energy: 0.3660081170430992
Energy: 0.43569003515181004
Energy: 0.3660081170430992
Energy: 0.4356900351514775
Energy: 0.3660081170430992
Energy: 0.4356900351514775
Energy: 0.34217243993649604
Energy: 0.33609318581330483
Energy: 0.34217243993649604
Energy: 0.33609318581330483
Energy: 0.34217243993649604
Energy: 0.33609318581363745
Energy: 0.36760734637783754
Energy: 0.3212512791058194
Energy: 0.36760734637783754
Energy: 0.3212512791058194
Energy: 0.36760734637783754
Energy: 0.3212512791058194
Energy: 0.36781669907716913
Energy: 0.32957715023683576
Energy: 0.36781669907716913
Energy: 0.32957715023683576
Energy: 0.36781669907716913
Energy: 0.32957715023683576
Energy: 0.3230332912750795
Energy: 0.3586244309817516
Energy: 0.3230332912750795
Energy: 0.3586244309817516
Energy: 0.3230332912750795
Energy: 0.3586244309817516
Energy: 0.373465148189457
Energy: 0.332870675731715
Energy: 0.373465148189457
Energy: 0.332870675731715
Energy: 0.373465148189457
Energy: 0.332870675731715
Energy: 0.34601041667980986
Energy: 0.3314162601046038
Energy: 0.34601041667947724
Energy: 0.3314162601046038
Energy: 0.34601041667947724
Energy: 0.3314162601046038
Energy: 0.36498190851891343
Energy: 0.3413964000687374
Energy: 0.36498190851891343
Energy: 0.34139640006906996
Energy: 0.3649819085192461
Energy: 0.3413964000687374
Energy: 0.33138619190242974
Energy: 0.33654499496021445
Energy: 0.33138619190242974
Energy: 0.33654499496021445
Energy: 0.33138619190276236
Energy: 0.33654499496021445
Energy: 0.3793745092803342
Energy: 0.372357798601605
Energy: 0.37956070405421255
Energy: 0.372357798601605
Energy: 0.37937450928066696
Energy: 0.372357798601605
Energy: 0.3224125826476833
Energy: 0.3831335494241629
Energy: 0.32239577752438386
Energy: 0.3831335494241629
Energy: 0.3224125826480159
Energy: 0.3831335494241629
Energy: 0.36754530908492844
Energy: 0.33067485554668047
Energy: 0.36754530908492844
Energy: 0.3306748555470131
Energy: 0.36754530908492844
Energy: 0.33067485554668047

minimum gb energy = 0.29537011155800286 eV
minimum distance =  2.56759108793256 Angstroms
sigma value = 57


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

Energy: 0.3342213762361248
Energy: 0.30229572458455706
Energy: 0.3342213762361248
Energy: 0.30229572458455706
Energy: 0.3342213762361248
Energy: 0.30229572458455706
Energy: 0.3391066354817909
Energy: 0.3010701747408186
Energy: 0.3391066354817909
Energy: 0.3010701747408186
Energy: 0.3391066354817909
Energy: 0.3010701747408186
Energy: 0.33708007709682947
Energy: 0.33192532169434374
Energy: 0.33708007709682947
Energy: 0.33192532169434374
Energy: 0.33708007709682947
Energy: 0.3319253216948853
Energy: 0.2901119050530674
Energy: 0.3331484370623713
Energy: 0.2901119050530674
Energy: 0.3331484370623713
Energy: 0.2901119050530674
Energy: 0.3331484370623713
Energy: 0.3408051658090306
Energy: 0.27894119648368826
Energy: 0.3408051658090306
Energy: 0.27894119648368826
Energy: 0.3408051658090306
Energy: 0.27894119648368826
Energy: 0.32936767147672963
Energy: 0.29958536116709616
Energy: 0.32936767147672963
Energy: 0.29958536116709616
Energy: 0.32936767147672963
Energy: 0.29958536116709616
Energy: 0.28676742633172114
Energy: 0.3216759596666287
Energy: 0.28676742633172114
Energy: 0.3216759596666287
Energy: 0.28676742633172114
Energy: 0.3216759596666287
Energy: 0.37207074137965856
Energy: 0.37286082688579214
Energy: 0.37207074137965856
Energy: 0.37286082688579214
Energy: 0.37207074137965856
Energy: 0.37286082688579214
Energy: 0.30023777691017156
Energy: 0.29953299564369823
Energy: 0.30023777691017156
Energy: 0.29953299564369823
Energy: 0.30023777691017156
Energy: 0.29953299564369823
Energy: 0.30645663850036364
Energy: 0.30783485718268155
Energy: 0.30645663850036364
Energy: 0.30783485718268155
Energy: 0.30645663850036364
Energy: 0.30783485718268155
Energy: 0.3683392949296808
Energy: 0.37657347869060276
Energy: 0.3683392949296808
Energy: 0.37657347869060276
Energy: 0.3683392949296808
Energy: 0.37657347869060276
Energy: 0.3138808951343181
Energy: 0.28688674095960426
Energy: 0.3138808951343181
Energy: 0.2868867409590627
Energy: 0.3138808951343181
Energy: 0.2868867409590627
Energy: 0.30470414789147576
Energy: 0.33229148627408234
Energy: 0.30470414789147576
Energy: 0.33229148627408234
Energy: 0.30470414789147576
Energy: 0.33229148627408234
Energy: 0.2893509216994782
Energy: 0.3527995829216325
Energy: 0.2893509216994782
Energy: 0.3527995829216325
Energy: 0.2893509216994782
Energy: 0.3527995829216325
Energy: 0.3370804942170827
Energy: 0.3045660141145459
Energy: 0.3370804942170827
Energy: 0.3045660141145459
Energy: 0.3370804942170827
Energy: 0.3045660141145459
Energy: 0.3040838584422167
Energy: 0.33524310908478877
Energy: 0.3040838584422167
Energy: 0.33524310908533034
Energy: 0.3040838584422167
Energy: 0.33524310908478877
Energy: 0.3096120672760679
Energy: 0.3374085152112225
Energy: 0.3096120672760679
Energy: 0.3374085152112225
Energy: 0.3096120672755263
Energy: 0.3374085152112225
Energy: 0.35749657912074406
Energy: 0.33147340219292915
Energy: 0.3574965791212857
Energy: 0.33147340219292915
Energy: 0.3574965791212857
Energy: 0.3314734021934708
Energy: 0.2947964372899957
Energy: 0.3539602394237575
Energy: 0.2947964372899957
Energy: 0.3539602394237575
Energy: 0.2947964372899957
Energy: 0.35396023942326515
Energy: 0.2969811254990133
Energy: 0.32791941520636836
Energy: 0.2969811254984717
Energy: 0.32791941520636836
Energy: 0.2969811254984717
Energy: 0.32791941520636836
Energy: 0.331020412079259
Energy: 0.379554022716333
Energy: 0.331020412079259
Energy: 0.379554022716333
Energy: 0.331020412079259
Energy: 0.379554022716333
Energy: 0.28909662614788495
Energy: 0.355327600230638
Energy: 0.28909662614788495
Energy: 0.3553276002300964
Energy: 0.28909662614788495
Energy: 0.355327600230638
Energy: 0.31520279380048477
Energy: 0.3140600231892333
Energy: 0.31520279380048477
Energy: 0.3140600231892333
Energy: 0.31520279380048477
Energy: 0.3140600231892333
Energy: 0.31678496224400904
Energy: 0.35545975238356503
Energy: 0.31678496224400904
Energy: 0.35545975238356503
Energy: 0.31678496224400904
Energy: 0.35545975238356503
Energy: 0.3180234518043534
Energy: 0.37794520229292766
Energy: 0.3180234518043534
Energy: 0.37794520229292766
Energy: 0.3180234518043534
Energy: 0.37794520229292766
Energy: 0.3037858910979451
Energy: 0.313499976308603
Energy: 0.30378589109848675
Energy: 0.313499976308603
Energy: 0.3037858910979451
Energy: 0.313499976308603
Energy: 0.28807799334440676
Energy: 0.35395528902460477
Energy: 0.2880779933438652
Energy: 0.35395528902460477
Energy: 0.28807799334440676
Energy: 0.35395528902460477

minimum gb energy = 0.27894119648368826 eV
minimum distance =  2.5449657557394 Angstroms
sigma value = 43


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

Energy: 0.35865841761957223
Energy: 0.26836559574352614
Energy: 0.35865841761957223
Energy: 0.26836559574313157
Energy: 0.35865841761957223
Energy: 0.26836559574313157
Energy: 0.29182513873081173
Energy: 0.26942187877235385
Energy: 0.29182513873081173
Energy: 0.2694218787719592
Energy: 0.29182513873081173
Energy: 0.2694218787719592
Energy: 0.28668778625297686
Energy: 0.30377202014569465
Energy: 0.28668778625297686
Energy: 0.30377202014569465
Energy: 0.28668778625258223
Energy: 0.30377202014569465
Energy: 0.2674347938676167
Energy: 0.2807321821841443
Energy: 0.26743479386722213
Energy: 0.2807321821841443
Energy: 0.2674347938676167
Energy: 0.2807321821841443
Energy: 0.29150366406001976
Energy: 0.25080760583469974
Energy: 0.29150366406001976
Energy: 0.25080760583469974
Energy: 0.29150366406001976
Energy: 0.25080760583469974
Energy: 0.2759090069134896
Energy: 0.26584736037723344
Energy: 0.2759090069134896
Energy: 0.26584736037723344
Energy: 0.2759090069134896
Energy: 0.26584736037723344
Energy: 0.3223117149457471
Energy: 0.2778271493147371
Energy: 0.3223117149457471
Energy: 0.2778271493147371
Energy: 0.3223117149457471
Energy: 0.2778271493147371
Energy: 0.2926485972659689
Energy: 0.3084543590864612
Energy: 0.29264859726123366
Energy: 0.3084543590864612
Energy: 0.2926485972628121
Energy: 0.3084543590864612
Energy: 0.2637816992704326
Energy: 0.2612304003619232
Energy: 0.2637816992704326
Energy: 0.2612304003619232
Energy: 0.2637816992704326
Energy: 0.2612304003619232
Energy: 0.2931281482581742
Energy: 0.2645209119888499
Energy: 0.2931281482581742
Energy: 0.2645209119888499
Energy: 0.2931281482581742
Energy: 0.2645209119888499
Energy: 0.3154337948567069
Energy: 0.3119069505081622
Energy: 0.3154337948567069
Energy: 0.3119069505081622
Energy: 0.3154337948567069
Energy: 0.3119069505081622
Energy: 0.250553952419309
Energy: 0.2869863830937051
Energy: 0.2505539524197036
Energy: 0.2869863830937051
Energy: 0.2505539524197036
Energy: 0.2869863830937051
Energy: 0.2931428921045161
Energy: 0.2499222314156642
Energy: 0.2931428921045161
Energy: 0.2499222314156642
Energy: 0.2931428921045161
Energy: 0.2499222314156642
Energy: 0.3143695449103524
Energy: 0.31326482159938634
Energy: 0.3143695449103524
Energy: 0.31326482159938634
Energy: 0.3143695449103524
Energy: 0.31326482159938634
Energy: 0.2600630950599462
Energy: 0.28741972964896545
Energy: 0.2600630950599462
Energy: 0.28741972964896545
Energy: 0.2600630950599462
Energy: 0.28741972964896545
Energy: 0.3022400999524036
Energy: 0.2886062979033282
Energy: 0.3022400999524036
Energy: 0.2886062979033282
Energy: 0.3022400999524036
Energy: 0.2886062979033282
Energy: 0.31987916114185
Energy: 0.3119643514901199
Energy: 0.31987916114185
Energy: 0.3119643514901199
Energy: 0.31987916114185
Energy: 0.3119643514901199
Energy: 0.2682034643032867
Energy: 0.3185544832999431
Energy: 0.26820346430368125
Energy: 0.3185544832999431
Energy: 0.26820346430368125
Energy: 0.3185544832999431
Energy: 0.28638051347954574
Energy: 0.286093941299389
Energy: 0.28638051347954574
Energy: 0.28609394129978355
Energy: 0.28638051347954574
Energy: 0.28609394129978355
Energy: 0.32878514179095686
Energy: 0.28420001436442704
Energy: 0.32878514179095686
Energy: 0.28420001436442704
Energy: 0.32878514179095686
Energy: 0.28420001436442704
Energy: 0.28911532286430713
Energy: 0.26976454032339525
Energy: 0.28911532286430713
Energy: 0.26976454032339525
Energy: 0.28911532286430713
Energy: 0.26976454032339525
Energy: 0.27825488172432783
Energy: 0.28852601714872084
Energy: 0.27825488172432783
Energy: 0.28852601714872084
Energy: 0.27825488172432783
Energy: 0.2885260171491154
Energy: 0.2733501249044989
Energy: 0.28703058492283523
Energy: 0.27335012490410426
Energy: 0.28703058492283523
Energy: 0.27335012490410426
Energy: 0.28703058492283523
Energy: 0.30355604207328796
Energy: 0.2699516287554569
Energy: 0.30355604207289333
Energy: 0.2699516287546677
Energy: 0.30355604207328796
Energy: 0.2699516287562461
Energy: 0.2874118027620328
Energy: 0.28234635396863483
Energy: 0.2874118027620328
Energy: 0.28234635396863483
Energy: 0.2874118027620328
Energy: 0.28234635396863483
Energy: 0.28742494499376625
Energy: 0.27824286572153895
Energy: 0.28742494499376625
Energy: 0.2782428657219336
Energy: 0.28742494499376625
Energy: 0.2782428657219336
Energy: 0.2798068859896566
Energy: 0.3253746326707597
Energy: 0.2798068859900511
Energy: 0.3253746326707597
Energy: 0.2743170847664543
Energy: 0.3253746326707597
Energy: 0.2751704197486109
Energy: 0.27973914780132014
Energy: 0.2751704197486109
Energy: 0.27973914780132014
Energy: 0.2751704197486109
Energy: 0.2797391478009255
Energy: 0.25855416014237464
Energy: 0.26272209853326595
Energy: 0.25855416014237464
Energy: 0.26272209853326595
Energy: 0.25855416014237464
Energy: 0.26272209853326595
Energy: 0.2581451104608131
Energy: 0.3138861721646249
Energy: 0.2581451104604185
Energy: 0.3138861721646249
Energy: 0.2581451104608131
Energy: 0.3138861721646249
Energy: 0.27639080575272695
Energy: 0.28103613663346777
Energy: 0.27639080575272695
Energy: 0.28103613663346777
Energy: 0.27639080575272695
Energy: 0.28103613663346777
Energy: 0.25875123561139146
Energy: 0.2524262575914774
Energy: 0.25875123561139146
Energy: 0.2524262575914774
Energy: 0.25875123561139146
Energy: 0.2524262575914774
Energy: 0.2491003132443409
Energy: 0.28200700397635337
Energy: 0.2491003132443409
Energy: 0.28200700397635337
Energy: 0.2491003132443409
Energy: 0.28200700397635337
Energy: 0.31442277590581585
Energy: 0.3155630597850916
Energy: 0.31442277590581585
Energy: 0.3155630597850916
Energy: 0.31442277590581585
Energy: 0.3155630597850916
Energy: 0.2693370821601557
Energy: 0.24461999626799383
Energy: 0.2693370821601557
Energy: 0.24461999626799383
Energy: 0.2693370821601557
Energy: 0.24461999626799383
Energy: 0.2296582836135359
Energy: 0.28136855697274965
Energy: 0.22965828361393054
Energy: 0.28136855697274965
Energy: 0.2296582836135359
Energy: 0.28136855697274965

minimum gb energy = 0.2296582836135359 eV
minimum distance =  2.5384645903486 Angstroms
sigma value = 81


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

Energy: 0.010980567141519222
Energy: 0.026800138329616228
Energy: 0.010980567141519222
Energy: 0.026800138329616228
Energy: 0.010980567141519222
Energy: 0.026800138329616228
Energy: 0.2291999483080245
Energy: 0.06074437545034143
Energy: 0.2291999483080245
Energy: 0.06074437545048971
Energy: 0.2291999483080245
Energy: 0.06074437545034143
Energy: 0.2292095826526404
Energy: 0.061028729481744974
Energy: 0.2292095826527722
Energy: 0.06102872948187678
Energy: 0.2292095826526404
Energy: 0.061028729481744974
Energy: 0.010980567141519222
Energy: 0.026800138329616228
Energy: 0.010980567141519222
Energy: 0.026800138329616228
Energy: 0.010980567141519222
Energy: 0.026800138329616228
Energy: 0.2291999483078762
Energy: 0.06074437545048971
Energy: 0.2291999483080245
Energy: 0.06074437545048971
Energy: 0.2291999483080245
Energy: 0.06074437545034143
Energy: 0.2292095826527722
Energy: 0.061028729481744974
Energy: 0.2292095826526404
Energy: 0.061028729481744974
Energy: 0.2292095826526404
Energy: 0.061028729481744974
Energy: 0.010980567141519222
Energy: 0.026800138329616228
Energy: 0.010980567141519222
Energy: 0.026800138329616228
Energy: 0.010980567141519222
Energy: 0.02680013832946795
Energy: 0.2291999483080245
Energy: 0.06074437545048971
Energy: 0.2291999483078762
Energy: 0.06074437545048971
Energy: 0.2291999483080245
Energy: 0.06074437545034143
Energy: 0.2292095826526404
Energy: 0.061028729481744974
Energy: 0.2292095826526404
Energy: 0.061028729481744974
Energy: 0.2292095826526404
Energy: 0.061028729481744974
Energy: 0.010980567141519222
Energy: 0.026800138329616228
Energy: 0.010980567141519222
Energy: 0.026800138329616228
Energy: 0.010980567141519222
Energy: 0.02680013832946795

minimum gb energy = 0.010980567141519222 eV
minimum distance =  2.77180049065183 Angstroms
sigma value = 3


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

Energy: 0.26167548443044614
Energy: 0.26099841175741517
Energy: 0.26167548443044614
Energy: 0.26099841175741517
Energy: 0.26167548443044614
Energy: 0.26099841175741517
Energy: 0.22886106975692555
Energy: 0.2251031989373402
Energy: 0.22886106975692555
Energy: 0.2251031989373402
Energy: 0.22886106975692555
Energy: 0.2251031989373402
Energy: 0.22888436153559208
Energy: 0.2255529494337887
Energy: 0.22888436153559208
Energy: 0.2255529494337887
Energy: 0.22888436153559208
Energy: 0.2255529494337887
Energy: 0.21938589616914464
Energy: 0.2392510320235244
Energy: 0.21938589616914464
Energy: 0.2392510320235244
Energy: 0.21938589616914464
Energy: 0.2392510320235244
Energy: 0.21132665156567895
Energy: 0.22214052901575126
Energy: 0.21132665156567895
Energy: 0.22214052901575126
Energy: 0.21132665156567895
Energy: 0.22214052901575126
Energy: 0.22980752836895046
Energy: 0.22182405121166296
Energy: 0.22980752836895046
Energy: 0.22182405121166296
Energy: 0.22980752836895046
Energy: 0.22182405121166296
Energy: 0.2232221709938167
Energy: 0.23775334148874938
Energy: 0.2232221709938167
Energy: 0.23775334148874938
Energy: 0.2232221709938167
Energy: 0.23775334148874938
Energy: 0.21099785583341293
Energy: 0.22178329048125678
Energy: 0.21099785583341293
Energy: 0.22178329048169063
Energy: 0.21099785583341293
Energy: 0.22178329048125678
Energy: 0.23236201312355842
Energy: 0.2237995419564933
Energy: 0.23236201312355842
Energy: 0.22379954195692714
Energy: 0.23236201312355842
Energy: 0.22379954195692714
Energy: 0.22200056330406065
Energy: 0.22189239124197857
Energy: 0.22200056330406065
Energy: 0.22189239124154467
Energy: 0.22200056330406065
Energy: 0.22189239124154467
Energy: 0.22337591589373068
Energy: 0.22191539185735615
Energy: 0.22337591589373068
Energy: 0.22191539185735615
Energy: 0.22337591589329678
Energy: 0.22191539185735615
Energy: 0.23653258908719788
Energy: 0.24055056939929859
Energy: 0.23653258908719788
Energy: 0.24055056939929859
Energy: 0.23653258908719788
Energy: 0.24055056939929859
Energy: 0.22469535268030283
Energy: 0.21144178819238954
Energy: 0.22469535268030283
Energy: 0.21144178819282342
Energy: 0.22469535268030283
Energy: 0.21144178819282342
Energy: 0.2290914654278636
Energy: 0.2328416650095289
Energy: 0.2290914654278636
Energy: 0.2328416650095289
Energy: 0.2290914654278636
Energy: 0.2328416650095289
Energy: 0.21926316449404185
Energy: 0.2353592147097144
Energy: 0.21926316449404185
Energy: 0.2353592147097144
Energy: 0.21926316449404185
Energy: 0.2353592147097144
Energy: 0.22470438599065176
Energy: 0.21011348874578495
Energy: 0.22470438599108566
Energy: 0.21011348874578495
Energy: 0.22470438599065176
Energy: 0.21011348874578495
Energy: 0.24886821562067307
Energy: 0.24375384755155205
Energy: 0.24886821562067307
Energy: 0.24375384755155205
Energy: 0.24886821562067307
Energy: 0.2437538475511182
Energy: 0.2423086342966728
Energy: 0.23005889978942487
Energy: 0.2423086342966728
Energy: 0.23005889978942487
Energy: 0.2423086342966728
Energy: 0.23005889978942487
Energy: 0.22453786759574995
Energy: 0.2257885002886641
Energy: 0.22453786759531605
Energy: 0.2257885002886641
Energy: 0.22453786759574995
Energy: 0.2257885002886641
Energy: 0.2270263042190856
Energy: 0.25768017054394143
Energy: 0.2270263042190856
Energy: 0.25768017054394143
Energy: 0.22702630421951953
Energy: 0.25768017054394143
Energy: 0.25740591824461045
Energy: 0.23372820063424077
Energy: 0.25740591824461045
Energy: 0.23372820063424077
Energy: 0.25740591824461045
Energy: 0.23372820063424077
Energy: 0.21791547192172192
Energy: 0.22620922888365802
Energy: 0.21791547192172192
Energy: 0.22620922888365802
Energy: 0.21791547192172192
Energy: 0.22620922888365802
Energy: 0.23820658013601165
Energy: 0.21226657642007823
Energy: 0.23820658013601165
Energy: 0.21226657642007823
Energy: 0.23820658013601165
Energy: 0.21226657642051214
Energy: 0.23937223744233965
Energy: 0.2276729445033608
Energy: 0.2393722374427735
Energy: 0.2276729445033608
Energy: 0.23937223744233965
Energy: 0.2276729445033608
Energy: 0.22510964977454884
Energy: 0.23206026594663698
Energy: 0.22510964977454884
Energy: 0.23206026594663698
Energy: 0.22510964977454884
Energy: 0.23206026594663698
Energy: 0.23547632778386376
Energy: 0.22215312443135832
Energy: 0.23547632778386376
Energy: 0.22215312443135832
Energy: 0.23547632778386376
Energy: 0.22215312443135832
Energy: 0.26428140427394164
Energy: 0.21254226188335196
Energy: 0.2642814042743756
Energy: 0.21254226188335196
Energy: 0.26428140427394164
Energy: 0.21254226188335196
Energy: 0.22203117746149525
Energy: 0.23321655484692846
Energy: 0.22203117746149525
Energy: 0.23321655484692846
Energy: 0.22203117746149525
Energy: 0.23321655484692846
Energy: 0.22962883413237953
Energy: 0.22566708386790205
Energy: 0.22962883413237953
Energy: 0.22566708386746814
Energy: 0.22962883413237953
Energy: 0.22566708386746814
Energy: 0.26868102858989007
Energy: 0.2262055993431894
Energy: 0.26868102858989007
Energy: 0.2262055993431894
Energy: 0.26868102858989007
Energy: 0.2262055993431894
Energy: 0.22261898505330374
Energy: 0.23427651606284905
Energy: 0.22261898505330374
Energy: 0.23427651606284905
Energy: 0.22261898505330374
Energy: 0.23427651606284905
Energy: 0.2196557505319746
Energy: 0.221706061952392
Energy: 0.2196557505319746
Energy: 0.221706061952392
Energy: 0.2196557505319746
Energy: 0.221706061952392
Energy: 0.2267311299489756
Energy: 0.23348038047724207
Energy: 0.2267311299489756
Energy: 0.23348038047724207
Energy: 0.2267311299489756
Energy: 0.23348038047724207

minimum gb energy = 0.21011348874578495 eV
minimum distance =  2.6261875233618 Angstroms
sigma value = 67


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

Energy: 0.3095076173177689
Energy: 0.30564516398400665
Energy: 0.3095076173177689
Energy: 0.3056451639833884
Energy: 0.3095076173177689
Energy: 0.30564516398400665
Energy: 0.2935855280320191
Energy: 0.29179981960677764
Energy: 0.2935855280320191
Energy: 0.29179981960677764
Energy: 0.2935855280320191
Energy: 0.29179981960677764
Energy: 0.30073424531496473
Energy: 0.2905253255347757
Energy: 0.30073424531496473
Energy: 0.2905253255347757
Energy: 0.3007342453143465
Energy: 0.2905253255347757
Energy: 0.2984192477206089
Energy: 0.3084791582284044
Energy: 0.2984192477200187
Energy: 0.3084791582284044
Energy: 0.2984192477200187
Energy: 0.3084791582284044
Energy: 0.28332715332351144
Energy: 0.2877915483044798
Energy: 0.28332715332351144
Energy: 0.28779154830386156
Energy: 0.28332715332351144
Energy: 0.2877915483044798
Energy: 0.2991685260429083
Energy: 0.2868319580623754
Energy: 0.2991685260429083
Energy: 0.2868319580623754
Energy: 0.2991685260429083
Energy: 0.2868319580623754
Energy: 0.32605361127725707
Energy: 0.2994933417883112
Energy: 0.32605361127725707
Energy: 0.2994933417883112
Energy: 0.32605361127725707
Energy: 0.2994933417883112
Energy: 0.30427039747314266
Energy: 0.2915757672129891
Energy: 0.30427039747314266
Energy: 0.2915757672129891
Energy: 0.30427039747314266
Energy: 0.2915757672129891
Energy: 0.3080944054566533
Energy: 0.31093266009927356
Energy: 0.3080944054566533
Energy: 0.31093266009927356
Energy: 0.3080944054566533
Energy: 0.31093266009927356
Energy: 0.28393783078201235
Energy: 0.2828263518218243
Energy: 0.28393783078201235
Energy: 0.28282635182120613
Energy: 0.28393783078201235
Energy: 0.28282635182120613
Energy: 0.3029267160088797
Energy: 0.29127204067131346
Energy: 0.30292671600949794
Energy: 0.29127204067131346
Energy: 0.30292671600949794
Energy: 0.29127204067131346
Energy: 0.2829451033404566
Energy: 0.3018390312614981
Energy: 0.2829451033404566
Energy: 0.3018390312614981
Energy: 0.2829451033404566
Energy: 0.3018390312614981
Energy: 0.2855205478557647
Energy: 0.2875505086711923
Energy: 0.2855205478557647
Energy: 0.2875505086711923
Energy: 0.2855205478557647
Energy: 0.2875505086711923
Energy: 0.2969399089858402
Energy: 0.29578296385671493
Energy: 0.2969399089858402
Energy: 0.29578296385671493
Energy: 0.2969399089858402
Energy: 0.29578296385671493
Energy: 0.29608384443003055
Energy: 0.29251847237950757
Energy: 0.29608384443003055
Energy: 0.29251847237950757
Energy: 0.29608384443003055
Energy: 0.29251847237950757
Energy: 0.29638930195060526
Energy: 0.2928107428738498
Energy: 0.29638930195060526
Energy: 0.2928107428738498
Energy: 0.29638930195060526
Energy: 0.2928107428738498
Energy: 0.3115178213561283
Energy: 0.29592854350041364
Energy: 0.3115178213561283
Energy: 0.29592854350041364
Energy: 0.3115178213561283
Energy: 0.29592854350041364
Energy: 0.30582544434870207
Energy: 0.2866400584785258
Energy: 0.30582544434870207
Energy: 0.2866400584785258
Energy: 0.30582544434870207
Energy: 0.2866400584785258
Energy: 0.2910090266314028
Energy: 0.30275575566578794
Energy: 0.2910090266314028
Energy: 0.30275575566578794
Energy: 0.2910090266314028
Energy: 0.30275575566578794
Energy: 0.28545811598672516
Energy: 0.2936649468440307
Energy: 0.28545811598672516
Energy: 0.2936649468434125
Energy: 0.2854581159861069
Energy: 0.2936649468440307
Energy: 0.30922479624653487
Energy: 0.2860294636935892
Energy: 0.30922479624653487
Energy: 0.2860294636935892
Energy: 0.30922479624653487
Energy: 0.2860294636935892
Energy: 0.2994080309045797
Energy: 0.3101292838657953
Energy: 0.2994080309045797
Energy: 0.3101292838657953
Energy: 0.2994080309045797
Energy: 0.3101292838657953
Energy: 0.2932446427693634
Energy: 0.2907434961864734
Energy: 0.2932446427693634
Energy: 0.2907434961864734
Energy: 0.29324464276998163
Energy: 0.2907434961864734

minimum gb energy = 0.28282635182120613 eV
minimum distance =  2.63089921435701 Angstroms
sigma value = 33


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

Energy: 0.3523344798836703
Energy: 0.3487102750225387
Energy: 0.3523344798836703
Energy: 0.3487102750225387
Energy: 0.3523344798836703
Energy: 0.3487102750225387
Energy: 0.3377616859135708
Energy: 0.33099367519543166
Energy: 0.3377616859135708
Energy: 0.33099367519543166
Energy: 0.3377616859135708
Energy: 0.33099367519543166
Energy: 0.3513447338967106
Energy: 0.33029791959392324
Energy: 0.3513447338967106
Energy: 0.33029791959392324
Energy: 0.3513447338967106
Energy: 0.33029791959392324
Energy: 0.33989925894832274
Energy: 0.3518998359161576
Energy: 0.33989925894832274
Energy: 0.3518998359161576
Energy: 0.33989925894832274
Energy: 0.3518998359161576
Energy: 0.3338514212494174
Energy: 0.32770296629116064
Energy: 0.3338514212494174
Energy: 0.32770296629116064
Energy: 0.3338514212494174
Energy: 0.32770296629116064
Energy: 0.36772638821342246
Energy: 0.34691373647585216
Energy: 0.36772638821342246
Energy: 0.36979910285931844
Energy: 0.36772638821342246
Energy: 0.3599687225222677
Energy: 0.3393623751455361
Energy: 0.3403163405702306
Energy: 0.3393623751455361
Energy: 0.3403163405702306
Energy: 0.3393623751455361
Energy: 0.3403163405702306
Energy: 0.34845546091766794
Energy: 0.3352142175899271
Energy: 0.3484554609172757
Energy: 0.3352142175899271
Energy: 0.3484554609172757
Energy: 0.3352142175895349
Energy: 0.3247598273514493
Energy: 0.3502794668976684
Energy: 0.3247598273514493
Energy: 0.3502794668976684
Energy: 0.3247598273514493
Energy: 0.3502794668976684
Energy: 0.35126352583262777
Energy: 0.3323732617084562
Energy: 0.35126352583262777
Energy: 0.3323732617080641
Energy: 0.35126352583223563
Energy: 0.3323732617084562
Energy: 0.3447250321536416
Energy: 0.3274315831292054
Energy: 0.3447250321536416
Energy: 0.3274315831292054
Energy: 0.3447250321536416
Energy: 0.3274315831292054
Energy: 0.3362904872431416
Energy: 0.3359094385373667
Energy: 0.3362904872431416
Energy: 0.3359094385373667
Energy: 0.3362904872427494
Energy: 0.3359094385373667
Energy: 0.3463623964477534
Energy: 0.3379971317371318
Energy: 0.3463623964477534
Energy: 0.337997131737524
Energy: 0.3463623964477534
Energy: 0.337997131737524
Energy: 0.33645363459738714
Energy: 0.33157623703444
Energy: 0.33645363459738714
Energy: 0.33157623703483224
Energy: 0.33645363459738714
Energy: 0.33157623703483224
Energy: 0.3475374857447814
Energy: 0.34442440393158663
Energy: 0.34753748574438925
Energy: 0.34442440393158663
Energy: 0.34753748574438925
Energy: 0.34442440393158663
Energy: 0.3394407193170046
Energy: 0.34760006968123663
Energy: 0.3394407193170046
Energy: 0.34760006968123663
Energy: 0.3394407193170046
Energy: 0.34760006968123663
Energy: 0.3297879513476383
Energy: 0.3310387658527096
Energy: 0.3297879513476383
Energy: 0.3310387658527096
Energy: 0.3297879513476383
Energy: 0.3310387658527096
Energy: 0.3575736868361305
Energy: 0.35831511322816517
Energy: 0.3575736868361305
Energy: 0.3583151132285574
Energy: 0.3575736868361305
Energy: 0.35831511322816517
Energy: 0.3374732042633232
Energy: 0.3555134647891852
Energy: 0.337473204262931
Energy: 0.35551346478957746
Energy: 0.337473204262931
Energy: 0.35551346478957746
Energy: 0.3482888930124973
Energy: 0.33144315033346894
Energy: 0.3482888930124973
Energy: 0.33144315033346894
Energy: 0.3482888930124973
Energy: 0.33144315033346894
Energy: 0.3393664836158719
Energy: 0.34923145437252523
Energy: 0.3393664836158719
Energy: 0.34923145437252523
Energy: 0.3393664836158719
Energy: 0.34923145437252523
Energy: 0.3446809748724169
Energy: 0.3301202044874118
Energy: 0.3446809748724169
Energy: 0.3301202044874118
Energy: 0.3446809748720247
Energy: 0.3301202044874118
Energy: 0.35626187862171405
Energy: 0.32723812668124597
Energy: 0.35626187862171405
Energy: 0.32723812668124597
Energy: 0.35626187862171405
Energy: 0.32723812668124597
Energy: 0.3511538576144305
Energy: 0.35458846554857265
Energy: 0.3511538576144305
Energy: 0.3367513878584437
Energy: 0.35115385761403833
Energy: 0.3367513878584437
Energy: 0.33553247322669205
Energy: 0.33582537775466126
Energy: 0.33553247322669205
Energy: 0.33582537775466126
Energy: 0.33553247322669205
Energy: 0.33582537775466126
Energy: 0.35361876511876805
Energy: 0.3336798432992955
Energy: 0.3536187651183758
Energy: 0.3336798432992955
Energy: 0.35361876511876805
Energy: 0.3336798432992955
Energy: 0.33751004690446695
Energy: 0.33093220037019816
Energy: 0.33751004690446695
Energy: 0.33093220037019816
Energy: 0.33751004690485914
Energy: 0.33093220037019816
Energy: 0.3403138200623638
Energy: 0.35734221969963165
Energy: 0.3403138200619717
Energy: 0.35734221969963165
Energy: 0.3403138200619717
Energy: 0.35734221969963165
Energy: 0.3465754646567303
Energy: 0.32798870395930774
Energy: 0.3465754646567303
Energy: 0.32798870395930774
Energy: 0.3465754646567303
Energy: 0.32798870395930774
Energy: 0.33792612812290246
Energy: 0.34220143430187167
Energy: 0.33792612812290246
Energy: 0.34220143430187167
Energy: 0.33792612812290246
Energy: 0.34220143430187167
Energy: 0.3670271498068813
Energy: 0.3584467833852887
Energy: 0.3670271498068813
Energy: 0.3584467833852887
Energy: 0.3670271498068813
Energy: 0.3584467833852887
Energy: 0.3347683425189793
Energy: 0.33171661650921813
Energy: 0.3347683425189793
Energy: 0.33171661650921813
Energy: 0.3347683425189793
Energy: 0.33171661650921813
Energy: 0.3385267442708041
Energy: 0.343669953300444
Energy: 0.3385267442708041
Energy: 0.343669953300444
Energy: 0.3385267442708041
Energy: 0.343669953300444
Energy: 0.3456405353924735
Energy: 0.3301957694568505
Energy: 0.3456405353924735
Energy: 0.3301957694568505
Energy: 0.3456405353924735
Energy: 0.3301957694568505
Energy: 0.33550153504178065
Energy: 0.3308595797456138
Energy: 0.33550153504178065
Energy: 0.3308595797456138
Energy: 0.33550153504178065
Energy: 0.33085957974600605
Energy: 0.35062174772915283
Energy: 0.33815171428516605
Energy: 0.35062174772915283
Energy: 0.33815171428516605
Energy: 0.35062174772915283
Energy: 0.3381517142847738
Energy: 0.33623919922889917
Energy: 0.34197485633515334
Energy: 0.33623919922889917
Energy: 0.34197485633515334
Energy: 0.33623919922889917
Energy: 0.34197485633515334

minimum gb energy = 0.3247598273514493 eV
minimum distance =  2.59277215731035 Angstroms
sigma value = 41


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

Energy: 0.4141350394483566
Energy: 0.438704371859209
Energy: 0.4141350394483566
Energy: 0.4387043718581382
Energy: 0.4141350394483566
Energy: 0.438704371859209
Energy: 0.4220164604016366
Energy: 0.3956225049365508
Energy: 0.4220164604016366
Energy: 0.3956225049365508
Energy: 0.4220164604016366
Energy: 0.3956225049365508
Energy: 0.4366113740009174
Energy: 0.39361978316718615
Energy: 0.4366113740009174
Energy: 0.39361978316718615
Energy: 0.4366113740009174
Energy: 0.39361978316718615
Energy: 0.4108209138991429
Energy: 0.42428265922894276
Energy: 0.4108209138991429
Energy: 0.42428265922894276
Energy: 0.4108209138991429
Energy: 0.42428265922894276
Energy: 0.42969564938063487
Energy: 0.3995777234300194
Energy: 0.42969564938063487
Energy: 0.3995777234300194
Energy: 0.42969564938063487
Energy: 0.3995777234300194
Energy: 0.44640872189097897
Energy: 0.4333755560774487
Energy: 0.44640872189097897
Energy: 0.4333755560774487
Energy: 0.44640872189097897
Energy: 0.4333755560774487
Energy: 0.40609432168173004
Energy: 0.39216748083232594
Energy: 0.40609432168065923
Energy: 0.39216748083232594
Energy: 0.40609432168173004
Energy: 0.39216748083232594
Energy: 0.4294926117255243
Energy: 0.3960131952976522
Energy: 0.4294926117255243
Energy: 0.3960131952976522
Energy: 0.4294926117255243
Energy: 0.3960131952976522
Energy: 0.406204537222556
Energy: 0.40731021210314516
Energy: 0.406204537222556
Energy: 0.40731021210314516
Energy: 0.406204537222556
Energy: 0.40731021210314516
Energy: 0.409531911840699
Energy: 0.4099486827953372
Energy: 0.409531911840699
Energy: 0.4099486827953372
Energy: 0.409531911840699
Energy: 0.4099486827953372
Energy: 0.40351931128017304
Energy: 0.39407742559778025
Energy: 0.40351931128017304
Energy: 0.39407742559778025
Energy: 0.40351931128017304
Energy: 0.39407742559778025
Energy: 0.41941944291565836
Energy: 0.3948390016039574
Energy: 0.41941944291565836
Energy: 0.3948390016039574
Energy: 0.41941944291565836
Energy: 0.3948390016039574
Energy: 0.4124375361275508
Energy: 0.42552142344946936
Energy: 0.4124375361275508
Energy: 0.42552142344946936
Energy: 0.4124375361275508
Energy: 0.42552142344946936
Energy: 0.43422433729880416
Energy: 0.39611304653142165
Energy: 0.43422433729880416
Energy: 0.39611304653142165
Energy: 0.43422433729880416
Energy: 0.39611304653142165

minimum gb energy = 0.39216748083232594 eV
minimum distance =  2.59257672409586 Angstroms
sigma value = 11


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

Energy: 0.49520420016486233
Energy: 0.473454581140903
Energy: 0.49520420016486233
Energy: 0.473454581140903
Energy: 0.49520420016486233
Energy: 0.473454581140903
Energy: 0.4654904362875405
Energy: 0.46006883643095514
Energy: 0.46549043628801096
Energy: 0.46006883643095514
Energy: 0.4654904362875405
Energy: 0.46006883643095514
Energy: 0.4932142382819967
Energy: 0.4648956517599559
Energy: 0.5018387698257678
Energy: 0.46489565176042635
Energy: 0.4920102930101208
Energy: 0.4648956517599559
Energy: 0.4779088146343263
Energy: 0.46329313982520975
Energy: 0.4779088146343263
Energy: 0.46329313982520975
Energy: 0.4779088146343263
Energy: 0.46329313982520975
Energy: 0.4912703949498615
Energy: 0.46586091992309697
Energy: 0.4912703949498615
Energy: 0.4658609199235673
Energy: 0.4912703949498615
Energy: 0.4658609199235673
Energy: 0.4692364103330439
Energy: 0.48042712309882457
Energy: 0.4692364103330439
Energy: 0.4804271230983541
Energy: 0.4692364103330439
Energy: 0.4804271230983541
Energy: 0.47467982877665493
Energy: 0.4719261880355903
Energy: 0.47467982877665493
Energy: 0.4719261880355903
Energy: 0.47467982877665493
Energy: 0.4719261880355903
Energy: 0.47268326066936567
Energy: 0.47073571383214124
Energy: 0.47268326066936567
Energy: 0.47073571383214124
Energy: 0.47268326066936567
Energy: 0.47073571383214124
Energy: 0.4827073549058779
Energy: 0.4706590454510641
Energy: 0.4827073549058779
Energy: 0.4706590454510641
Energy: 0.4827073549054075
Energy: 0.4706590454510641
Energy: 0.4648664056975659
Energy: 0.4891569806095201
Energy: 0.4648664056975659
Energy: 0.4891569806095201
Energy: 0.4648664056975659
Energy: 0.4891569806095201
Energy: 0.4633441748508976
Energy: 0.4689040693993479
Energy: 0.4633441748508976
Energy: 0.4689040693993479
Energy: 0.4633441748508976
Energy: 0.4689040693993479
Energy: 0.48018861069592034
Energy: 0.4776306286431805
Energy: 0.4801886106963908
Energy: 0.4776306286431805
Energy: 0.48018861069592034
Energy: 0.4776306286431805
Energy: 0.4726920633280758
Energy: 0.4718045959262549
Energy: 0.4726920633280758
Energy: 0.4718045959262549
Energy: 0.4726920633276053
Energy: 0.4718045959262549
Energy: 0.48941706779312405
Energy: 0.4734775694813228
Energy: 0.48941706779312405
Energy: 0.4734775694813228
Energy: 0.48941706779312405
Energy: 0.4734775694813228
Energy: 0.4791939613036564
Energy: 0.48578745441423793
Energy: 0.4791939613036564
Energy: 0.48578745441423793
Energy: 0.4791939613036564
Energy: 0.48578745441423793
Energy: 0.47309249551120613
Energy: 0.4784362928077726
Energy: 0.47309249551120613
Energy: 0.4784362928077726
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Energy: 0.4784362928077726
Energy: 0.46496424147181664
Energy: 0.4640101097537337
Energy: 0.46496424147181664
Energy: 0.4640101097537337
Energy: 0.46496424147181664
Energy: 0.4640101097537337
Energy: 0.4773541512610892
Energy: 0.4780553914612491
Energy: 0.4773541512610892
Energy: 0.4780553914612491
Energy: 0.4773541512610892
Energy: 0.4780553914612491
Energy: 0.46766167125527214
Energy: 0.46072347298659927
Energy: 0.46766167125527214
Energy: 0.46072347298659927
Energy: 0.46766167125527214
Energy: 0.46072347298659927
Energy: 0.4826188549592982
Energy: 0.4661574209177785
Energy: 0.4826188549592982
Energy: 0.4661574209177785
Energy: 0.4826188549592982
Energy: 0.4661574209177785
Energy: 0.4758613630807541
Energy: 0.4788683887955026
Energy: 0.4758613630807541
Energy: 0.4788683887955026
Energy: 0.4758613630807541
Energy: 0.4788683887955026
Energy: 0.4871408837750892
Energy: 0.49193315021615786
Energy: 0.4871408837750892
Energy: 0.49193315021615786
Energy: 0.4871408837750892
Energy: 0.49193315021615786
Energy: 0.4787044049999188
Energy: 0.464830800503239
Energy: 0.4787044049999188
Energy: 0.464830800503239
Energy: 0.4787044049999188
Energy: 0.464830800503239
Energy: 0.4889708951014768
Energy: 0.46955191021395454
Energy: 0.4889708951014768
Energy: 0.46955191021395454
Energy: 0.4889708951014768
Energy: 0.46955191021395454
Energy: 0.46790015689040304
Energy: 0.4769286846300557
Energy: 0.46790015689040304
Energy: 0.4769286846300557
Energy: 0.46790015689040304
Energy: 0.4769286846300557
Energy: 0.4738722989740948
Energy: 0.4657993980282893
Energy: 0.4738722989745651
Energy: 0.4657993980282893
Energy: 0.4738722989745651
Energy: 0.4657993980282893
Energy: 0.46614022032276464
Energy: 0.49242017838750357
Energy: 0.46614022032276464
Energy: 0.49242017838750357
Energy: 0.46614022032276464
Energy: 0.49242017838750357
Energy: 0.47306942162104443
Energy: 0.4737676426794333
Energy: 0.47306942162104443
Energy: 0.4737676426794333
Energy: 0.47306942162104443
Energy: 0.4737676426794333
Energy: 0.4704975320351272
Energy: 0.4706551160653986
Energy: 0.4704975320346568
Energy: 0.4706551160653986
Energy: 0.4704975320346568
Energy: 0.4706551160653986
Energy: 0.4702360996098775
Energy: 0.4635415935057648
Energy: 0.47023609960940715
Energy: 0.4635415935057648
Energy: 0.47023609960940715
Energy: 0.4635415935057648
Energy: 0.46707865236000284
Energy: 0.49191767722415136
Energy: 0.46707865236047325
Energy: 0.49191767722415136
Energy: 0.46707865236000284
Energy: 0.49191767722415136

minimum gb energy = 0.46006883643095514 eV
minimum distance =  2.55027384859274 Angstroms
sigma value = 57


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

Energy: 0.48955491951119734
Energy: 0.5029890213860592
Energy: 0.48955491951119734
Energy: 0.5029890213860592
Energy: 0.48955491951119734
Energy: 0.5029890213860592
Energy: 0.4944313828298653
Energy: 0.4833644630664762
Energy: 0.4944313828298653
Energy: 0.4833644630664762
Energy: 0.4944313828298653
Energy: 0.48336446306563907
Energy: 0.5052627754116317
Energy: 0.48515186646707453
Energy: 0.5052627754124687
Energy: 0.48515186646707453
Energy: 0.5052627754116317
Energy: 0.48515186646707453
Energy: 0.4797720969275913
Energy: 0.500356739337794
Energy: 0.4797720969275913
Energy: 0.500356739337794
Energy: 0.4797720969275913
Energy: 0.500356739337794
Energy: 0.5046915743976486
Energy: 0.485157986492281
Energy: 0.5046915743976486
Energy: 0.485157986492281
Energy: 0.5046915743976486
Energy: 0.485157986492281
Energy: 0.49445202691186013
Energy: 0.4906255958111801
Energy: 0.49445202691186013
Energy: 0.4906255958111801
Energy: 0.49445202691186013
Energy: 0.4906255958111801
Energy: 0.48955491951119734
Energy: 0.5029890213860592
Energy: 0.48955491951119734
Energy: 0.5029890213860592
Energy: 0.48955491951119734
Energy: 0.5029890213860592
Energy: 0.4944313828298653
Energy: 0.4833644630664762
Energy: 0.4944313828298653
Energy: 0.4833644630664762
Energy: 0.4944313828298653
Energy: 0.4833644630664762
Energy: 0.5052627754116317
Energy: 0.48515186646707453
Energy: 0.5052627754116317
Energy: 0.48515186646707453
Energy: 0.5052627754107946
Energy: 0.48515186646707453
Energy: 0.4797720969284284
Energy: 0.4802576842642814
Energy: 0.4797720969284284
Energy: 0.4802576842642814
Energy: 0.4797720969275913
Energy: 0.4802576842642814
Energy: 0.5046915743976486
Energy: 0.485157986492281
Energy: 0.5046915743976486
Energy: 0.485157986492281
Energy: 0.5046915743984858
Energy: 0.485157986492281
Energy: 0.49445202691186013
Energy: 0.4906255958111801
Energy: 0.49445202691186013
Energy: 0.4906255958111801
Energy: 0.49445202691186013
Energy: 0.4906255958111801
Energy: 0.48955491951119734
Energy: 0.5029890213860592
Energy: 0.48955491951119734
Energy: 0.5029890213860592
Energy: 0.48955491951119734
Energy: 0.5029890213860592
Energy: 0.4944313828298653
Energy: 0.48336446306563907
Energy: 0.4944313828298653
Energy: 0.4833644630664762
Energy: 0.4944313828298653
Energy: 0.4833644630664762
Energy: 0.5052627754116317
Energy: 0.48515186646707453
Energy: 0.5052627754116317
Energy: 0.48515186646707453
Energy: 0.5052627754116317
Energy: 0.48515186646707453
Energy: 0.4797720969275913
Energy: 0.4802576842642814
Energy: 0.4797720969275913
Energy: 0.48025768426344434
Energy: 0.4797720969275913
Energy: 0.4802576842642814
Energy: 0.5046915743984858
Energy: 0.485157986492281
Energy: 0.5046915743976486
Energy: 0.485157986492281
Energy: 0.5046915743976486
Energy: 0.485157986492281

minimum gb energy = 0.4797720969275913 eV
minimum distance =  2.57630811290615 Angstroms
sigma value = 9


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

Energy: 0.5374379456692662
Energy: 0.4963184518869225
Energy: 0.5374379456692662
Energy: 0.4963184518869225
Energy: 0.5374379456692662
Energy: 0.4963184518869225
Energy: 0.5100212671397354
Energy: 0.5010821517721956
Energy: 0.5100212671397354
Energy: 0.5010821517721956
Energy: 0.5100212671397354
Energy: 0.5010821517728791
Energy: 0.5293490413134452
Energy: 0.4904612317758185
Energy: 0.5147554107413039
Energy: 0.4904612317758185
Energy: 0.5147554107413039
Energy: 0.4904612317758185
Energy: 0.49668651077675996
Energy: 0.5326752951017409
Energy: 0.49668651077675996
Energy: 0.5326752951017409
Energy: 0.49668651077675996
Energy: 0.5326752951017409
Energy: 0.5174330055144387
Energy: 0.5090417854381236
Energy: 0.5174330055144387
Energy: 0.5090417854381236
Energy: 0.5174330055144387
Energy: 0.5090417854381236
Energy: 0.5144820176915118
Energy: 0.5077017297604007
Energy: 0.5144820176915118
Energy: 0.5077017297604007
Energy: 0.5144820176915118
Energy: 0.5077017297604007
Energy: 0.48708597490332334
Energy: 0.519876900909774
Energy: 0.48708597490332334
Energy: 0.519876900909774
Energy: 0.48708597490332334
Energy: 0.519876900909774
Energy: 0.5036425601611005
Energy: 0.5225652020792446
Energy: 0.5036425601611005
Energy: 0.5225652020792446
Energy: 0.5036425601611005
Energy: 0.5225652020792446
Energy: 0.537955634801883
Energy: 0.5109775598274794
Energy: 0.537955634801883
Energy: 0.5109775598274794
Energy: 0.537955634801883
Energy: 0.5109775598274794
Energy: 0.5087917635354863
Energy: 0.5081733633399775
Energy: 0.5087917635354863
Energy: 0.5081733633399775
Energy: 0.5087917635354863
Energy: 0.5081733633399775
Energy: 0.5039940954227702
Energy: 0.5099957632690105
Energy: 0.5039940954227702
Energy: 0.5099957632690105
Energy: 0.5039940954220867
Energy: 0.5099957632690105
Energy: 0.5325873701646684
Energy: 0.5188109546383562
Energy: 0.5325873701646684
Energy: 0.5188109546383562
Energy: 0.5325873701646684
Energy: 0.5188109546383562
Energy: 0.4983104354570144
Energy: 0.5242356109961108
Energy: 0.4983104354570144
Energy: 0.5242356109961108
Energy: 0.4983104354570144
Energy: 0.5242356109961108
Energy: 0.4970259550550853
Energy: 0.512642336359535
Energy: 0.4970259550550853
Energy: 0.512642336359535
Energy: 0.4970259550557687
Energy: 0.512642336359535
Energy: 0.5143719004378488
Energy: 0.49433518015563627
Energy: 0.5143719004378488
Energy: 0.49433518015563627
Energy: 0.5143719004378488
Energy: 0.49433518015563627
Energy: 0.5219786096983863
Energy: 0.5208766908567394
Energy: 0.5219786096990698
Energy: 0.5208766908567394
Energy: 0.5219786096983863
Energy: 0.5208766908567394
Energy: 0.518010092871849
Energy: 0.525645511091411
Energy: 0.518010092871849
Energy: 0.525645511091411
Energy: 0.518010092871849
Energy: 0.525645511091411
Energy: 0.556474360976755
Energy: 0.5055325509038263
Energy: 0.556474360976755
Energy: 0.5055325509038263
Energy: 0.556474360976755
Energy: 0.5055325509038263
Energy: 0.4871673396799178
Energy: 0.5103983749923918
Energy: 0.4871673396806013
Energy: 0.5103983749917083
Energy: 0.4871673396806013
Energy: 0.5103983749917083
Energy: 0.5047426451342882
Energy: 0.49383237123026263
Energy: 0.5047426451342882
Energy: 0.49383237123026263
Energy: 0.5047426451342882
Energy: 0.49383237123026263
Energy: 0.532243422347412
Energy: 0.5169689367722383
Energy: 0.532243422347412
Energy: 0.5169689367722383
Energy: 0.532243422347412
Energy: 0.5169689367722383

minimum gb energy = 0.48708597490332334 eV
minimum distance =  2.5394354479547 Angstroms
sigma value = 27


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

Energy: 0.5355608506087756
Energy: 0.4934770812265199
Energy: 0.5355608506087756
Energy: 0.4934770812265199
Energy: 0.5355608506087756
Energy: 0.4934770812265199
Energy: 0.5192620088735547
Energy: 0.504800340773622
Energy: 0.5192620088735547
Energy: 0.504800340773622
Energy: 0.5192620088735547
Energy: 0.504800340773622
Energy: 0.499559096619488
Energy: 0.4953950015481848
Energy: 0.499559096619488
Energy: 0.4953950015481848
Energy: 0.499559096619488
Energy: 0.4953950015481848
Energy: 0.5022131264764907
Energy: 0.4949632624655568
Energy: 0.5022131264764907
Energy: 0.4949632624655568
Energy: 0.5022131264770668
Energy: 0.4949632624655568
Energy: 0.5023081337630754
Energy: 0.4977826095421771
Energy: 0.5023081337630754
Energy: 0.4977826095421771
Energy: 0.5023081337630754
Energy: 0.4977826095421771
Energy: 0.4969828004939884
Energy: 0.5233043571956975
Energy: 0.4969828004939884
Energy: 0.5233043571956975
Energy: 0.4969828004939884
Energy: 0.5233043571956975
Energy: 0.5080815509431239
Energy: 0.5064480598805856
Energy: 0.5080815509437001
Energy: 0.5064480598805856
Energy: 0.5080815509431239
Energy: 0.5064480598805856
Energy: 0.5205883990250902
Energy: 0.4981356795190865
Energy: 0.5205883990250902
Energy: 0.4981356795190865
Energy: 0.5205883990250902
Energy: 0.4981356795190865
Energy: 0.4892064832758422
Energy: 0.5079945874611973
Energy: 0.4892064832758422
Energy: 0.5079945874611973
Energy: 0.4892064832758422
Energy: 0.5079945874611973
Energy: 0.5025363045590898
Energy: 0.4871837939391473
Energy: 0.5025363045590898
Energy: 0.48718379393857114
Energy: 0.5025363045590898
Energy: 0.4871837939391473
Energy: 0.502553767341388
Energy: 0.5008835353112218
Energy: 0.502553767341388
Energy: 0.5008835353112218
Energy: 0.502553767341388
Energy: 0.5008835353112218
Energy: 0.5090062569094218
Energy: 0.5090448190071102
Energy: 0.5090062569094218
Energy: 0.5090448190071102
Energy: 0.5090062569094218
Energy: 0.5090448190071102
Energy: 0.5080712810763924
Energy: 0.5026622957363753
Energy: 0.5080712810763924
Energy: 0.5026622957363753
Energy: 0.5080712810763924
Energy: 0.5026622957363753
Energy: 0.5081836570141326
Energy: 0.4913768967255097
Energy: 0.5081836570141326
Energy: 0.4913768967255097
Energy: 0.5081836570141326
Energy: 0.4913768967255097
Energy: 0.4941534544960298
Energy: 0.5242710411454239
Energy: 0.4941534544960298
Energy: 0.5242710411454239
Energy: 0.4941534544960298
Energy: 0.5242710411454239
Energy: 0.5019944981251808
Energy: 0.4995797015908194
Energy: 0.5019944981251808
Energy: 0.4995797015908194
Energy: 0.5019944981251808
Energy: 0.4995797015908194
Energy: 0.5111335443009605
Energy: 0.4994420831665684
Energy: 0.5111335443009605
Energy: 0.4994420831665684
Energy: 0.5111335443009605
Energy: 0.4994420831665684
Energy: 0.49445546242736754
Energy: 0.49472988783003785
Energy: 0.4944554624267914
Energy: 0.49472988783003785
Energy: 0.49445546242736754
Energy: 0.49472988782946176
Energy: 0.4746628180307962
Energy: 0.5025648098428583
Energy: 0.4746628180307962
Energy: 0.5025648098434347
Energy: 0.4746628180307962
Energy: 0.5025648098434347
Energy: 0.5355608506087756
Energy: 0.4934770812265199
Energy: 0.5355608506087756
Energy: 0.4934770812265199
Energy: 0.5355608506087756
Energy: 0.4934770812265199
Energy: 0.5192620088735547
Energy: 0.504800340773622
Energy: 0.5192620088735547
Energy: 0.504800340773046
Energy: 0.5192620088735547
Energy: 0.504800340773622
Energy: 0.499559096619488
Energy: 0.4953950015481848
Energy: 0.499559096619488
Energy: 0.4953950015481848
Energy: 0.499559096619488
Energy: 0.4953950015481848
Energy: 0.5022131264764907
Energy: 0.4949632624655568
Energy: 0.5022131264764907
Energy: 0.4949632624655568
Energy: 0.5022131264764907
Energy: 0.4949632624655568
Energy: 0.5023081337630754
Energy: 0.4977826095421771
Energy: 0.5023081337630754
Energy: 0.4977826095421771
Energy: 0.5023081337630754
Energy: 0.4977826095421771
Energy: 0.4969828004939884
Energy: 0.5233043571956975
Energy: 0.49698280049456456
Energy: 0.5233043571956975
Energy: 0.4969828004939884
Energy: 0.5233043571956975

minimum gb energy = 0.4746628180307962 eV
minimum distance =  2.54944487792039 Angstroms
sigma value = 19


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

Energy: 0.501246381487558
Energy: 0.49269779145935255
Energy: 0.501246381487558
Energy: 0.49269779145935255
Energy: 0.501246381487558
Energy: 0.49269779145935255
Energy: 0.4839633140136393
Energy: 0.48125657317605935
Energy: 0.4839633140136393
Energy: 0.48125657317605935
Energy: 0.4839633140136393
Energy: 0.48125657317605935
Energy: 0.4903127295477807
Energy: 0.4786792837020112
Energy: 0.4903127295477807
Energy: 0.4786792837020112
Energy: 0.4903127295477807
Energy: 0.4786792837020112
Energy: 0.47784952070606174
Energy: 0.4819933306038795
Energy: 0.47784952070606174
Energy: 0.4819933306038795
Energy: 0.47784952070606174
Energy: 0.4819933306038795
Energy: 0.48716925481841467
Energy: 0.49251484827267716
Energy: 0.48716925481841467
Energy: 0.49251484827267716
Energy: 0.48716925481841467
Energy: 0.49251484827267716
Energy: 0.4791890818452224
Energy: 0.4876350476375826
Energy: 0.4791890818452224
Energy: 0.4876350476375826
Energy: 0.4791890818452224
Energy: 0.4876350476375826
Energy: 0.4726851171283339
Energy: 0.4922693766417266
Energy: 0.4726851171283339
Energy: 0.492269376642224
Energy: 0.4726851171283339
Energy: 0.4922693766417266
Energy: 0.4765997189828697
Energy: 0.49501952130067756
Energy: 0.4765997189828697
Energy: 0.49501952130067756
Energy: 0.4765997189828697
Energy: 0.49501952130067756
Energy: 0.4944123178610384
Energy: 0.4747123082188518
Energy: 0.4944123178610384
Energy: 0.4747123082188518
Energy: 0.4944123178610384
Energy: 0.4747123082188518
Energy: 0.4892182035553232
Energy: 0.4829835482765261
Energy: 0.4892182035553232
Energy: 0.4829835482765261
Energy: 0.4892182035553232
Energy: 0.4829835482765261
Energy: 0.4782948473722944
Energy: 0.4998348527866386
Energy: 0.4782948473722944
Energy: 0.4998348527866386
Energy: 0.4782948473722944
Energy: 0.4998348527866386
Energy: 0.4904283847084966
Energy: 0.47341718516582576
Energy: 0.4904283847084966
Energy: 0.47341718516582576
Energy: 0.4904283847084966
Energy: 0.47341718516582576
Energy: 0.486888356568804
Energy: 0.4843635199746826
Energy: 0.486888356568804
Energy: 0.4843635199746826
Energy: 0.486888356568804
Energy: 0.4843635199746826
Energy: 0.48507338728271304
Energy: 0.4773759016415245
Energy: 0.48507338728271304
Energy: 0.4773759016415245
Energy: 0.48507338728271304
Energy: 0.4773759016415245
Energy: 0.4934179444426951
Energy: 0.4736554631000235
Energy: 0.4934179444426951
Energy: 0.4736554631000235
Energy: 0.4934179444426951
Energy: 0.4736554631000235
Energy: 0.4939406403833097
Energy: 0.4749599629549249
Energy: 0.4939406403833097
Energy: 0.4749599629549249
Energy: 0.4939406403833097
Energy: 0.4749599629549249
Energy: 0.47688754224012025
Energy: 0.4845172536027549
Energy: 0.47688754224012025
Energy: 0.4845172536027549
Energy: 0.47688754224012025
Energy: 0.4845172536027549
Energy: 0.4914621555507986
Energy: 0.4926684741107615
Energy: 0.4914621555507986
Energy: 0.49266847411026427
Energy: 0.4914621555507986
Energy: 0.4926684741107615
Energy: 0.47581680166691903
Energy: 0.48729833690212165
Energy: 0.47581680166691903
Energy: 0.48729833690162433
Energy: 0.47581680166691903
Energy: 0.48729833690162433
Energy: 0.48024705538121976
Energy: 0.4872613482670992
Energy: 0.48024705538121976
Energy: 0.4872613482670992
Energy: 0.48024705538121976
Energy: 0.4872613482670992
Energy: 0.4722887496309331
Energy: 0.49953278377153565
Energy: 0.4722887496314304
Energy: 0.49953278377153565
Energy: 0.4722887496314304
Energy: 0.49953278377153565
Energy: 0.498496009364686
Energy: 0.4767150380059862
Energy: 0.498496009364686
Energy: 0.4767150380059862
Energy: 0.498496009364686
Energy: 0.4767150380059862
Energy: 0.502662142785568
Energy: 0.48525158769852955
Energy: 0.502662142785568
Energy: 0.48525158769852955
Energy: 0.502662142785568
Energy: 0.48525158769852955
Energy: 0.5026206353250986
Energy: 0.4929758130543574
Energy: 0.5026206353250986
Energy: 0.4929758130543574
Energy: 0.5026206353250986
Energy: 0.4929758130543574
Energy: 0.48305676585188234
Energy: 0.4723926682334427
Energy: 0.48305676585188234
Energy: 0.4723926682334427
Energy: 0.48305676585188234
Energy: 0.4723926682334427
Energy: 0.4827260406838574
Energy: 0.48282299657525446
Energy: 0.48272604068336
Energy: 0.4828229965747571
Energy: 0.48272604068336
Energy: 0.4828229965747571
Energy: 0.4733597309669273
Energy: 0.4828828247346564
Energy: 0.4733597309669273
Energy: 0.4828828247346564
Energy: 0.4733597309669273
Energy: 0.4828828247346564
Energy: 0.495282627989263
Energy: 0.4842315554309302
Energy: 0.495282627989263
Energy: 0.4842315554309302
Energy: 0.495282627989263
Energy: 0.4842315554309302
Energy: 0.4870594272324932
Energy: 0.48838195823465425
Energy: 0.4870594272324932
Energy: 0.48838195823465425
Energy: 0.4870594272324932
Energy: 0.4883819582341569

minimum gb energy = 0.4722887496309331 eV
minimum distance =  2.52636512735078 Angstroms
sigma value = 101


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

Energy: 0.4680194804924877
Energy: 0.47872143891102975
Energy: 0.4680194804924877
Energy: 0.47872143891102975
Energy: 0.4680194804924877
Energy: 0.47872143891102975
Energy: 0.4810631882801619
Energy: 0.4577820313789804
Energy: 0.4810631882801619
Energy: 0.4577820313789804
Energy: 0.4810631882801619
Energy: 0.4577820313789804
Energy: 0.4696270290025603
Energy: 0.45298404265379805
Energy: 0.4696270290025603
Energy: 0.45298404265379805
Energy: 0.4696270290029974
Energy: 0.45298404265379805
Energy: 0.44709719296272854
Energy: 0.4787635971029112
Energy: 0.44709719296272854
Energy: 0.4787635971029112
Energy: 0.44709719296272854
Energy: 0.4787635971033484
Energy: 0.46353771188055576
Energy: 0.4642976566754975
Energy: 0.46353771188055576
Energy: 0.4642976566754975
Energy: 0.46353771188055576
Energy: 0.4642976566754975
Energy: 0.46035003738965996
Energy: 0.45320216147818915
Energy: 0.46035003738965996
Energy: 0.45320216147818915
Energy: 0.46035003738965996
Energy: 0.45320216147818915
Energy: 0.45849261888382403
Energy: 0.4786780318038752
Energy: 0.45849261888382403
Energy: 0.4786780318038752
Energy: 0.45849261888382403
Energy: 0.4786780318038752
Energy: 0.44623401181574446
Energy: 0.47549951405158475
Energy: 0.44623401181574446
Energy: 0.47549951405158475
Energy: 0.44623401181574446
Energy: 0.47549951405158475
Energy: 0.4700498478595722
Energy: 0.45385831024159784
Energy: 0.47004984786000925
Energy: 0.45385831024159784
Energy: 0.4700498478595722
Energy: 0.45385831024159784
Energy: 0.4635994921472225
Energy: 0.4717539041028758
Energy: 0.4635994921472225
Energy: 0.4717539041028758
Energy: 0.4635994921472225
Energy: 0.4717539041028758
Energy: 0.444936666040705
Energy: 0.5179485404689027
Energy: 0.444936666040705
Energy: 0.5179485404689027
Energy: 0.444936666040705
Energy: 0.5179485404689027
Energy: 0.47909715720077517
Energy: 0.4577067562790489
Energy: 0.47909715720077517
Energy: 0.4577067562790489
Energy: 0.47909715720077517
Energy: 0.4577067562790489
Energy: 0.46143351849679665
Energy: 0.4530462560127515
Energy: 0.46143351849679665
Energy: 0.4530462560127515
Energy: 0.46143351849679665
Energy: 0.4530462560127515
Energy: 0.4691026952613398
Energy: 0.4831379852705487
Energy: 0.4691026952613398
Energy: 0.4831379852705487
Energy: 0.4691026952613398
Energy: 0.49580503190247216
Energy: 0.4809543549921104
Energy: 0.46494887932028045
Energy: 0.4809543549921104
Energy: 0.46494887932028045
Energy: 0.4809543549921104
Energy: 0.46494887932028045
Energy: 0.4683810372481689
Energy: 0.4579443488329648
Energy: 0.4683810372481689
Energy: 0.4579443488329648
Energy: 0.4683810372481689
Energy: 0.4579443488329648
Energy: 0.4454760362345535
Energy: 0.4805117365154195
Energy: 0.4454760362345535
Energy: 0.4805117365154195
Energy: 0.4454760362345535
Energy: 0.4805117365154195
Energy: 0.44674099878513834
Energy: 0.47678848619041364
Energy: 0.44674099878513834
Energy: 0.47678848619041364
Energy: 0.44674099878513834
Energy: 0.47678848619041364
Energy: 0.461147526779963
Energy: 0.45390191008583
Energy: 0.461147526779963
Energy: 0.45390191008583
Energy: 0.461147526779963
Energy: 0.45390191008583
Energy: 0.4596843449146797
Energy: 0.47068436865021435
Energy: 0.4596843449146797
Energy: 0.47068436865021435
Energy: 0.4596843449146797
Energy: 0.47068436865021435
Energy: 0.44675742100386473
Energy: 0.5078457831675595
Energy: 0.44675742100386473
Energy: 0.5078457831679966
Energy: 0.44675742100386473
Energy: 0.5078457831675595
Energy: 0.48603640682903987
Energy: 0.45211988039849255
Energy: 0.48603640682903987
Energy: 0.45211988039849255
Energy: 0.48603640682903987
Energy: 0.45211988039849255
Energy: 0.4869524529145706
Energy: 0.4533330988039617
Energy: 0.4869524529145706
Energy: 0.4533330988039617
Energy: 0.4869524529145706
Energy: 0.4533330988039617
Energy: 0.44726485421988404
Energy: 0.4816818607326587
Energy: 0.44726485421988404
Energy: 0.4816818607326587
Energy: 0.44726485421988404
Energy: 0.4816818607326587
Energy: 0.48160533991487664
Energy: 0.46420530504050656
Energy: 0.48160533991487664
Energy: 0.46420530504050656
Energy: 0.48160533991487664
Energy: 0.46420530504050656
Energy: 0.4599380327738439
Energy: 0.45322017354245564
Energy: 0.45993803277340684
Energy: 0.45322017354245564
Energy: 0.4599380327738439
Energy: 0.45322017354245564
Energy: 0.4713970155530727
Energy: 0.47689107441782946
Energy: 0.4713970155530727
Energy: 0.47689107441782946
Energy: 0.47139701555348995
Energy: 0.47689107441782946
Energy: 0.4676530826531775
Energy: 0.47355240219371464
Energy: 0.4676530826536146
Energy: 0.47355240219371464
Energy: 0.4676530826531775
Energy: 0.47355240219371464
Energy: 0.4809244087391348
Energy: 0.45597290551770203
Energy: 0.4809244087391348
Energy: 0.45597290551770203
Energy: 0.4809244087391348
Energy: 0.45597290551813924
Energy: 0.4464596036141496
Energy: 0.46809917686555097
Energy: 0.4464596036141496
Energy: 0.46809917686555097
Energy: 0.4464596036141496
Energy: 0.46809917686555097
Energy: 0.44675724561238417
Energy: 0.460334054059956
Energy: 0.44675724561238417
Energy: 0.460334054059956
Energy: 0.44675724561238417
Energy: 0.460334054059956
Energy: 0.48615884268651516
Energy: 0.45299910887619116
Energy: 0.48615884268607795
Energy: 0.45299910887619116
Energy: 0.48615884268651516
Energy: 0.45299910887619116
Energy: 0.48586434434045306
Energy: 0.45293804179389524
Energy: 0.48586434434045306
Energy: 0.45293804179389524
Energy: 0.48586434434045306
Energy: 0.45293804179389524

minimum gb energy = 0.444936666040705 eV
minimum distance =  2.55542071239848 Angstroms
sigma value = 33


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

Energy: 0.011756671629343967
Energy: 0.3200432498569756
Energy: 0.011756671629343967
Energy: 0.3200432498569756
Energy: 0.011756671629343967
Energy: 0.3200432498569756
Energy: 0.012114176556262901
Energy: 0.1192759407108951
Energy: 0.012114176556262901
Energy: 0.1192759407108951
Energy: 0.012114176556262901
Energy: 0.1192759407108951
Energy: 0.31991995102203896
Energy: 0.11956546319885313
Energy: 0.319919950953895
Energy: 0.11956546319885313
Energy: 0.3199199523734969
Energy: 0.11956546319885313
Energy: 0.012114176556262901
Energy: 0.1192759407108951
Energy: 0.012114176556262901
Energy: 0.1192759407108951
Energy: 0.012114176556262901
Energy: 0.1192759407108951

minimum gb energy = 0.011756671629343967 eV
minimum distance =  2.81401123829437 Angstroms
sigma value = 1