Model name: model_name=MEAM_LAMMPS_PascuetFernandez_2015_Al__MO_315820974149_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049998879432679
cohesive_energy=3.360254209517775
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.010374398678326084
Energy: 0.5510354721639737
Energy: 0.010374398678326084
Energy: 0.5510354721642235
Energy: 0.010374398678326084
Energy: 0.5510354721639737
Energy: 0.5510354721642235
Energy: 0.7065520497202997
Energy: 0.5510354721639737
Energy: 0.7065520497202997
Energy: 0.5510354721639737
Energy: 0.7065520497202997
Energy: 0.010374398678326084
Energy: 0.5510354721642235
Energy: 0.010374398678326084
Energy: 0.5510354721642235
Energy: 0.010374398678326084
Energy: 0.5510354721642235
Energy: 0.5510354721642235
Energy: 0.7065520497202997
Energy: 0.5510354721642235
Energy: 0.7065520497202997
Energy: 0.5510354721642235
Energy: 0.7065520497200777
Energy: 0.010374398678326084
Energy: 0.5510354721639737
Energy: 0.010374398678326084
Energy: 0.5510354721639737
Energy: 0.010374398678326084
Energy: 0.5510354721642235
Energy: 0.5510354721642235
Energy: 0.7065520497205496
Energy: 0.5510354721642235
Energy: 0.7065520497205496
Energy: 0.5510354721642235
Energy: 0.7065520497202997

minimum gb energy = 0.010374398678326084 eV
minimum distance =  2.5007661504049 Angstroms
sigma value = 1


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

Energy: 0.7020176526054305
Energy: 0.663035616017956
Energy: 0.7020176526054305
Energy: 0.6630356160173546
Energy: 0.7020176526054305
Energy: 0.6630356160173546
Energy: 0.7622579004602528
Energy: 0.5955925906900451
Energy: 0.7622579004602528
Energy: 0.5955925906900451
Energy: 0.7622579004602528
Energy: 0.5955925906900451
Energy: 0.6333825683081453
Energy: 0.7469685566138494
Energy: 0.6563624914969871
Energy: 0.7469685566138494
Energy: 0.6333825683081453
Energy: 0.7469685566138494
Energy: 0.7631102348502788
Energy: 0.6176310428082377
Energy: 0.7631102348502788
Energy: 0.6176310428082377
Energy: 0.7631102348502788
Energy: 0.6176310428082377
Energy: 0.6757611214346984
Energy: 0.7567964669089101
Energy: 0.6757611214346984
Energy: 0.7567964669089101
Energy: 0.6757611214346984
Energy: 0.7567964669089101
Energy: 0.7031830706268277
Energy: 0.6156367263344711
Energy: 0.7031830706262264
Energy: 0.6156367263344711
Energy: 0.7031830706262264
Energy: 0.6156367263344711
Energy: 0.6753161316592692
Energy: 0.7391860160307655
Energy: 0.6753161316586678
Energy: 0.739186016030164
Energy: 0.6753161316592692
Energy: 0.739186016030164
Energy: 0.6588627615370841
Energy: 0.7506822600448919
Energy: 0.6588627615370841
Energy: 0.7506822600448919
Energy: 0.6588627615370841
Energy: 0.7506822600448919
Energy: 0.7170574581910266
Energy: 0.6677869834528469
Energy: 0.7170574581910266
Energy: 0.6677869834528469
Energy: 0.7170574581910266
Energy: 0.6677869834534482
Energy: 0.5946412868532244
Energy: 0.7555077332788537
Energy: 0.5946412868532244
Energy: 0.7555077332788537
Energy: 0.5946412868526229
Energy: 0.7555077332788537
Energy: 0.8252754155277409
Energy: 0.6057781141173573
Energy: 0.8252754155277409
Energy: 0.6057781141173573
Energy: 0.8252754155277409
Energy: 0.6057781141173573
Energy: 0.5635332456571873
Energy: 0.8227009104663746
Energy: 0.5635332456571873
Energy: 0.8227009104663746
Energy: 0.5635332456571873
Energy: 0.8227009104663746
Energy: 0.7517735930900594
Energy: 0.5688178154761467
Energy: 0.751773593090661
Energy: 0.5688178154755453
Energy: 0.7517735930900594
Energy: 0.5688178154761467
Energy: 0.6100120291501567
Energy: 0.7023109836147261
Energy: 0.6100120291501567
Energy: 0.7023109836147261
Energy: 0.6100120291507583
Energy: 0.7023109836141247
Energy: 0.7769768156128016
Energy: 0.6160240052811555
Energy: 0.7769768156128016
Energy: 0.6160240052817569
Energy: 0.7769768156122002
Energy: 0.6160240052811555
Energy: 0.7516004553360575
Energy: 0.6926130511662691
Energy: 0.7516004553360575
Energy: 0.6926130511662691
Energy: 0.7516004553360575
Energy: 0.6926130511662691
Energy: 0.6858652611450146
Energy: 0.6711198742555656
Energy: 0.6858652611450146
Energy: 0.6711198742549641
Energy: 0.6858652611450146
Energy: 0.6711198742549641
Energy: 0.7212540345817299
Energy: 0.6294202760258035
Energy: 0.7212540345823312
Energy: 0.6294202760258035
Energy: 0.7212540345823312
Energy: 0.6294202760258035
Energy: 0.5910621282483772
Energy: 0.6307608522990449
Energy: 0.5910621282477758
Energy: 0.6307608522996464
Energy: 0.5910621282483772
Energy: 0.6307608522990449
Energy: 0.7135775843206522
Energy: 0.6156090246347007
Energy: 0.7135775843206522
Energy: 0.6156090246347007
Energy: 0.7135775843206522
Energy: 0.6156090246347007
Energy: 0.6069081954767879
Energy: 0.7596846958541474
Energy: 0.6069081954767879
Energy: 0.7596846958541474
Energy: 0.6069081954767879
Energy: 0.7596846958541474
Energy: 0.7535164847919293
Energy: 0.6729984727818539
Energy: 0.7535164847913276
Energy: 0.6729984727818539
Energy: 0.7535164847913276
Energy: 0.6729984727818539
Energy: 0.5846984594352589
Energy: 0.7632363715792149
Energy: 0.5846984594346847
Energy: 0.7632363715786133
Energy: 0.5846984594346847
Energy: 0.7632363715792149

minimum gb energy = 0.5635332456571873 eV
minimum distance =  2.56391272936736 Angstroms
sigma value = 33


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

Energy: 0.7579332154768001
Energy: 0.7144583082932235
Energy: 0.729947625592812
Energy: 0.7144583082935657
Energy: 0.757933215476458
Energy: 0.7144583082932235
Energy: 0.7842806352130908
Energy: 0.6224598770874519
Energy: 0.7842806352134328
Energy: 0.6224598770874519
Energy: 0.7842806352130908
Energy: 0.6224598770884783
Energy: 0.6037422403468046
Energy: 0.6510378924664622
Energy: 0.6037422403471466
Energy: 0.6510378924664622
Energy: 0.6037422403464625
Energy: 0.6510378924664622
Energy: 0.7544403299178383
Energy: 0.7202971271199692
Energy: 0.7544403299168118
Energy: 0.7202971271199692
Energy: 0.7544403299178383
Energy: 0.7202971271206535
Energy: 0.6833930500390166
Energy: 0.6651616818981703
Energy: 0.6833930500386746
Energy: 0.6651616818978281
Energy: 0.6833930500386746
Energy: 0.6651616818978281
Energy: 0.6443604282844009
Energy: 0.5964490910103944
Energy: 0.6443604282840587
Energy: 0.5964490910103944
Energy: 0.6443604282844009
Energy: 0.596449091009026
Energy: 0.7436243764946481
Energy: 0.6823333068267655
Energy: 0.7436243764946481
Energy: 0.6823333068267655
Energy: 0.7436243764946481
Energy: 0.6823333068267655
Energy: 0.5701574914278844
Energy: 0.7759071230067022
Energy: 0.5701574914282266
Energy: 0.7759071230067022
Energy: 0.5701574914278844
Energy: 0.7759071230080705
Energy: 0.6751399474383543
Energy: 0.5943116236729933
Energy: 0.6751399474390385
Energy: 0.5943116236729933
Energy: 0.6751399474383543
Energy: 0.5943116236743616
Energy: 0.6009507014631253
Energy: 0.7537720834726997
Energy: 0.6009552077866291
Energy: 0.7537720834726997
Energy: 0.6009507014631253
Energy: 0.7537720834726997
Energy: 0.760729152375261
Energy: 0.5997030776587359
Energy: 0.760729152375261
Energy: 0.5997030776587359
Energy: 0.760729152375261
Energy: 0.5997030776587359
Energy: 0.5924531172960401
Energy: 0.6504155430619694
Energy: 0.5924529559806923
Energy: 0.6504155430619694
Energy: 0.5924531172960401
Energy: 0.6504155430633378
Energy: 0.7823967276046782
Energy: 0.5809675906507009
Energy: 0.7824081598797399
Energy: 0.5809675906507009
Energy: 0.7823967276050202
Energy: 0.5809675906507009
Energy: 0.7358883899867523
Energy: 0.7256370575257125
Energy: 0.7358886392045801
Energy: 0.7256370575257125
Energy: 0.7358883899867523
Energy: 0.7256370575260546
Energy: 0.7141229270540077
Energy: 0.6595173927134349
Energy: 0.7141229270543499
Energy: 0.6595173927134349
Energy: 0.7141229270540077
Energy: 0.6595173927130927
Energy: 0.5964132064091404
Energy: 0.6536043782509777
Energy: 0.5964132064094827
Energy: 0.6536043782509777
Energy: 0.5964132064094827
Energy: 0.653604378252004
Energy: 0.7200154397961845
Energy: 0.7274166605179123
Energy: 0.7200154397958424
Energy: 0.7274166605179123
Energy: 0.7200154397958424
Energy: 0.7274166605182544
Energy: 0.6837046015503131
Energy: 0.5943176258730863
Energy: 0.6837046015492869
Energy: 0.5943176258730863
Energy: 0.6837046015503131
Energy: 0.5943176258737705
Energy: 0.6390599684316199
Energy: 0.6391387717161445
Energy: 0.6390599684319621
Energy: 0.6391387717164866
Energy: 0.6390599684316199
Energy: 0.6391387717164866
Energy: 0.7380039607549687
Energy: 0.6812952527447488
Energy: 0.7380039607549687
Energy: 0.6812952527450908
Energy: 0.7380039607553107
Energy: 0.6812952527461172
Energy: 0.5706134091888582
Energy: 0.7885367563053033
Energy: 0.5706134091892002
Energy: 0.7885367563053033
Energy: 0.5706134091892002
Energy: 0.7885367563066717
Energy: 0.7065539187874456
Energy: 0.6004607791930152
Energy: 0.7065539187874456
Energy: 0.6004607791930152
Energy: 0.7065539187871035
Energy: 0.6004607791926732
Energy: 0.5989313649554647
Energy: 0.7732245923672836
Energy: 0.59894183738509
Energy: 0.7732245923669415
Energy: 0.5989313649558068
Energy: 0.7732245923665995
Energy: 0.7667782235257213
Energy: 0.666442066508093
Energy: 0.7667782235253792
Energy: 0.666442066508093
Energy: 0.7667782235253792
Energy: 0.6664420665087772
Energy: 0.6038244640216439
Energy: 0.6351354125629121
Energy: 0.6038036957486715
Energy: 0.6351354125629121
Energy: 0.6038244640216439
Energy: 0.63513541256257
Energy: 0.7895385329386218
Energy: 0.7001796285311933
Energy: 0.7746542213038501
Energy: 0.7001796285311933
Energy: 0.7895385329386218
Energy: 0.7001796285308513
Energy: 0.7775787525200695
Energy: 0.7160924636077882
Energy: 0.7647028743559048
Energy: 0.7160924636074462
Energy: 0.7775787525197272
Energy: 0.7160924636071041
Energy: 0.5992527079689252
Energy: 0.6739742456479088
Energy: 0.5992527079696093
Energy: 0.6739742456472245
Energy: 0.5992527079689252
Energy: 0.673974245648593
Energy: 0.7549501578979221
Energy: 0.632128083549007
Energy: 0.7549501578986063
Energy: 0.632128083549007
Energy: 0.7549501578979221
Energy: 0.6321280835483228
Energy: 0.5976557991729855
Energy: 0.7959275468340088
Energy: 0.5976557991729855
Energy: 0.795927546834351
Energy: 0.5976557991733276
Energy: 0.7959275468333247
Energy: 0.7777226321164096
Energy: 0.594297953012096
Energy: 0.7777226321164096
Energy: 0.594297953012096
Energy: 0.7777226321167516
Energy: 0.594297953012096
Energy: 0.5869590566302734
Energy: 0.7543633881810986
Energy: 0.5869590566305843
Energy: 0.7543633881807564
Energy: 0.5869590566302734
Energy: 0.7543633881807564
Energy: 0.742312440753317
Energy: 0.6812985290270398
Energy: 0.7423124407546854
Energy: 0.6812985290270398
Energy: 0.742312440753317
Energy: 0.6812985290270398
Energy: 0.6621296984913208
Energy: 0.7313092004056457
Energy: 0.6621296984906365
Energy: 0.7313092004056457
Energy: 0.6621296984916628
Energy: 0.7313092004059879
Energy: 0.6560935570555527
Energy: 0.5923996457568833
Energy: 0.6560935570548684
Energy: 0.5923996457568833
Energy: 0.6560935570558948
Energy: 0.5923996457568833
Energy: 0.7073932202095042
Energy: 0.7332751300293963
Energy: 0.7073932202101885
Energy: 0.7332751300293963
Energy: 0.7073932202095042
Energy: 0.7332751300287119
Energy: 0.596418521741693
Energy: 0.6829185224362417
Energy: 0.5964190648459503
Energy: 0.6829185224362417
Energy: 0.5964185217413509
Energy: 0.6829185224352154
Energy: 0.6503248965202518
Energy: 0.639399458196907
Energy: 0.6502783596871333
Energy: 0.639399458196907
Energy: 0.6503248965199098
Energy: 0.6393994581972491
Energy: 0.7357368565354085
Energy: 0.7279550592631424
Energy: 0.7357378022085743
Energy: 0.7279550592628004
Energy: 0.7357368565354085
Energy: 0.7279550592641688
Energy: 0.7847080494468105
Energy: 0.5803338135438948
Energy: 0.7847080494454421
Energy: 0.5803338135435526
Energy: 0.7847080494468105
Energy: 0.5803338135421844
Energy: 0.592428930505983
Energy: 0.5853376337732529
Energy: 0.5924289305056409
Energy: 0.5853376337732529
Energy: 0.592428930505983
Energy: 0.5853376337749633

minimum gb energy = 0.5701574914278844 eV
minimum distance =  2.66533617234723 Angstroms
sigma value = 51


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

Energy: 0.6625265227238794
Energy: 0.7428977828323711
Energy: 0.662526522724672
Energy: 0.7428977828323711
Energy: 0.6625265227238794
Energy: 0.7428977828323711
Energy: 0.7244682709052203
Energy: 0.6327718538012285
Energy: 0.7244682709052203
Energy: 0.6327718538012285
Energy: 0.7244682709052203
Energy: 0.6327718538012285
Energy: 0.6500638151983184
Energy: 0.6757538734376395
Energy: 0.6500638151983184
Energy: 0.6757538734376395
Energy: 0.6500638151983184
Energy: 0.6757538734376395
Energy: 0.682376323758124
Energy: 0.5872393847299996
Energy: 0.682376323758124
Energy: 0.5872393847299996
Energy: 0.682376323758124
Energy: 0.5872393847299996
Energy: 0.6898202176808167
Energy: 0.7148484341281935
Energy: 0.6898202176808167
Energy: 0.7148484341281935
Energy: 0.6898202176808167
Energy: 0.7148484341281935
Energy: 0.6801777665367895
Energy: 0.6959980765027697
Energy: 0.6801777665367895
Energy: 0.6959980765027697
Energy: 0.6801777665367895
Energy: 0.6959980765027697
Energy: 0.6981366645696953
Energy: 0.6483620625549787
Energy: 0.6981366645696953
Energy: 0.6483620625549787
Energy: 0.6981366645696953
Energy: 0.6483620625549787
Energy: 0.614610871173917
Energy: 0.6589549493873078
Energy: 0.614610871173917
Energy: 0.6589549493873078
Energy: 0.614610871173917
Energy: 0.6589549493881004
Energy: 0.7740320438975385
Energy: 0.5883902210486159
Energy: 0.7740320438975385
Energy: 0.5883902210486159
Energy: 0.7740320438975385
Energy: 0.5883902210486159
Energy: 0.5838989105247674
Energy: 0.7456612010453626
Energy: 0.5838989105247674
Energy: 0.7456612010453626
Energy: 0.5838989105247674
Energy: 0.7456612010453626
Energy: 0.7656259066112919
Energy: 0.5761628861430997
Energy: 0.7656259066112919
Energy: 0.5761628861430997
Energy: 0.7656259066112919
Energy: 0.5761628861430997
Energy: 0.664471636424561
Energy: 0.7235993360479749
Energy: 0.664471636424561
Energy: 0.7235993360479749
Energy: 0.6644716364237684
Energy: 0.7235993360479749
Energy: 0.749203602311293
Energy: 0.6462071650788099
Energy: 0.749203602311293
Energy: 0.6462071650788099
Energy: 0.749203602311293
Energy: 0.6462071650788099
Energy: 0.6751694372748691
Energy: 0.6153375978187526
Energy: 0.6751694372748691
Energy: 0.6153375978179599
Energy: 0.6751694372748691
Energy: 0.6153375978187526
Energy: 0.6859223993886805
Energy: 0.6856273816065898
Energy: 0.6859223993886805
Energy: 0.6856273816065898
Energy: 0.6859223993878878
Energy: 0.6856273816065898
Energy: 0.6951325430129254
Energy: 0.6742926259419888
Energy: 0.695132543013718
Energy: 0.6742926259419888
Energy: 0.695132543013718
Energy: 0.6742926259419888
Energy: 0.7025826135237804
Energy: 0.7508573678812933
Energy: 0.7025826135237804
Energy: 0.7508573678812933
Energy: 0.7025826135237804
Energy: 0.7508573678812933
Energy: 0.6829676573611627
Energy: 0.6481377266479179
Energy: 0.6829676573619552
Energy: 0.6481377266479179
Energy: 0.6829676573619552
Energy: 0.6481377266479179

minimum gb energy = 0.5761628861430997 eV
minimum distance =  2.46616672740569 Angstroms
sigma value = 19


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

Energy: 0.5824693411705035
Energy: 0.5931752600978241
Energy: 0.5576554831760259
Energy: 0.5931752600973539
Energy: 0.5824693411709737
Energy: 0.5931752600973539
Energy: 0.6897578160209334
Energy: 0.5635233192489238
Energy: 0.6897578160214035
Energy: 0.5635233192479834
Energy: 0.6897578160214035
Energy: 0.5635233192484537
Energy: 0.587750016333521
Energy: 0.5630619020289465
Energy: 0.587750016333521
Energy: 0.5630619020294166
Energy: 0.5877500163339909
Energy: 0.5630619020294166
Energy: 0.5870051593752654
Energy: 0.5817709236740095
Energy: 0.5870051593747952
Energy: 0.5817709236740095
Energy: 0.5870051593747952
Energy: 0.5817709236740095
Energy: 0.5608437391091409
Energy: 0.5475408480186594
Energy: 0.5608437391096112
Energy: 0.5475408480186594
Energy: 0.5608437391096112
Energy: 0.5475408480186594
Energy: 0.5528582732478605
Energy: 0.5477362638375394
Energy: 0.5528582732473906
Energy: 0.5477362638370692
Energy: 0.5528582732469203
Energy: 0.5477362638375394
Energy: 0.5643644166976297
Energy: 0.5817873409159084
Energy: 0.5643644166976297
Energy: 0.5817873409159084
Energy: 0.5643644166980998
Energy: 0.5817873409159084
Energy: 0.5833501673925312
Energy: 0.6418937600426383
Energy: 0.5833452849439464
Energy: 0.6418937600426383
Energy: 0.5833501673925312
Energy: 0.6418937600426383
Energy: 0.6899686897803569
Energy: 0.6524308697612666
Energy: 0.6899686897803569
Energy: 0.6524308697607963
Energy: 0.6899686897803569
Energy: 0.6524308697607963
Energy: 0.5576554831760259
Energy: 0.5931752600968837
Energy: 0.5576554831760259
Energy: 0.5931752600959435
Energy: 0.5576554831760259
Energy: 0.5931752600959435
Energy: 0.6897578160214035
Energy: 0.5635233192489238
Energy: 0.6897578160214035
Energy: 0.5635233192489238
Energy: 0.6897578160218738
Energy: 0.5635233192484537
Energy: 0.5877500163339909
Energy: 0.5630619020289465
Energy: 0.5877500163339909
Energy: 0.5630619020294166
Energy: 0.5877500163344612
Energy: 0.5630619020294166
Energy: 0.5870051593747952
Energy: 0.5817955341158597
Energy: 0.5870051593747952
Energy: 0.5817955341158597
Energy: 0.5870051593747952
Energy: 0.5817955341158597
Energy: 0.5608437391091409
Energy: 0.5475408480186594
Energy: 0.5608437391091409
Energy: 0.5475408480186594
Energy: 0.5608437391091409
Energy: 0.5475408480186594
Energy: 0.5528582732473906
Energy: 0.5477362638375394
Energy: 0.5528582732473906
Energy: 0.5477362638375394
Energy: 0.5528582732464501
Energy: 0.5477362638370692
Energy: 0.5643644166976297
Energy: 0.5817873409159084
Energy: 0.5643644166976297
Energy: 0.5817873409159084
Energy: 0.5643644166980998
Energy: 0.5817873409159084
Energy: 0.5833978494320011
Energy: 0.6418937600426383
Energy: 0.5834516897120116
Energy: 0.6418937600431085
Energy: 0.5833978494310608
Energy: 0.6418937600431085
Energy: 0.6214508415585549
Energy: 0.6524308697612666
Energy: 0.6899686897803569
Energy: 0.6524308697607963
Energy: 0.6214508415580848
Energy: 0.6524308697612666
Energy: 0.5824693411709737
Energy: 0.5931752600973539
Energy: 0.5576554831760259
Energy: 0.5931752600968837
Energy: 0.5824693411709737
Energy: 0.5931752600968837
Energy: 0.6897578160214035
Energy: 0.5635233192489238
Energy: 0.6897578160214035
Energy: 0.5635233192484537
Energy: 0.6897578160218738
Energy: 0.5635233192489238
Energy: 0.5877500163339909
Energy: 0.5630619020284764
Energy: 0.5877500163339909
Energy: 0.5630619020284764
Energy: 0.5877500163339909
Energy: 0.5630619020284764
Energy: 0.5870051593747952
Energy: 0.5817709236740095
Energy: 0.5870051593747952
Energy: 0.5817709236735393
Energy: 0.5870051593747952
Energy: 0.5817709236735393
Energy: 0.5608437391096112
Energy: 0.5475408480191296
Energy: 0.5608437391096112
Energy: 0.5475408480191296
Energy: 0.5608437391096112
Energy: 0.5475408480191296
Energy: 0.5528582732478605
Energy: 0.5477362638375394
Energy: 0.5528582732473906
Energy: 0.5477362638370692
Energy: 0.5528582732469203
Energy: 0.5477362638370692
Energy: 0.5643644166976297
Energy: 0.5817873409159084
Energy: 0.5643644166976297
Energy: 0.5817873409154383
Energy: 0.5643644166980998
Energy: 0.5817873409154383
Energy: 0.583350167392061
Energy: 0.6418937600426383
Energy: 0.5833452849439464
Energy: 0.6418937600431085
Energy: 0.583350167392061
Energy: 0.6418937600426383
Energy: 0.6899686897803569
Energy: 0.6524308697617368
Energy: 0.6899686897808271
Energy: 0.6524308697607963
Energy: 0.6899686897803569
Energy: 0.6524308697612666
Energy: 0.557655483176496
Energy: 0.5931752600973539
Energy: 0.557655483176496
Energy: 0.5931752600968837
Energy: 0.5576554831760259
Energy: 0.5931752600968837
Energy: 0.6897578160214035
Energy: 0.5635233192484537
Energy: 0.6897578160214035
Energy: 0.5635233192484537
Energy: 0.6897578160218738
Energy: 0.5635233192479834
Energy: 0.5877500163339909
Energy: 0.5630619020284764
Energy: 0.5877500163339909
Energy: 0.5630619020294166
Energy: 0.5877500163349313
Energy: 0.5630619020294166

minimum gb energy = 0.5475408480186594 eV
minimum distance =  2.68356132960074 Angstroms
sigma value = 27


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

Energy: 0.5775651698804968
Energy: 0.5664101946307345
Energy: 0.5775651698793451
Energy: 0.5664101946307345
Energy: 0.5775651698793451
Energy: 0.5664101946307345
Energy: 0.7368161032227053
Energy: 0.5988977155633487
Energy: 0.7368161032238568
Energy: 0.5988977155633487
Energy: 0.7368161032227053
Energy: 0.5988977155633487
Energy: 0.5715633136187631
Energy: 0.6457605723263272
Energy: 0.5715633136187631
Energy: 0.6457605723263272
Energy: 0.5715633136176115
Energy: 0.6457605723263272
Energy: 0.6750894964908305
Energy: 0.557993885316944
Energy: 0.6750894964908305
Energy: 0.557993885316944
Energy: 0.6750894964908305
Energy: 0.557993885316944
Energy: 0.6750352374766425
Energy: 0.5842784312050427
Energy: 0.6750352374766425
Energy: 0.5842784312050427
Energy: 0.6750352374766425
Energy: 0.5842784312061944
Energy: 0.6915247960738948
Energy: 0.6962081356168417
Energy: 0.6915247960738948
Energy: 0.6962081356168417
Energy: 0.6915247960738948
Energy: 0.6962081356168417
Energy: 0.7018813371141867
Energy: 0.5974473122992187
Energy: 0.7018813371141867
Energy: 0.5974473122992187
Energy: 0.7018813371130348
Energy: 0.5974473122992187
Energy: 0.5808128485246028
Energy: 0.5676113432886639
Energy: 0.5808128485246028
Energy: 0.5676113432875123
Energy: 0.5808128485246028
Energy: 0.5676113432875123
Energy: 0.6762129524056171
Energy: 0.571494742280144
Energy: 0.6762129524056171
Energy: 0.5714947287989288
Energy: 0.6762129524056171
Energy: 0.5714947556681262
Energy: 0.5883928521555952
Energy: 0.7297485188562348
Energy: 0.5883928521544435
Energy: 0.7297485188562348
Energy: 0.5883928521555952
Energy: 0.7297485188562348
Energy: 0.7102167464006499
Energy: 0.555216128398103
Energy: 0.7102167464006499
Energy: 0.555216128398103
Energy: 0.5666341978794629
Energy: 0.555216128398103
Energy: 0.7487901846033491
Energy: 0.6930859327156719
Energy: 0.7487901846033491
Energy: 0.6930859327156719
Energy: 0.7487901846033491
Energy: 0.6930859327168236

minimum gb energy = 0.555216128398103 eV
minimum distance =  2.59296099452113 Angstroms
sigma value = 9


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

Energy: 0.6269956819595572
Energy: 0.5929395249533421
Energy: 0.6269956819598809
Energy: 0.5929395249530185
Energy: 0.6269956819598809
Energy: 0.5929395249536656
Energy: 0.6660715772559992
Energy: 0.5951818641564819
Energy: 0.6660715772566463
Energy: 0.5801087932433794
Energy: 0.6660715772563227
Energy: 0.5801087932433794
Energy: 0.5477973971241139
Energy: 0.7010330287463511
Energy: 0.5477973971231431
Energy: 0.7010330287463511
Energy: 0.5477973971237903
Energy: 0.7010330287463511
Energy: 0.5630251783110429
Energy: 0.5416202219005605
Energy: 0.5630251783110429
Energy: 0.5416202219005605
Energy: 0.5630251783113664
Energy: 0.5416202219005605
Energy: 0.5961897649056255
Energy: 0.5712449060826982
Energy: 0.5961897649059491
Energy: 0.5712449060820509
Energy: 0.5961897649059491
Energy: 0.5712449060823745
Energy: 0.5933447073495652
Energy: 0.6498116787352918
Energy: 0.5933447073495652
Energy: 0.6254270876182889
Energy: 0.5933447073495652
Energy: 0.6254270876182889
Energy: 0.6101644739450833
Energy: 0.6144450868539073
Energy: 0.610164473945407
Energy: 0.6144450868535837
Energy: 0.610164473945407
Energy: 0.6144450868535837
Energy: 0.5261544489779081
Energy: 0.609389345216136
Energy: 0.5261544489775845
Energy: 0.609389345216136
Energy: 0.5261544489779081
Energy: 0.609389345216136
Energy: 0.7422722822730692
Energy: 0.5700718241240522
Energy: 0.7422722822737164
Energy: 0.5700718241243757
Energy: 0.7422722822737164
Energy: 0.5700718241243757
Energy: 0.596528711982572
Energy: 0.7170475938268193
Energy: 0.5965287119822484
Energy: 0.7170475938264957
Energy: 0.5965287119822484
Energy: 0.7170475938264957
Energy: 0.5656934640189236
Energy: 0.5370367864882836
Energy: 0.5656934640192472
Energy: 0.5370367864882836
Energy: 0.5656934640186
Energy: 0.5370367864886071
Energy: 0.565452862483624
Energy: 0.6622620462665204
Energy: 0.5654528624842713
Energy: 0.6622620462674912
Energy: 0.565452862483624
Energy: 0.6622620462674912
Energy: 0.6679685071036374
Energy: 0.636590560537327
Energy: 0.6679685071036374
Energy: 0.6365905605376506
Energy: 0.6679685071026666
Energy: 0.636590560537327
Energy: 0.6923171421156422
Energy: 0.6829962531275295
Energy: 0.6923171421162894
Energy: 0.6829962531275295
Energy: 0.6923171421156422
Energy: 0.6829962531275295
Energy: 0.5556537763720528
Energy: 0.5843614656919804
Energy: 0.5556537763720528
Energy: 0.5843614656919804
Energy: 0.5556537763720528
Energy: 0.5843614656919804
Energy: 0.6940136763571926
Energy: 0.6139256171804005
Energy: 0.6940136763575162
Energy: 0.6139256171807241
Energy: 0.6940136763571926
Energy: 0.6139256171807241
Energy: 0.6583946717355659
Energy: 0.6591886780080949
Energy: 0.6583946717349187
Energy: 0.6591886780084184
Energy: 0.6583946717352424
Energy: 0.6591886780080949
Energy: 0.5636695713796989
Energy: 0.5676662696810809
Energy: 0.5636695713803461
Energy: 0.5676662696814045
Energy: 0.5636695713796989
Energy: 0.5676662696814045
Energy: 0.530353515680032
Energy: 0.6639959457222531
Energy: 0.5303535156803556
Energy: 0.6639959457219295
Energy: 0.5303535156806792
Energy: 0.6639959457219295
Energy: 0.6835413559485478
Energy: 0.615322357425223
Energy: 0.6835413559482242
Energy: 0.6153223574248994
Energy: 0.6835413559485478
Energy: 0.6153223574248994
Energy: 0.5306058644115467
Energy: 0.6640786936125642
Energy: 0.5306058644118703
Energy: 0.6640786936122406
Energy: 0.5306058644115467
Energy: 0.6640786936122406
Energy: 0.5634749674415152
Energy: 0.5677893514222467
Energy: 0.5634749674411915
Energy: 0.5677893514219231
Energy: 0.5634749674411915
Energy: 0.5677893514219231
Energy: 0.6583991190215625
Energy: 0.6593007960010392
Energy: 0.6583991190215625
Energy: 0.6593007960010392
Energy: 0.6583991190215625
Energy: 0.6593007960013628
Energy: 0.6441166812234427
Energy: 0.6644181209718629
Energy: 0.6441166812227956
Energy: 0.6644181209718629
Energy: 0.6441166812224721
Energy: 0.6644181209718629
Energy: 0.5555921064663638
Energy: 0.584455754705369
Energy: 0.5555921064660402
Energy: 0.584455754705369
Energy: 0.5555921064663638
Energy: 0.584455754705369
Energy: 0.6934233824221397
Energy: 0.6057066396221396
Energy: 0.6934233824214925
Energy: 0.6057066396221396
Energy: 0.6934233824218161
Energy: 0.6057066396221396
Energy: 0.6679151099595471
Energy: 0.6365088524369497
Energy: 0.6679151099595471
Energy: 0.6365088524369497
Energy: 0.6679151099595471
Energy: 0.6365088524369497
Energy: 0.5657414890116789
Energy: 0.6344517173331876
Energy: 0.565741489012326
Energy: 0.6344517173331876
Energy: 0.565741489012326
Energy: 0.6344517173331876
Energy: 0.5655402921643373
Energy: 0.5368953282288014
Energy: 0.5655402921649549
Energy: 0.5368953282288014
Energy: 0.5655402921643373
Energy: 0.5368953282291249
Energy: 0.5963120072669991
Energy: 0.694940907056883
Energy: 0.5963120072666754
Energy: 0.6949409070565594
Energy: 0.5963120072666754
Energy: 0.6949409070565594
Energy: 0.7432006029055305
Energy: 0.5700397922288573
Energy: 0.7432006029055305
Energy: 0.5700397922291808
Energy: 0.7432006029055305
Energy: 0.5700397922288573
Energy: 0.5261588954614569
Energy: 0.6094363996350647
Energy: 0.5261588954614569
Energy: 0.6094363996350647
Energy: 0.5261588954617805
Energy: 0.6094363996350647
Energy: 0.6100709111099571
Energy: 0.6143923564901758
Energy: 0.61007091110931
Energy: 0.6143923564901758
Energy: 0.6100709111099571
Energy: 0.6143923564901758
Energy: 0.5934209806156632
Energy: 0.6233928491874698
Energy: 0.5934209806163103
Energy: 0.6233928491877935
Energy: 0.5934209806163103
Energy: 0.6233928491877935
Energy: 0.5962714782853078
Energy: 0.5711916637358384
Energy: 0.5962714782856314
Energy: 0.5711916637358384
Energy: 0.5962714782856314
Energy: 0.5711916637358384
Energy: 0.5629556619187359
Energy: 0.541552104819032
Energy: 0.5629556619187359
Energy: 0.541552104819032
Energy: 0.5629556619184123
Energy: 0.541552104819032
Energy: 0.5477705952024401
Energy: 0.7012197136350216
Energy: 0.5477705952024401
Energy: 0.7012197136350216
Energy: 0.5477705952024401
Energy: 0.7012197136350216
Energy: 0.6664222758244834
Energy: 0.574942460422063
Energy: 0.6664222758241598
Energy: 0.5749424604217395
Energy: 0.6664222758244834
Energy: 0.574942460422063
Energy: 0.6269956819592337
Energy: 0.5929395249530185
Energy: 0.6269956819592337
Energy: 0.5929395249533421
Energy: 0.6269956819592337
Energy: 0.5929395249526949
Energy: 0.6660715772563227
Energy: 0.5801087932420852
Energy: 0.6660715772566463
Energy: 0.5801087932420852
Energy: 0.6660715772563227
Energy: 0.5801087932417616
Energy: 0.5477973971237903
Energy: 0.7010330287460275
Energy: 0.5477973971234668
Energy: 0.7010330287460275
Energy: 0.5477973971234668
Energy: 0.7010330287463511
Energy: 0.5630251783113664
Energy: 0.5416202219018549
Energy: 0.5630251783113664
Energy: 0.5416202219018549
Energy: 0.5630251783120137
Energy: 0.5416202219018549
Energy: 0.5961897649062726
Energy: 0.5712449060820509
Energy: 0.5961897649062726
Energy: 0.5712449060817274
Energy: 0.5961897649062726
Energy: 0.5712449060820509

minimum gb energy = 0.5261544489775845 eV
minimum distance =  2.60531097561688 Angstroms
sigma value = 57


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

Energy: 0.4431215325118806
Energy: 0.41758338710989407
Energy: 0.4431215325118806
Energy: 0.41758338710989407
Energy: 0.443121532511144
Energy: 0.41758338710989407
Energy: 0.4266919533528486
Energy: 0.4352099364925821
Energy: 0.4266919533528486
Energy: 0.4352099364925821
Energy: 0.4266919533535852
Energy: 0.4352099364925821
Energy: 0.43790039386482044
Energy: 0.5706087591233998
Energy: 0.43790039386482044
Energy: 0.5706087591233998
Energy: 0.43790039386555707
Energy: 0.5706087591233998
Energy: 0.36679837636094076
Energy: 0.3537922982042498
Energy: 0.36679837636094076
Energy: 0.3537922982042498
Energy: 0.3667983763602042
Energy: 0.3537922982042498
Energy: 0.41605891269952655
Energy: 0.42775738676382075
Energy: 0.41605891269952655
Energy: 0.42775738676382075
Energy: 0.41605891269952655
Energy: 0.42775738676382075
Energy: 0.3471620237196276
Energy: 0.4406072180382761
Energy: 0.34716202371889104
Energy: 0.44060721803753955
Energy: 0.34716202371889104
Energy: 0.44060721803753955
Energy: 0.34708670152508886
Energy: 0.49974596079982825
Energy: 0.34708670152508886
Energy: 0.49974596079909156
Energy: 0.34708670152508886
Energy: 0.49974596079982825
Energy: 0.4278783550902734
Energy: 0.41626842674562936
Energy: 0.4278783550902734
Energy: 0.41626842674636594
Energy: 0.4278783550902734
Energy: 0.41626842674562936
Energy: 0.36566403871115616
Energy: 0.3538113077696007
Energy: 0.36566403871115616
Energy: 0.3538113077703373
Energy: 0.36566403871189274
Energy: 0.3538113077696007
Energy: 0.4993737682631194
Energy: 0.4991747380783299
Energy: 0.4993737682631194
Energy: 0.4991747380783299
Energy: 0.4993737682631194
Energy: 0.4991747380790665
Energy: 0.4185720921114513
Energy: 0.43543891209382063
Energy: 0.4185720921107146
Energy: 0.43543891209382063
Energy: 0.4185720921107146
Energy: 0.43543891209382063
Energy: 0.443121532511144
Energy: 0.41758338710989407
Energy: 0.4431215325104073
Energy: 0.41758338710989407
Energy: 0.443121532511144
Energy: 0.41758338710989407
Energy: 0.4266919533528486
Energy: 0.43520993649184553
Energy: 0.4266919533528486
Energy: 0.43520993649184553
Energy: 0.4266919533528486
Energy: 0.43520993649184553
Energy: 0.43790039386555707
Energy: 0.5706087591233998
Energy: 0.43790039386555707
Energy: 0.5706087591233998
Energy: 0.43790039386555707
Energy: 0.5706087591233998
Energy: 0.3667983763602042
Energy: 0.3537922982035132
Energy: 0.3667983763602042
Energy: 0.3537922982035132
Energy: 0.3667983763602042
Energy: 0.3537922982035132
Energy: 0.41605891269952655
Energy: 0.42775738676382075
Energy: 0.41605891269952655
Energy: 0.42775738676382075
Energy: 0.41605891269952655
Energy: 0.42775738676382075
Energy: 0.34716202371889104
Energy: 0.4406072180368029
Energy: 0.34716202371889104
Energy: 0.4406072180368029
Energy: 0.34716202371889104
Energy: 0.4406072180368029
Energy: 0.34708670152508886
Energy: 0.49974596079982825
Energy: 0.34708670152582544
Energy: 0.49974596079909156
Energy: 0.34708670152582544
Energy: 0.49974596079909156
Energy: 0.4278783550902734
Energy: 0.41626842674636594
Energy: 0.4278783550902734
Energy: 0.41626842674562936
Energy: 0.4278783550902734
Energy: 0.41626842674562936

minimum gb energy = 0.34708670152508886 eV
minimum distance =  2.68605943713775 Angstroms
sigma value = 11


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

Energy: 0.5832528264190452
Energy: 0.5531454509762882
Energy: 0.5832528264190452
Energy: 0.5531454509762882
Energy: 0.5832528264185057
Energy: 0.5531454509762882
Energy: 0.6605752439843029
Energy: 0.5570534321720874
Energy: 0.6605752439837633
Energy: 0.557053432172627
Energy: 0.6605752439843029
Energy: 0.5570534321720874
Energy: 0.6204501355492571
Energy: 0.7993398521077791
Energy: 0.6204501355492571
Energy: 0.7993398521077791
Energy: 0.6204501355487176
Energy: 0.7993398521077791
Energy: 0.6798751211684361
Energy: 0.5781688208280413
Energy: 0.6798751211678965
Energy: 0.5781688208275019
Energy: 0.6798751211684361
Energy: 0.5781688208275019
Energy: 0.5466587696100444
Energy: 0.5195906221228224
Energy: 0.5466587696105841
Energy: 0.5195906221222827
Energy: 0.5466587696105841
Energy: 0.5195906221222827
Energy: 0.5723250768021301
Energy: 0.5569538333027666
Energy: 0.5723250768021301
Energy: 0.5569538333027666
Energy: 0.5723250768021301
Energy: 0.5569538333022271
Energy: 0.6237421510698614
Energy: 0.6907233189524236
Energy: 0.6237421510698614
Energy: 0.690723318951884
Energy: 0.6237421510698614
Energy: 0.6907233189524236
Energy: 0.551984540461419
Energy: 0.503605101466419
Energy: 0.5519845404608793
Energy: 0.5036051014658794
Energy: 0.551984540461419
Energy: 0.5036051014658794
Energy: 0.5506895403905323
Energy: 0.5098198062518011
Energy: 0.5506895403910719
Energy: 0.5098198062523408
Energy: 0.5506895403905323
Energy: 0.5098198062523408
Energy: 0.5304463119902293
Energy: 0.714365228294652
Energy: 0.5304463119896896
Energy: 0.714365228294652
Energy: 0.5304463119896896
Energy: 0.7143652282951914
Energy: 0.6664350685372439
Energy: 0.6353287096866636
Energy: 0.6664350685372439
Energy: 0.6353287096866636
Energy: 0.6664350685372439
Energy: 0.6353287096866636
Energy: 0.5467780453131733
Energy: 0.5218292226558431
Energy: 0.5467780453131733
Energy: 0.5218292226558431
Energy: 0.5467780453131733
Energy: 0.5218292226553036
Energy: 0.5732467195283502
Energy: 0.5751037468896708
Energy: 0.5732467195278106
Energy: 0.5751037468896708
Energy: 0.5732467195278106
Energy: 0.5751037468896708
Energy: 0.5982495482858213
Energy: 0.7293586258732786
Energy: 0.5982495482852817
Energy: 0.729358625872739
Energy: 0.5982495482852817
Energy: 0.7293586258738183
Energy: 0.695149674921854
Energy: 0.5567824663836233
Energy: 0.695149674921854
Energy: 0.5567824663841628
Energy: 0.6951496749223935
Energy: 0.5567824663836233
Energy: 0.583189639303863
Energy: 0.5578401237134063
Energy: 0.5831896393033233
Energy: 0.5578401237139459
Energy: 0.5831896393033233
Energy: 0.5578401237139459
Energy: 0.5615015800255794
Energy: 0.5530948822274705
Energy: 0.5615015800255794
Energy: 0.5530948822280101
Energy: 0.5615015800255794
Energy: 0.5530948822280101
Energy: 0.662895839288041
Energy: 0.6993098481997561
Energy: 0.6628958392875015
Energy: 0.6993098481992165
Energy: 0.6628958392875015
Energy: 0.6993098481997561
Energy: 0.6617501734317462
Energy: 0.5819927797620148
Energy: 0.6617501734322859
Energy: 0.5819927797620148
Energy: 0.6617501734317462
Energy: 0.5819927797625545
Energy: 0.5538312112677762
Energy: 0.5297820166633258
Energy: 0.5538312112677762
Energy: 0.5297820166633258
Energy: 0.5538312112677762
Energy: 0.5297820166627863
Energy: 0.513115553350424
Energy: 0.552626661133389
Energy: 0.513115553350424
Energy: 0.5526266611339286
Energy: 0.5131155533509635
Energy: 0.552626661133389
Energy: 0.6288924045506551
Energy: 0.6239578129047894
Energy: 0.6288924045506551
Energy: 0.6239578129047894
Energy: 0.6288924045506551
Energy: 0.6239578129047894
Energy: 0.5551640152866606
Energy: 0.5705910532405248
Energy: 0.5551640152861211
Energy: 0.5705910532405248
Energy: 0.5551640152861211
Energy: 0.5705910532405248
Energy: 0.5515325824014474
Energy: 0.5334611884832614
Energy: 0.5515325824014474
Energy: 0.5334611884832614
Energy: 0.551532582400908
Energy: 0.5334611884832614
Energy: 0.5131345999728374
Energy: 0.7325562892630036
Energy: 0.5131345999722978
Energy: 0.7325562892635432
Energy: 0.5131345999728374
Energy: 0.7325562892624641
Energy: 0.8024592628760993
Energy: 0.6519899191310388
Energy: 0.8024592628755598
Energy: 0.6519899191310388
Energy: 0.8024592628755598
Energy: 0.6519899191310388

minimum gb energy = 0.5036051014658794 eV
minimum distance =  2.54999109172345 Angstroms
sigma value = 41


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

Energy: 0.6347640813983658
Energy: 0.5449324043787589
Energy: 0.6347640813983658
Energy: 0.5449324043791841
Energy: 0.6347640813983658
Energy: 0.5449324043779082
Energy: 0.6565258967019768
Energy: 0.6049467868646006
Energy: 0.6565258967024021
Energy: 0.6049467868646006
Energy: 0.6565258967019768
Energy: 0.6049467868646006
Energy: 0.6782119657760917
Energy: 0.8175630789898826
Energy: 0.6782119657760917
Energy: 0.8175630789894572
Energy: 0.6782119657760917
Energy: 0.817563078989032
Energy: 0.6244214015677374
Energy: 0.5361084408281003
Energy: 0.6244214015677374
Energy: 0.5361084408285255
Energy: 0.6244214015673122
Energy: 0.5361084408285255
Energy: 0.5310806022902002
Energy: 0.5556010408488823
Energy: 0.5310806022906255
Energy: 0.5556010408488823
Energy: 0.5310806022906255
Energy: 0.5556010408488823
Energy: 0.6033253011568926
Energy: 0.6058221004323204
Energy: 0.6033253011568926
Energy: 0.6058221004323204
Energy: 0.6033253011573179
Energy: 0.6058221004318952
Energy: 0.577668809577827
Energy: 0.6861130979304313
Energy: 0.5776688095774016
Energy: 0.6861130979304313
Energy: 0.5776688095774016
Energy: 0.6861130979304313
Energy: 0.5505897807074033
Energy: 0.5361018249289022
Energy: 0.5505897807078285
Energy: 0.5361018249289022
Energy: 0.5505897807074033
Energy: 0.5361018249284769
Energy: 0.5413262145034503
Energy: 0.5519633310395773
Energy: 0.5413262145034503
Energy: 0.5519633310400026
Energy: 0.5413262145034503
Energy: 0.5519633310400026
Energy: 0.6157376861770941
Energy: 0.6954285914445362
Energy: 0.6157376861745425
Energy: 0.6954285914445362
Energy: 0.615737686175393
Energy: 0.6954285914445362
Energy: 0.6984790737538639
Energy: 0.6906446165983392
Energy: 0.6984790737542891
Energy: 0.6906446165979139
Energy: 0.6984790737547143
Energy: 0.6906446165979139
Energy: 0.5359009340910172
Energy: 0.5626798190944857
Energy: 0.5359009340914425
Energy: 0.5626798190944857
Energy: 0.5359009340910172
Energy: 0.5626798190944857
Energy: 0.5514838237636044
Energy: 0.5387379413591465
Energy: 0.5514838237636044
Energy: 0.5387379413604224
Energy: 0.5514838237636044
Energy: 0.5387379413608476
Energy: 0.528053225258412
Energy: 0.734442631305704
Energy: 0.528053225258412
Energy: 0.734442631305704
Energy: 0.528053225258412
Energy: 0.734442631305704
Energy: 0.7019414720711852
Energy: 0.6517136211403298
Energy: 0.7019414720707599
Energy: 0.6517136211403298
Energy: 0.7019414720711852
Energy: 0.6517136211403298
Energy: 0.5228322371518229
Energy: 0.5765175979102709
Energy: 0.5228322371513977
Energy: 0.5765175979102709
Energy: 0.5228322371513977
Energy: 0.5765175979102709
Energy: 0.5508733672132934
Energy: 0.5387390482280074
Energy: 0.550873367212443
Energy: 0.5387390482275822
Energy: 0.5508733672128682
Energy: 0.5387390482280074
Energy: 0.614769337860439
Energy: 0.7441346833483821
Energy: 0.6147693378608642
Energy: 0.7441346833483821
Energy: 0.614769337860439
Energy: 0.7441346833483821
Energy: 0.6838165155136343
Energy: 0.6005218986426403
Energy: 0.6838165155136343
Energy: 0.6005218986426403
Energy: 0.6838165155132091
Energy: 0.6005218986426403
Energy: 0.6366794719642634
Energy: 0.5873100578512694
Energy: 0.6366794719642634
Energy: 0.6271673948702836
Energy: 0.6366794719642634
Energy: 0.5626515753627196
Energy: 0.5422010586301077
Energy: 0.6046032087999873
Energy: 0.5422010586292572
Energy: 0.6046032087991368
Energy: 0.5422010586296824
Energy: 0.604603208799562
Energy: 0.6646546489557184
Energy: 0.8388173579583289
Energy: 0.6646546489548679
Energy: 0.8388173579583289
Energy: 0.6646546489552931
Energy: 0.8388173579583289
Energy: 0.6045455295822539
Energy: 0.5346752213208157
Energy: 0.6045455295822539
Energy: 0.5346752213208157
Energy: 0.6045455295822539
Energy: 0.5346752213212409
Energy: 0.5299629124105771
Energy: 0.5877365285901932
Energy: 0.5299629124105771
Energy: 0.5877365285901932
Energy: 0.5299629124105771
Energy: 0.5877365285901932
Energy: 0.5218080988224757
Energy: 0.6020039338868239
Energy: 0.5218080988224757
Energy: 0.6020039338868239
Energy: 0.5218080988224757
Energy: 0.6020039338868239
Energy: 0.5773901351225612
Energy: 0.7806003439559236
Energy: 0.5773901351225612
Energy: 0.7806003439559236
Energy: 0.5773901351221358
Energy: 0.7806003439559236
Energy: 0.538315217626951
Energy: 0.5347799276040318
Energy: 0.5383152176273763
Energy: 0.534779927603181
Energy: 0.538315217626951
Energy: 0.5347799276040318
Energy: 0.5397534567432798
Energy: 0.576637775602026
Energy: 0.5397534567432798
Energy: 0.576637775602026
Energy: 0.5397534567432798
Energy: 0.5766377756024512
Energy: 0.6357499310692543
Energy: 0.6090471037955703
Energy: 0.6357499310692543
Energy: 0.609047103795145
Energy: 0.6357499310705301
Energy: 0.609047103795145
Energy: 0.815406822856741
Energy: 0.6658631631522557
Energy: 0.815406822856741
Energy: 0.6658631631522557
Energy: 0.815406822856741
Energy: 0.6658631631522557
Energy: 0.5388488940711458
Energy: 0.5657563194468813
Energy: 0.5388488940711458
Energy: 0.5657563194468813
Energy: 0.5388488940711458
Energy: 0.5657563194468813
Energy: 0.5531131542695903
Energy: 0.5394852993562541
Energy: 0.5531131542695903
Energy: 0.53948529935753
Energy: 0.5531131542691651
Energy: 0.539485299357936
Energy: 0.5219665454355853
Energy: 0.5997105277972016
Energy: 0.5219665454355853
Energy: 0.5997105277972016
Energy: 0.5219665454355853
Energy: 0.5997105277972016

minimum gb energy = 0.5218080988224757 eV
minimum distance =  2.56808696125658 Angstroms
sigma value = 33


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

Energy: 0.5682532446897985
Energy: 0.5450069124166794
Energy: 0.5682532446903955
Energy: 0.545006912415187
Energy: 0.568253244690097
Energy: 0.5450069124142916
Energy: 0.686859167302167
Energy: 0.5427626960449472
Energy: 0.6868591673018685
Energy: 0.5427626960449472
Energy: 0.6868591673018685
Energy: 0.5427626960449472
Energy: 0.7130545405166692
Energy: 0.7786211186396087
Energy: 0.7130545405163707
Energy: 0.7786211186396087
Energy: 0.7130545405166692
Energy: 0.7786211186393103
Energy: 0.6470491953212396
Energy: 0.5395101245899238
Energy: 0.647049195321538
Energy: 0.5395101245896252
Energy: 0.647049195321538
Energy: 0.5395101245896252
Energy: 0.5396697672986905
Energy: 0.6730595394620819
Energy: 0.5396697672980937
Energy: 0.6730595394617835
Energy: 0.5396697672977951
Energy: 0.6730595394620819
Energy: 0.6601083073962577
Energy: 0.5427228979057056
Energy: 0.6601083073962577
Energy: 0.5427228979080932
Energy: 0.6601083073971531
Energy: 0.5427228979083917
Energy: 0.6058275805085181
Energy: 0.8726988578930591
Energy: 0.6058275805085181
Energy: 0.8726988578936561
Energy: 0.6058275805085181
Energy: 0.8726988578924623
Energy: 0.624027090239737
Energy: 0.6555601524742802
Energy: 0.624027090239737
Energy: 0.6555601524745788
Energy: 0.624027090239737
Energy: 0.6555601524739817
Energy: 0.6755162908173743
Energy: 0.5643499297004996
Energy: 0.6755162908173743
Energy: 0.5643499297002011
Energy: 0.6755162908176728
Energy: 0.5643499297004996
Energy: 0.690558623076829
Energy: 0.5464601017204328
Energy: 0.690558623076829
Energy: 0.5464601017201344
Energy: 0.690558623076829
Energy: 0.5464601017204328
Energy: 0.6160259405013627
Energy: 0.6583689028620329
Energy: 0.6160259405022581
Energy: 0.6583689028620329
Energy: 0.6160259405010642
Energy: 0.6583689028620329
Energy: 0.6690620744059396
Energy: 0.5394984359400877
Energy: 0.6690620744059396
Energy: 0.5394984359394909
Energy: 0.669062074406238
Energy: 0.5394984359391923
Energy: 0.5679567433754626
Energy: 0.6749809758439156
Energy: 0.5679567433760596
Energy: 0.6749809758439156
Energy: 0.5679567433757611
Energy: 0.6749809758439156
Energy: 0.6599547551151641
Energy: 0.60417206282734
Energy: 0.6599547551148656
Energy: 0.6041720628264446
Energy: 0.6599547551148656
Energy: 0.60417206282734
Energy: 0.7674952737547843
Energy: 0.6047298786997168
Energy: 0.7674952737556796
Energy: 0.6047298787012091
Energy: 0.7674952737550828
Energy: 0.604729878702403
Energy: 0.5418247874204762
Energy: 0.6572842964517075
Energy: 0.5418247874204762
Energy: 0.6572842964517075
Energy: 0.5418247874201777
Energy: 0.6572842964517075
Energy: 0.6712185818326468
Energy: 0.5403184249768203
Energy: 0.6712185818323482
Energy: 0.5403184249768203
Energy: 0.6712185818320499
Energy: 0.5403184249768203
Energy: 0.5409551824074608
Energy: 0.6037916944111219
Energy: 0.5409551824077592
Energy: 0.6037916944114202
Energy: 0.5409551824074608
Energy: 0.6037916944114202
Energy: 0.7759404952026167
Energy: 0.6774610975626594
Energy: 0.7759404952023181
Energy: 0.6774610975629579
Energy: 0.775940495202915
Energy: 0.6774610975629579
Energy: 0.6616932614920135
Energy: 0.5647386036004999
Energy: 0.6616932614920135
Energy: 0.5647386036002013
Energy: 0.6616932614920135
Energy: 0.5647386036004999
Energy: 0.5457907172911219
Energy: 0.5696959952819296
Energy: 0.5457907172911219
Energy: 0.5696959952819296
Energy: 0.5457907172911219
Energy: 0.5696959952816312
Energy: 0.5417799319572121
Energy: 0.7695469478260768
Energy: 0.5417799319572121
Energy: 0.7695469478260768
Energy: 0.5417799319575105
Energy: 0.7695469478263753
Energy: 0.6581134651474941
Energy: 0.6199781614531078
Energy: 0.6581134651480912
Energy: 0.61997816145072
Energy: 0.6581134651474941
Energy: 0.6199781614516154
Energy: 0.5392449977825199
Energy: 0.6619744511425915
Energy: 0.5392449977828183
Energy: 0.661974451142293
Energy: 0.539244997781923
Energy: 0.661974451142293
Energy: 0.6795288934374702
Energy: 0.5437663179037181
Energy: 0.6795288934374702
Energy: 0.5437663179040165
Energy: 0.6795288934377687
Energy: 0.5437663179037181
Energy: 0.5429490764958924
Energy: 0.657280146170979
Energy: 0.5429490764979819
Energy: 0.6572801461703821
Energy: 0.5429490764949971
Energy: 0.6572801461706805
Energy: 0.7679647104126854
Energy: 0.5976918797657514
Energy: 0.7679647104123869
Energy: 0.5976918797654529
Energy: 0.7679647104126854
Energy: 0.5976918797654529
Energy: 0.5661666684018885
Energy: 0.5419177902586995
Energy: 0.5661666683986053
Energy: 0.5419177902584011
Energy: 0.566166668398307
Energy: 0.5419177902586995
Energy: 0.5641131276376017
Energy: 0.6709150486498663
Energy: 0.5641131276376017
Energy: 0.6709150486501647
Energy: 0.5641131276376017
Energy: 0.6709150486501647
Energy: 0.5466967298072276
Energy: 0.776505616264484
Energy: 0.5466967298072276
Energy: 0.776505616264484
Energy: 0.5466967298072276
Energy: 0.7765056162641856
Energy: 0.6041146174291698
Energy: 0.5505417081605687
Energy: 0.6041146174288714
Energy: 0.5505417081602701
Energy: 0.6041146174291698
Energy: 0.5505417081599717
Energy: 0.5392130718510705
Energy: 0.6661295839454683
Energy: 0.539213071850772
Energy: 0.6661295839454683
Energy: 0.539213071850772
Energy: 0.6661295839451699
Energy: 0.6564626609041815
Energy: 0.5450541452538542
Energy: 0.6564626609038829
Energy: 0.5450541452547497
Energy: 0.6564626609044799
Energy: 0.5450541452535558
Energy: 0.6084649040385052
Energy: 0.7247675100599487
Energy: 0.6084649040370128
Energy: 0.7247675100602471
Energy: 0.6084649040379081
Energy: 0.7247675100602471
Energy: 0.6084871423679341
Energy: 0.6565328397442033
Energy: 0.6084871423679341
Energy: 0.6565328397442033
Energy: 0.6084871423682326
Energy: 0.6565328397439049
Energy: 0.6651762330044183
Energy: 0.5454641758006327
Energy: 0.6651762330041199
Energy: 0.5454641758006327
Energy: 0.6651762330044183
Energy: 0.5454641758006327
Energy: 0.539228796288167
Energy: 0.6661895505480878
Energy: 0.5392287962878685
Energy: 0.6661895505483864
Energy: 0.539228796288167
Energy: 0.6661895505480878
Energy: 0.6035838893928716
Energy: 0.5505755996684161
Energy: 0.6035838893919763
Energy: 0.5505755996684161
Energy: 0.6035838893925732
Energy: 0.550575599669013
Energy: 0.5465558700990013
Energy: 0.77656923015872
Energy: 0.5465558700990013
Energy: 0.7765692301590186
Energy: 0.5465558700995982
Energy: 0.7765692301590186
Energy: 0.5640730486903938
Energy: 0.6714422741821632
Energy: 0.5640730486906924
Energy: 0.6714422741818646
Energy: 0.5640730486900953
Energy: 0.6714422741815661
Energy: 0.5659346635333597
Energy: 0.5418989099642842
Energy: 0.5659346635443759
Energy: 0.5418989099642842
Energy: 0.5659346635455696
Energy: 0.541898909963389
Energy: 0.767800253760723
Energy: 0.5975577553194434
Energy: 0.7678002537610217
Energy: 0.597557755319145
Energy: 0.7678002537610217
Energy: 0.597557755319145
Energy: 0.5431435807115387
Energy: 0.6572032866234336
Energy: 0.5431435807112402
Energy: 0.6572032866234336
Energy: 0.5431435807106433
Energy: 0.6572032866237321
Energy: 0.6795292333623674
Energy: 0.5437678953096932
Energy: 0.6795292333623674
Energy: 0.5437678953096932
Energy: 0.6795292333617705
Energy: 0.5437678953099917
Energy: 0.5391826410785509
Energy: 0.6632234233199144
Energy: 0.5391826410782522
Energy: 0.663223423319616
Energy: 0.5391826410785509
Energy: 0.6632234233199144
Energy: 0.6605881649405728
Energy: 0.619862904575133
Energy: 0.6605881649396774
Energy: 0.619862904575133
Energy: 0.660588164939976
Energy: 0.619862904575133
Energy: 0.5417473609239009
Energy: 0.7697062378823721
Energy: 0.5417473609236023
Energy: 0.7697062378823721
Energy: 0.5417473609239009
Energy: 0.7697062378823721

minimum gb energy = 0.5391826410782522 eV
minimum distance =  2.57453725156488 Angstroms
sigma value = 67


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

Energy: 0.4375135280636278
Energy: 0.41933084605206394
Energy: 0.43751352806324245
Energy: 0.41933084605186
Energy: 0.43751352806383176
Energy: 0.41933084605186
Energy: 0.39305395049821135
Energy: 0.3780407489792895
Energy: 0.393053950497622
Energy: 0.3780407489788815
Energy: 0.393053950497622
Energy: 0.3780407489790856
Energy: 0.673119838154518
Energy: 0.9506315353506923
Energy: 0.6759742455219597
Energy: 0.9506315353508964
Energy: 0.5643642861916333
Energy: 0.9506315353506923
Energy: 0.39304227774528505
Energy: 0.37810463825360663
Energy: 0.39304227774528505
Energy: 0.37810463825340257
Energy: 0.39304227774528505
Energy: 0.37810463825399193
Energy: 0.4375135280630384
Energy: 0.41933084605206394
Energy: 0.43751352806324245
Energy: 0.41933084605186
Energy: 0.43751352806324245
Energy: 0.41933084605206394
Energy: 0.39305395049861935
Energy: 0.3780407489792895
Energy: 0.39305395049821135
Energy: 0.3780407489790856
Energy: 0.39305395049821135
Energy: 0.3780407489792895
Energy: 0.4196915457713165
Energy: 0.9506315353516898
Energy: 0.4196915457709085
Energy: 0.9506315353516898
Energy: 0.5019072721984142
Energy: 0.9506315353516898

minimum gb energy = 0.3780407489788815 eV
minimum distance =  2.64662719558974 Angstroms
sigma value = 3


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

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Energy: 0.6265729743409928
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Energy: 0.5079011342295278
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Energy: 0.5079011342292808
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Energy: 0.6336890766235845
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Energy: 0.6336890766235845
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Energy: 0.6512382303320146
Energy: 0.515370639498192
Energy: 0.6512382303325573
Energy: 0.5153706394979451
Energy: 0.6512382303322612
Energy: 0.515370639498192
Energy: 0.6647347859273595
Energy: 0.5240281878651052
Energy: 0.6647347859273595
Energy: 0.5240281878648585
Energy: 0.6647347859273595
Energy: 0.5240281878648585
Energy: 0.5303734458396222
Energy: 0.6594669488300748
Energy: 0.530373445839869
Energy: 0.6594669488303215
Energy: 0.5303734458396222
Energy: 0.6594669488300748
Energy: 0.5216960784096168
Energy: 0.6153021687535369
Energy: 0.5216960784099129
Energy: 0.6153021687537836
Energy: 0.521696078410456
Energy: 0.6153021687540798
Energy: 0.6143633219919528
Energy: 0.6066975186402699
Energy: 0.6143633219919528
Energy: 0.6066975186399739
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Energy: 0.6066975186399739
Energy: 0.6083273540534394
Energy: 0.5963458218766369
Energy: 0.6083273540534394
Energy: 0.5963458218768837
Energy: 0.6083273540531433
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Energy: 0.5470397952153639
Energy: 0.6173612705098838
Energy: 0.5470397952145742
Energy: 0.6173612705098838
Energy: 0.547039795214821
Energy: 0.6173612705101799

minimum gb energy = 0.48382871200843164 eV
minimum distance =  2.52568491396198 Angstroms
sigma value = 81


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

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Energy: 0.585510072632927
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Energy: 0.5240471399406447
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Energy: 0.5240471399391544
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Energy: 0.5856383029912369
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Energy: 0.6621727768850851
Energy: 0.526277694092803
Energy: 0.6621727768854577
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Energy: 0.7153869403284484
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Energy: 0.715386940328821
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Energy: 0.6251849943258401
Energy: 0.603842878369086
Energy: 0.6251849943254675
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Energy: 0.5603928179454264
Energy: 0.5810985571297064
Energy: 0.5603928179450537
Energy: 0.5810985571293337
Energy: 0.5603928179446812
Energy: 0.5810985571293337
Energy: 0.475130485037174
Energy: 0.5109056902748524
Energy: 0.47513048503754646
Energy: 0.5109056902741074
Energy: 0.4751304850368014
Energy: 0.5109056902741074
Energy: 0.5597521063023622
Energy: 0.7650394489215632
Energy: 0.5597685491867512
Energy: 0.7650394489219358
Energy: 0.5597521063027348
Energy: 0.7650394489215632
Energy: 0.6062787002081529
Energy: 0.5970840227286908
Energy: 0.6062787002074078
Energy: 0.5970840227290634
Energy: 0.6062787002070351
Energy: 0.5970840227290634
Energy: 0.5774523024244909
Energy: 0.6740890792955758
Energy: 0.5774523024241183
Energy: 0.6740890792952033
Energy: 0.5774523024241183
Energy: 0.6740890792955758
Energy: 0.5814222837987458
Energy: 0.5276807520743279
Energy: 0.5814222837987458
Energy: 0.5276807520747004
Energy: 0.5814222837991183
Energy: 0.5276807520747004

minimum gb energy = 0.4679039816744402 eV
minimum distance =  2.59690692230454 Angstroms
sigma value = 43


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

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Energy: 0.615493895469971
Energy: 0.6166802671861675
Energy: 0.615493895469971
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Energy: 0.587502898187432
Energy: 0.5612441491895757
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Energy: 0.6303313371099403
Energy: 0.6021669885245765
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Energy: 0.6021669885245765
Energy: 0.6303313371099403
Energy: 0.6021669885245765
Energy: 0.6194193008763239
Energy: 0.5913782470166539
Energy: 0.6194193008758664
Energy: 0.5913782470166539
Energy: 0.6194193008758664
Energy: 0.5913782470166539
Energy: 0.7060227500065342
Energy: 0.5507691301091895
Energy: 0.7060227500065342
Energy: 0.5507691301091895
Energy: 0.7060227500060767
Energy: 0.5507691301091895
Energy: 0.6126923573640273
Energy: 0.5543764604066064
Energy: 0.6126923573640273
Energy: 0.5543764604066064
Energy: 0.6126923573640273
Energy: 0.5543764604066064
Energy: 0.6300246043800413
Energy: 0.5774355874614975
Energy: 0.6300246043804989
Energy: 0.5774355874614975
Energy: 0.6300246043800413
Energy: 0.5774355874614975
Energy: 0.6150513544621038
Energy: 0.6354324326916723
Energy: 0.6150513544621038
Energy: 0.6354324326912146
Energy: 0.6150513544621038
Energy: 0.6354324326912146
Energy: 0.6948778976252803
Energy: 0.5421028274962423
Energy: 0.6948778976257378
Energy: 0.5421028274962423
Energy: 0.6948778976257378
Energy: 0.5421028274962423
Energy: 0.534505361732082
Energy: 0.6222568282374009
Energy: 0.534505361732082
Energy: 0.6222568282374009
Energy: 0.534505361732082
Energy: 0.6222568282374009
Energy: 0.6040580480541865
Energy: 0.6054154597424662
Energy: 0.6040580480537289
Energy: 0.6054154597420087
Energy: 0.6040580480537289
Energy: 0.6054154597420087
Energy: 0.5823228118464837
Energy: 0.5823055698799219
Energy: 0.5823228118464837
Energy: 0.5823055698799219
Energy: 0.5823228118464837
Energy: 0.5823055698803794
Energy: 0.6669734713936233
Energy: 0.5731214314651495
Energy: 0.6669734713936233
Energy: 0.5731214314651495
Energy: 0.6669734713936233
Energy: 0.5731214314651495
Energy: 0.5977012753692945
Energy: 0.6354246391684765
Energy: 0.5977012753692945
Energy: 0.6354246391684765
Energy: 0.5977012753697521
Energy: 0.6354246391693917
Energy: 0.6213734838502147
Energy: 0.6044236713736001
Energy: 0.6213734838502147
Energy: 0.6044236713736001
Energy: 0.6213734838502147
Energy: 0.6044236713736001
Energy: 0.5821753293021548
Energy: 0.5853052924824429
Energy: 0.5821753293021548
Energy: 0.5853052924824429
Energy: 0.5821753293021548
Energy: 0.5853052924824429
Energy: 0.6651379691735788
Energy: 0.7017974793150086
Energy: 0.6651379691735788
Energy: 0.7017974793150086
Energy: 0.6651379691735788
Energy: 0.7017974793150086
Energy: 0.5699611562833078
Energy: 0.6004737527653788
Energy: 0.5979549494225904
Energy: 0.6004737527658364
Energy: 0.5699611562833078
Energy: 0.6004737527653788

minimum gb energy = 0.5192722551936294 eV
minimum distance =  2.54709726142604 Angstroms
sigma value = 57


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

Energy: 0.646494729372954
Energy: 0.5633933167247674
Energy: 0.6464947293735467
Energy: 0.5633933167247674
Energy: 0.6464947293723616
Energy: 0.5633933167247674
Energy: 0.5646074823005848
Energy: 0.5838916284476539
Energy: 0.5646074822999921
Energy: 0.5838916284476539
Energy: 0.5646074822999921
Energy: 0.5838916284476539
Energy: 0.563389371971036
Energy: 0.6815320665808319
Energy: 0.563389371971036
Energy: 0.6815320668840721
Energy: 0.5633893719716285
Energy: 0.6815320668153656
Energy: 0.7366515498761241
Energy: 0.5881742167752413
Energy: 0.7366515498761241
Energy: 0.5881742167758338
Energy: 0.7366515498761241
Energy: 0.5881742167758338
Energy: 0.7294966466080344
Energy: 0.604798183180653
Energy: 0.7294966466080344
Energy: 0.604798183180653
Energy: 0.7294966466080344
Energy: 0.604798183180653
Energy: 0.5742096991724396
Energy: 0.6300562408437828
Energy: 0.5742096991724396
Energy: 0.6300562408437828
Energy: 0.5742096991724396
Energy: 0.6300562408437828
Energy: 0.6423396463792166
Energy: 0.6099904845032815
Energy: 0.6423396463792166
Energy: 0.6099904845050592
Energy: 0.6423396463792166
Energy: 0.6099904845044667
Energy: 0.5992408899485465
Energy: 0.5657024567557534
Energy: 0.5992408899485465
Energy: 0.5657024567557534
Energy: 0.599240889947954
Energy: 0.5657024567557534
Energy: 0.6588487308083197
Energy: 0.5768950445462709
Energy: 0.6588487308053571
Energy: 0.5768950445462709
Energy: 0.6588487308071347
Energy: 0.5768950445456784
Energy: 0.5923054285740622
Energy: 0.6042628986866988
Energy: 0.5923054285752472
Energy: 0.6042628986866988
Energy: 0.5923054285746546
Energy: 0.6042628986872913
Energy: 0.5639680138253507
Energy: 0.6208544461955994
Energy: 0.5639680138253507
Energy: 0.6208544461955994
Energy: 0.5639680138247581
Energy: 0.6208544461955994
Energy: 0.6852179275625618
Energy: 0.5970736964139379
Energy: 0.6852179275625618
Energy: 0.5970736964139379
Energy: 0.6852179275631544
Energy: 0.5970736964139379
Energy: 0.5881577393827788
Energy: 0.5774693153140029
Energy: 0.5881577393827788
Energy: 0.5774693153140029
Energy: 0.5881577393827788
Energy: 0.5774693153140029
Energy: 0.6448807675877021
Energy: 0.5069508216398205
Energy: 0.6448807675871095
Energy: 0.506950821639228
Energy: 0.6448807675871095
Energy: 0.506950821639228
Energy: 0.684133266871936
Energy: 0.5352577989128784
Energy: 0.6841332668725286
Energy: 0.5352577989128784
Energy: 0.6841332668725286
Energy: 0.5352577989128784
Energy: 0.6997662241472618
Energy: 0.5701010164636879
Energy: 0.6997662241472618
Energy: 0.5701010164636879
Energy: 0.6997662241478543
Energy: 0.5701010164636879
Energy: 0.5848178830003818
Energy: 0.6044537925497809
Energy: 0.5848178830003818
Energy: 0.6044537925503736
Energy: 0.5848178830003818
Energy: 0.6044537925497809
Energy: 0.5615348138231929
Energy: 0.5913209098497071
Energy: 0.5615348138231929
Energy: 0.5913209098502996
Energy: 0.5615348138231929
Energy: 0.5913209098502996
Energy: 0.5845853778827971
Energy: 0.6044533552487527
Energy: 0.5845853778827971
Energy: 0.6044533552487527
Energy: 0.5845853778827971
Energy: 0.6044533552487527
Energy: 0.6935268242885998
Energy: 0.5702257469899358
Energy: 0.6935268242891923
Energy: 0.5702257469893433
Energy: 0.6935268242891923
Energy: 0.5702257469893433
Energy: 0.6841400545858669
Energy: 0.5350829893285718
Energy: 0.6841400545858669
Energy: 0.5350829893285718
Energy: 0.6841400545858669
Energy: 0.5350829893285718
Energy: 0.6536873838100651
Energy: 0.6420157734563878
Energy: 0.6536873838094726
Energy: 0.6420157734563878
Energy: 0.6536873838094726
Energy: 0.6420157734563878
Energy: 0.5881596751466601
Energy: 0.577554844439839
Energy: 0.5881596751466601
Energy: 0.577554844439839
Energy: 0.5881596751466601
Energy: 0.5775548444404315
Energy: 0.6852148414113273
Energy: 0.5970640985413466
Energy: 0.6852148414113273
Energy: 0.5970640985413466
Energy: 0.6852148414113273
Energy: 0.5970640985413466

minimum gb energy = 0.506950821639228 eV
minimum distance =  2.59421519273648 Angstroms
sigma value = 17


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

Energy: 0.6438796784659178
Energy: 0.5806833111857678
Energy: 0.6438796784659178
Energy: 0.5806833111857678
Energy: 0.6438796784650799
Energy: 0.5806833111857678
Energy: 0.5974123818665401
Energy: 0.6294493348655013
Energy: 0.5974123818665401
Energy: 0.6294493348655013
Energy: 0.5974123818665401
Energy: 0.6294493348655013
Energy: 0.5694412586063716
Energy: 0.6289640870227131
Energy: 0.5694412586063716
Energy: 0.6289640870227131
Energy: 0.5694412586063716
Energy: 0.6289640870227131
Energy: 0.6202916960944608
Energy: 0.6307618588247531
Energy: 0.6202916960944608
Energy: 0.6307618588247531
Energy: 0.6202916960944608
Energy: 0.6307618588247531
Energy: 0.6299202868996612
Energy: 0.623091652519502
Energy: 0.6299202868996612
Energy: 0.623091652519502
Energy: 0.6299202868996612
Energy: 0.623091652518664
Energy: 0.6085175884063839
Energy: 0.6623954604054539
Energy: 0.6085175884063839
Energy: 0.6623954604054539
Energy: 0.6085175884063839
Energy: 0.6623954604054539
Energy: 0.6711077067617522
Energy: 0.5732015333746135
Energy: 0.6711077067617522
Energy: 0.5732015333746135
Energy: 0.6711077067617522
Energy: 0.5732015333746135
Energy: 0.6017926846875602
Energy: 0.6274597775765
Energy: 0.6017926846875602
Energy: 0.6274597775765
Energy: 0.6017926846883983
Energy: 0.6274597775765
Energy: 0.5521886996446482
Energy: 0.6002795389299729
Energy: 0.5521886996446482
Energy: 0.6002795389299729
Energy: 0.5521886996446482
Energy: 0.6002795389299729
Energy: 0.6062132650051467
Energy: 0.5972047739555717
Energy: 0.6062132650051467
Energy: 0.5972047739555717
Energy: 0.6062132650051467
Energy: 0.5972047739555717
Energy: 0.6588963735772203
Energy: 0.5713064396089482
Energy: 0.6588963735772203
Energy: 0.5713064396089482
Energy: 0.6588963735772203
Energy: 0.5713064396089482
Energy: 0.6130411220789854
Energy: 0.614544508635489
Energy: 0.6130411220798234
Energy: 0.614544508635489
Energy: 0.6130411220789854
Energy: 0.614544508634651
Energy: 0.5721670950041919
Energy: 0.6169318729961507
Energy: 0.5721670950041919
Energy: 0.6169318729961507
Energy: 0.5721670950033539
Energy: 0.6169318729953128
Energy: 0.6058437252572446
Energy: 0.5659630858877337
Energy: 0.6058437252564067
Energy: 0.5659630858877337
Energy: 0.6058437252564067
Energy: 0.5659630858877337
Energy: 0.62232366748746
Energy: 0.6091211139694648
Energy: 0.62232366748746
Energy: 0.6091211139694648
Energy: 0.62232366748746
Energy: 0.6091211139694648
Energy: 0.5979333125950191
Energy: 0.6646017102631848
Energy: 0.5979333125950191
Energy: 0.6646017102631848
Energy: 0.5979333125950191
Energy: 0.6646017102631848
Energy: 0.6031917579636931
Energy: 0.567748350692499
Energy: 0.6031917579636931
Energy: 0.567748350692499
Energy: 0.6031917579636931
Energy: 0.567748350692499

minimum gb energy = 0.5521886996446482 eV
minimum distance =  2.61716940172429 Angstroms
sigma value = 17


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

Energy: 0.6116517997976265
Energy: 0.5584566885302459
Energy: 0.611651799797303
Energy: 0.5584566885302459
Energy: 0.6116517997976265
Energy: 0.5584566885305695
Energy: 0.5664413168921785
Energy: 0.5918019730850573
Energy: 0.5664413168921785
Energy: 0.5918019730850573
Energy: 0.5664413168921785
Energy: 0.591801973085381
Energy: 0.5207192078173294
Energy: 0.5819898309005156
Energy: 0.5207192078173294
Energy: 0.5819898308998683
Energy: 0.5207192078173294
Energy: 0.581989830900192
Energy: 0.5844175115587472
Energy: 0.5366226474625365
Energy: 0.5844175115593944
Energy: 0.5366226474628601
Energy: 0.5844175115590708
Energy: 0.5366226474635073
Energy: 0.6361394564596135
Energy: 0.5690803550397739
Energy: 0.636139456459937
Energy: 0.5690803550400976
Energy: 0.6361394564596135
Energy: 0.5690803550400976
Energy: 0.5215477921665942
Energy: 0.5450796459981793
Energy: 0.521547792165947
Energy: 0.5450796459978557
Energy: 0.5215477921665942
Energy: 0.5450796459981793
Energy: 0.6625870711546726
Energy: 0.5534869414387552
Energy: 0.6625870711546726
Energy: 0.5534869414390788
Energy: 0.6625870711546726
Energy: 0.5534869414390788
Energy: 0.5988907893838259
Energy: 0.5839008688712881
Energy: 0.5988907893838259
Energy: 0.5839008688716117
Energy: 0.5988907893838259
Energy: 0.5839008688712881
Energy: 0.5601554723015018
Energy: 0.596846402965702
Energy: 0.5601554723015018
Energy: 0.596846402965702
Energy: 0.5601554723015018
Energy: 0.5968464029653785
Energy: 0.5568568485123657
Energy: 0.4773292049899758
Energy: 0.5568568485126892
Energy: 0.47732920498965226
Energy: 0.5568568485120421
Energy: 0.4773292049899758
Energy: 0.5938596748409164
Energy: 0.5903071664508666
Energy: 0.5938596748405928
Energy: 0.5903071664508666
Energy: 0.5938596748405928
Energy: 0.5903071664508666
Energy: 0.5306898214532229
Energy: 0.5984017671425452
Energy: 0.5306898214532229
Energy: 0.5984017671425452
Energy: 0.5306898214532229
Energy: 0.5984017671425452
Energy: 0.6072320634550652
Energy: 0.5634507426661057
Energy: 0.607232063456036
Energy: 0.5634507426657821
Energy: 0.6072320634563596
Energy: 0.5634507426657821
Energy: 0.6328374379243558
Energy: 0.5321198009130486
Energy: 0.6328374379243558
Energy: 0.5321198009130486
Energy: 0.6328374379246794
Energy: 0.5321198009130486
Energy: 0.6007438669934294
Energy: 0.5952451532135764
Energy: 0.6007438669934294
Energy: 0.5952451532132529
Energy: 0.6007438669934294
Energy: 0.5952451532132529
Energy: 0.555009153160003
Energy: 0.5803232877294492
Energy: 0.555009153160003
Energy: 0.5803232877294492
Energy: 0.5550091531596794
Energy: 0.5803232877294492
Energy: 0.5143377543516993
Energy: 0.5127786846665207
Energy: 0.5143377543500812
Energy: 0.5127786846665207
Energy: 0.5143377543529937
Energy: 0.5127786846665207
Energy: 0.6122922901317389
Energy: 0.5709640147633057
Energy: 0.6122922901314153
Energy: 0.5709640147633057
Energy: 0.6122922901314153
Energy: 0.5709640147633057
Energy: 0.5628027001126954
Energy: 0.5963450501253723
Energy: 0.5628027001126954
Energy: 0.5963450501253723
Energy: 0.5628027001126954
Energy: 0.5963450501250488
Energy: 0.5549539617605057
Energy: 0.5319674543671481
Energy: 0.5549539617605057
Energy: 0.5319674543668245
Energy: 0.5549539617608293
Energy: 0.5319674543668245
Energy: 0.5631897945988681
Energy: 0.5965147017520656
Energy: 0.5631897945988681
Energy: 0.5965147017520656
Energy: 0.5631897945991917
Energy: 0.5965147017520656
Energy: 0.6124649948764584
Energy: 0.5709623857234478
Energy: 0.6124649948767821
Energy: 0.5709623857234478
Energy: 0.6124649948764584
Energy: 0.5709623857231243
Energy: 0.5139436398732038
Energy: 0.5126380840852172
Energy: 0.5139436398735274
Energy: 0.5126380840855407
Energy: 0.5139436398735274
Energy: 0.5126380840852172
Energy: 0.5549311643890193
Energy: 0.6138542245080383
Energy: 0.5549311643893429
Energy: 0.6138542245077147
Energy: 0.5549311643893429
Energy: 0.6138542245080383
Energy: 0.6007394631842877
Energy: 0.5951215289800577
Energy: 0.6007394631839641
Energy: 0.5951215289800577
Energy: 0.6007394631846112
Energy: 0.5951215289803813
Energy: 0.6328653875468626
Energy: 0.5319783399446948
Energy: 0.6328653875468626
Energy: 0.5319783399446948
Energy: 0.6328653875465391
Energy: 0.5319783399446948
Energy: 0.6072242790739575
Energy: 0.5427331585919128
Energy: 0.6072242790733103
Energy: 0.5427331585919128
Energy: 0.6072242790742811
Energy: 0.5427331585919128
Energy: 0.5308573716123278
Energy: 0.5982297672004065
Energy: 0.5308573716116807
Energy: 0.5982297672010537
Energy: 0.5308573716120042
Energy: 0.5982297672004065
Energy: 0.5938762098167999
Energy: 0.5903369267300974
Energy: 0.5938762098171235
Energy: 0.5903369267300974
Energy: 0.5938762098171235
Energy: 0.5903369267300974
Energy: 0.5565658190686453
Energy: 0.47725450269682235
Energy: 0.5565658190683217
Energy: 0.47725450269682235
Energy: 0.5565658190686453
Energy: 0.4772545026964987
Energy: 0.5601565654784528
Energy: 0.5971768148362352
Energy: 0.5601565654784528
Energy: 0.5971768148359117
Energy: 0.5601565654781292
Energy: 0.5971768148362352
Energy: 0.5989819782638323
Energy: 0.6120758089217593
Energy: 0.5989819782638323
Energy: 0.6120758089220828
Energy: 0.5989819782631851
Energy: 0.6120758089220828
Energy: 0.662752833893209
Energy: 0.553509207589459
Energy: 0.6627528338935326
Energy: 0.553509207589459
Energy: 0.662752833893209
Energy: 0.553509207589459
Energy: 0.5216436763209082
Energy: 0.5247397204188715
Energy: 0.5216436763215554
Energy: 0.5247397204188715
Energy: 0.5216436763212318
Energy: 0.5247397204185479
Energy: 0.6363224181682117
Energy: 0.5691060887893143
Energy: 0.6363224181682117
Energy: 0.5691060887889908
Energy: 0.6363224181682117
Energy: 0.5691060887893143
Energy: 0.5844782703811193
Energy: 0.5813025681169984
Energy: 0.5844782703811193
Energy: 0.5813025681173221
Energy: 0.5844782703807957
Energy: 0.5813025681173221
Energy: 0.5208690024262926
Energy: 0.5819706979980941
Energy: 0.5208690024262926
Energy: 0.5819706979980941
Energy: 0.5208690024262926
Energy: 0.5819706979980941
Energy: 0.5665297812708797
Energy: 0.5854661476050893
Energy: 0.5665297812708797
Energy: 0.5854661476050893
Energy: 0.5665297812708797
Energy: 0.5854661476050893
Energy: 0.6116517997976265
Energy: 0.5584566885312167
Energy: 0.6116517997976265
Energy: 0.5584566885312167
Energy: 0.6116517997976265
Energy: 0.5584566885312167
Energy: 0.5664413168931492
Energy: 0.547131472523015
Energy: 0.5664413168931492
Energy: 0.547131472523015
Energy: 0.5664413168931492
Energy: 0.547131472523015
Energy: 0.5207192078179765
Energy: 0.5819898308995448
Energy: 0.5207192078179765
Energy: 0.5819898308992213
Energy: 0.5207192078179765
Energy: 0.5819898308988977
Energy: 0.5844175115590708
Energy: 0.5283576437756667
Energy: 0.5844175115590708
Energy: 0.5283576437756667
Energy: 0.5844175115590708
Energy: 0.5283576437753432
Energy: 0.6361394564596135
Energy: 0.5690803550410684
Energy: 0.636139456459937
Energy: 0.5690803550400976
Energy: 0.636139456459937
Energy: 0.5690803550410684

minimum gb energy = 0.4772545026964987 eV
minimum distance =  2.54991200537633 Angstroms
sigma value = 57


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

Energy: 0.5837702285621083
Energy: 0.5423010502120958
Energy: 0.583770228563162
Energy: 0.5423010502115689
Energy: 0.583770228562635
Energy: 0.5423010502120958
Energy: 0.5237469088322638
Energy: 0.5276093727776843
Energy: 0.5237469088322638
Energy: 0.5276093727776843
Energy: 0.5237469088322638
Energy: 0.5276093727771574
Energy: 0.5056417421558836
Energy: 0.5243341020695441
Energy: 0.5056417421553567
Energy: 0.524334102070071
Energy: 0.5056417421558836
Energy: 0.524334102070071
Energy: 0.5539887380281
Energy: 0.49808985035307735
Energy: 0.5539887380281
Energy: 0.49808985035307735
Energy: 0.5539887380281
Energy: 0.49808985035307735
Energy: 0.5747399277311518
Energy: 0.5107084328453865
Energy: 0.5747399277311518
Energy: 0.5107084328453865
Energy: 0.5747399277311518
Energy: 0.5107084328453865
Energy: 0.48774231171768995
Energy: 0.4702502772988175
Energy: 0.48774231171768995
Energy: 0.4702502772988175
Energy: 0.4877423117171631
Energy: 0.4702502772988175
Energy: 0.5620641427912143
Energy: 0.5222972099491321
Energy: 0.5620641427912143
Energy: 0.5222972099491321
Energy: 0.5620641427912143
Energy: 0.5222972099491321
Energy: 0.56116664190987
Energy: 0.570712555658806
Energy: 0.56116664190987
Energy: 0.570712555658806
Energy: 0.56116664190987
Energy: 0.570712555658806
Energy: 0.5085395508378623
Energy: 0.5104734568579162
Energy: 0.5085395508378623
Energy: 0.5104734568584433
Energy: 0.5085395508378623
Energy: 0.5104734568579162
Energy: 0.5500407875796676
Energy: 0.4691013527307653
Energy: 0.5500407875791407
Energy: 0.46910135272971154
Energy: 0.5500407875791407
Energy: 0.46910135272971154
Energy: 0.5573419595420102
Energy: 0.5602451963835612
Energy: 0.5573419595420102
Energy: 0.5602451963835612
Energy: 0.557341959542537
Energy: 0.5602451963835612
Energy: 0.4849836012598256
Energy: 0.5640345133992566
Energy: 0.4849836012598256
Energy: 0.5640345133992566
Energy: 0.4849836012598256
Energy: 0.5640345133992566
Energy: 0.5458090157110792
Energy: 0.5073076279051757
Energy: 0.5458090157110792
Energy: 0.5073076279051757
Energy: 0.5458090157110792
Energy: 0.5073076279051757
Energy: 0.5690225416197963
Energy: 0.5187632249370149
Energy: 0.5690225416203232
Energy: 0.5187632249370149
Energy: 0.5690225416197963
Energy: 0.5187632249370149
Energy: 0.5018134871297928
Energy: 0.5759381947309347
Energy: 0.5018134871297928
Energy: 0.5759381947309347
Energy: 0.5018134871292658
Energy: 0.5759381947304079
Energy: 0.5602694985667955
Energy: 0.5249934601804322
Energy: 0.5602694985673224
Energy: 0.5249934601804322
Energy: 0.5602694985673224
Energy: 0.5249934601804322
Energy: 0.6104122929029427
Energy: 0.509859052998074
Energy: 0.6104122929029427
Energy: 0.509859052998074
Energy: 0.6104122929029427
Energy: 0.509859052998074
Energy: 0.572286799430173
Energy: 0.5722487594839507
Energy: 0.572286799430173
Energy: 0.5722487594839507
Energy: 0.572286799429646
Energy: 0.5722487594839507
Energy: 0.523593250386134
Energy: 0.5499585009695688
Energy: 0.5235932503866608
Energy: 0.5499585009695688
Energy: 0.523593250386134
Energy: 0.5499585009695688
Energy: 0.5357653500900267
Energy: 0.4921275574838089
Energy: 0.5357653500900267
Energy: 0.4921275574838089
Energy: 0.5357653500894997
Energy: 0.4921275574838089
Energy: 0.5715668560879614
Energy: 0.5420628501046211
Energy: 0.5715668560879614
Energy: 0.5420628501040943
Energy: 0.5715668560879614
Energy: 0.5420628501046211
Energy: 0.49975599154275246
Energy: 0.5566434269800253
Energy: 0.4997559915422256
Energy: 0.5566434269800253
Energy: 0.49975599154275246
Energy: 0.5566434269800253
Energy: 0.48263278816635563
Energy: 0.47996063500295916
Energy: 0.48263278816635563
Energy: 0.47996063500295916
Energy: 0.48263278816635563
Energy: 0.47996063500295916
Energy: 0.5254838266425933
Energy: 0.6123705161196991
Energy: 0.5254838266425933
Energy: 0.6123705161196991
Energy: 0.5254838266425933
Energy: 0.6123705161196991
Energy: 0.5671869714020689
Energy: 0.5438202264824012
Energy: 0.5671869714025957
Energy: 0.5438202264818743
Energy: 0.5671869714025957
Energy: 0.5438202264818743
Energy: 0.4775365865980607
Energy: 0.47971463274717796
Energy: 0.4775365866001682
Energy: 0.47971463274717796
Energy: 0.47753658660069503
Energy: 0.4797146327466511
Energy: 0.5017340572785355
Energy: 0.5708759100410515
Energy: 0.5017340572785355
Energy: 0.5708759100415783
Energy: 0.5017340572785355
Energy: 0.5708759100415783

minimum gb energy = 0.46910135272971154 eV
minimum distance =  2.5813763018945 Angstroms
sigma value = 43


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

Energy: 0.5427483329799545
Energy: 0.42819475511801164
Energy: 0.5427483329803384
Energy: 0.4281947551183955
Energy: 0.5427483329799545
Energy: 0.42819475511801164
Energy: 0.4609729002174728
Energy: 0.47293152217134765
Energy: 0.46097290021785664
Energy: 0.47293152217134765
Energy: 0.46097290021785664
Energy: 0.47293152217134765
Energy: 0.44609812665864795
Energy: 0.47306923840619824
Energy: 0.44609812665903187
Energy: 0.47306923840619824
Energy: 0.44609812665903187
Energy: 0.47306923840619824
Energy: 0.5252142606987482
Energy: 0.43305692638987137
Energy: 0.5252142606918383
Energy: 0.43305692638987137
Energy: 0.5252142606914544
Energy: 0.43305692638987137
Energy: 0.4956730025015917
Energy: 0.46577921106752374
Energy: 0.4956730025015917
Energy: 0.46577921106752374
Energy: 0.4956730025015917
Energy: 0.46577921106752374
Energy: 0.428002064216832
Energy: 0.4558278790173153
Energy: 0.4280020642172158
Energy: 0.4558278790173153
Energy: 0.428002064216832
Energy: 0.4558278790173153
Energy: 0.5042890987179237
Energy: 0.45130661232750385
Energy: 0.5042890987175399
Energy: 0.45130661232750385
Energy: 0.5042890987179237
Energy: 0.45130661232750385
Energy: 0.5186755457741815
Energy: 0.5047836618848747
Energy: 0.5186755457741815
Energy: 0.5047836618848747
Energy: 0.5186755457745654
Energy: 0.5047836618848747
Energy: 0.4235841218046224
Energy: 0.45443358301339065
Energy: 0.4235841218046224
Energy: 0.4544335830130068
Energy: 0.4235841218050064
Energy: 0.45443358301339065
Energy: 0.4714836740014162
Energy: 0.4463516957538962
Energy: 0.4714836740014162
Energy: 0.4463516957538962
Energy: 0.4714836740014162
Energy: 0.4463516957538962
Energy: 0.5005192957857072
Energy: 0.4862398579913017
Energy: 0.5005192957857072
Energy: 0.4862398579913017
Energy: 0.5005192957857072
Energy: 0.4862398579913017
Energy: 0.4408692654979649
Energy: 0.47325695485909947
Energy: 0.4408692654979649
Energy: 0.4732569548594834
Energy: 0.44086926549758093
Energy: 0.47325695485909947
Energy: 0.4717229534840148
Energy: 0.43809260579925113
Energy: 0.47172295348363097
Energy: 0.43809260579925113
Energy: 0.4717229534840148
Energy: 0.43809260579925113
Energy: 0.4946476903083963
Energy: 0.4953644931417978
Energy: 0.4946476903083963
Energy: 0.4953644931417978
Energy: 0.4946476903083963
Energy: 0.49536449314141395
Energy: 0.445766598159401
Energy: 0.4718957337088704
Energy: 0.44576659815978487
Energy: 0.4718957337092543
Energy: 0.445766598159401
Energy: 0.4718957337092543
Energy: 0.48400002579332935
Energy: 0.4328607442579724
Energy: 0.48400002579332935
Energy: 0.4328607442579724
Energy: 0.48400002579332935
Energy: 0.4328607442579724
Energy: 0.5072224136121959
Energy: 0.49423565099140165
Energy: 0.5072224136121959
Energy: 0.49423565099140165
Energy: 0.5072224136121959
Energy: 0.49423565099140165
Energy: 0.4280498859874527
Energy: 0.52306480373655
Energy: 0.4280498859870688
Energy: 0.52306480373655
Energy: 0.4280498859874527
Energy: 0.52306480373655
Energy: 0.45700328076330277
Energy: 0.4479973140888101
Energy: 0.45700328076291885
Energy: 0.4479973140888101
Energy: 0.45700328076291885
Energy: 0.44799731408919397
Energy: 0.4803354326903211
Energy: 0.4967184379791226
Energy: 0.4803354326899372
Energy: 0.4967184379795065
Energy: 0.4803354326903211
Energy: 0.4967184379795065
Energy: 0.4401716366427946
Energy: 0.5430401544300949
Energy: 0.4401716366427946
Energy: 0.5430401544300949
Energy: 0.4401716366427946
Energy: 0.5430401544300949
Energy: 0.4858525904677266
Energy: 0.4616419714265714
Energy: 0.4858525904681104
Energy: 0.4616419714265714
Energy: 0.4858525904681104
Energy: 0.4616419714265714
Energy: 0.4747144760222035
Energy: 0.44846633290012344
Energy: 0.4747144760225874
Energy: 0.44846633289973953
Energy: 0.4747144760222035
Energy: 0.44846633289973953
Energy: 0.5110697390260099
Energy: 0.5332938897321089
Energy: 0.5110697390263939
Energy: 0.5332938897321089
Energy: 0.5110697390263939
Energy: 0.5332938897324927
Energy: 0.4613941735851743
Energy: 0.4514736882572041
Energy: 0.4613941735851743
Energy: 0.4514736882572041
Energy: 0.4613941735851743
Energy: 0.4514736882572041
Energy: 0.5006729692522821
Energy: 0.43479380707466103
Energy: 0.5006729692522821
Energy: 0.43479380707466103
Energy: 0.5006729692518982
Energy: 0.43479380707466103
Energy: 0.45708021644760083
Energy: 0.5090260180097266
Energy: 0.45708021644798474
Energy: 0.5090260180097266
Energy: 0.45708021644760083
Energy: 0.5090260180097266
Energy: 0.4529186646961224
Energy: 0.5041033855637339
Energy: 0.45291866469573844
Energy: 0.5041033855637339
Energy: 0.45291866469573844
Energy: 0.50410338556335
Energy: 0.4921977734764836
Energy: 0.4180261748745265
Energy: 0.4921977734764836
Energy: 0.4180261748745265
Energy: 0.4921977734764836
Energy: 0.4180261748745265
Energy: 0.44086442890181143
Energy: 0.48927309001149666
Energy: 0.44086442890181143
Energy: 0.48927309001149666
Energy: 0.44086442890181143
Energy: 0.48927309001149666
Energy: 0.4551706207200083
Energy: 0.5148461352383541
Energy: 0.45517062071962433
Energy: 0.5148461352383541
Energy: 0.4551706207203921
Energy: 0.5148461352383541
Energy: 0.49286830533843307
Energy: 0.413972808669696
Energy: 0.49286830533843307
Energy: 0.413972808669696
Energy: 0.49286830533843307
Energy: 0.413972808669696
Energy: 0.40635957550764545
Energy: 0.5388150473058014
Energy: 0.40635957550764545
Energy: 0.5388150473061853
Energy: 0.4063595755080294
Energy: 0.5388150473058014
Energy: 0.4861287209112052
Energy: 0.4961147695383919
Energy: 0.4861287209112052
Energy: 0.4961147695383919
Energy: 0.48612872091158904
Energy: 0.4961147695383919
Energy: 0.4603297339419893
Energy: 0.4343698954332009
Energy: 0.4603297339419893
Energy: 0.434369895432817
Energy: 0.4603297339419893
Energy: 0.434369895432817
Energy: 0.42717126135691175
Energy: 0.4631313872612885
Energy: 0.42717126135691175
Energy: 0.4631313872612885
Energy: 0.42717126135691175
Energy: 0.4631313872612885

minimum gb energy = 0.40635957550764545 eV
minimum distance =  2.57428773379754 Angstroms
sigma value = 81


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

Energy: 0.10429088781313534
Energy: 0.1305016611276437
Energy: 0.10429088781313534
Energy: 0.13050166112778794
Energy: 0.10429088781313534
Energy: 0.13050166112749942
Energy: 0.26896118396609886
Energy: 0.1948157096942679
Energy: 0.2689611839662431
Energy: 0.19481570969412362
Energy: 0.26896118396609886
Energy: 0.19481570969412362
Energy: 0.2688815433904467
Energy: 0.1944462956591603
Energy: 0.2688815433904467
Energy: 0.19444629565930455
Energy: 0.2688815433904467
Energy: 0.19444629565930455
Energy: 0.10429088781313534
Energy: 0.13050166112735517
Energy: 0.10429088781313534
Energy: 0.1305016611276437
Energy: 0.10429088781313534
Energy: 0.13050166112749942
Energy: 0.2689611839662431
Energy: 0.19481570969412362
Energy: 0.2689611839662431
Energy: 0.1948157096939954
Energy: 0.26896118396609886
Energy: 0.1948157096942679
Energy: 0.2688815433904467
Energy: 0.19444629565930455
Energy: 0.26888154339030246
Energy: 0.1944462956591603
Energy: 0.268881543390591
Energy: 0.1944462956591603
Energy: 0.10429088781313534
Energy: 0.13050166112735517
Energy: 0.10429088781313534
Energy: 0.13050166112778794
Energy: 0.10429088781313534
Energy: 0.1305016611276437
Energy: 0.26896118396595453
Energy: 0.1948157096942679
Energy: 0.2689611839662431
Energy: 0.19481570969412362
Energy: 0.26896118396595453
Energy: 0.1948157096939954
Energy: 0.268881543390591
Energy: 0.1944462956594488
Energy: 0.268881543390591
Energy: 0.19444629565903207
Energy: 0.268881543390591
Energy: 0.1944462956594488
Energy: 0.10429088781313534
Energy: 0.1305016611276437
Energy: 0.10429088781313534
Energy: 0.13050166112749942
Energy: 0.10429088781313534
Energy: 0.13050166112749942

minimum gb energy = 0.10429088781313534 eV
minimum distance =  2.83767855923968 Angstroms
sigma value = 3


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

Energy: 0.4821342552205756
Energy: 0.4891521568391775
Energy: 0.4821342552205756
Energy: 0.48915215683959967
Energy: 0.4821342552201536
Energy: 0.4891521568391775
Energy: 0.46808078706781464
Energy: 0.45358697798397357
Energy: 0.4680807870673925
Energy: 0.45358697798397357
Energy: 0.4680807870673925
Energy: 0.45358697798397357
Energy: 0.47632045463818445
Energy: 0.45915605546373806
Energy: 0.47632045463818445
Energy: 0.45915605546373806
Energy: 0.47632045463818445
Energy: 0.45915605546373806
Energy: 0.4742330589574192
Energy: 0.44238606560572763
Energy: 0.4742330589569971
Energy: 0.44238606560614974
Energy: 0.4742330589569971
Energy: 0.44238606560614974
Energy: 0.39888508998531436
Energy: 0.4889606005712825
Energy: 0.3988850899857365
Energy: 0.4889606005717046
Energy: 0.3988850899848923
Energy: 0.4889606005717046
Energy: 0.4967614950807316
Energy: 0.4490538560295983
Energy: 0.4967614950811537
Energy: 0.4490538560295983
Energy: 0.49676149508157574
Energy: 0.4490538560295983
Energy: 0.4586900508339132
Energy: 0.4466440948939121
Energy: 0.4586900508343353
Energy: 0.44664409489348994
Energy: 0.4586900508343353
Energy: 0.4466440948939121
Energy: 0.3970873254529043
Energy: 0.47118369091100337
Energy: 0.39708732545332637
Energy: 0.47118369091100337
Energy: 0.3970873254529043
Energy: 0.47118369091100337
Energy: 0.46574240939738665
Energy: 0.4625044044034955
Energy: 0.46574240939738665
Energy: 0.4625044044034955
Energy: 0.46574240939738665
Energy: 0.46250440440307344
Energy: 0.4885946202565254
Energy: 0.4272031884143729
Energy: 0.4885946202565254
Energy: 0.4272031884143729
Energy: 0.4885946202565254
Energy: 0.427203188414795
Energy: 0.40600401489092386
Energy: 0.47029771000402043
Energy: 0.40600401489092386
Energy: 0.47029771000402043
Energy: 0.4060040148905018
Energy: 0.47029771000402043
Energy: 0.4613609530397074
Energy: 0.47879518810635796
Energy: 0.4613609530397074
Energy: 0.47879518810635796
Energy: 0.4613609530397074
Energy: 0.47879518810593585
Energy: 0.4779552830189653
Energy: 0.3961742309460247
Energy: 0.4779552830185431
Energy: 0.3961742309460247
Energy: 0.4779552830189653
Energy: 0.3961742309460247
Energy: 0.4094676286253883
Energy: 0.4573560003287879
Energy: 0.4094676286253883
Energy: 0.4573560003287879
Energy: 0.4094676286253883
Energy: 0.4573560003287879
Energy: 0.4465764954519935
Energy: 0.47725286162484515
Energy: 0.4465764954519935
Energy: 0.47725286162484515
Energy: 0.4465764954519935
Energy: 0.47725286162484515
Energy: 0.4977499063650416
Energy: 0.4462211078148928
Energy: 0.4977499063650416
Energy: 0.4462211078148928
Energy: 0.4977499063654637
Energy: 0.4462211078148928
Energy: 0.4586657552413458
Energy: 0.48072198551422735
Energy: 0.45866575524176795
Energy: 0.48072198551422735
Energy: 0.4586657552413458
Energy: 0.48072198551464945
Energy: 0.4546634921979856
Energy: 0.4649037193723283
Energy: 0.4546634921979856
Energy: 0.4649037193723283
Energy: 0.4546634921979856
Energy: 0.4649037193723283
Energy: 0.44706285038443294
Energy: 0.4515671141182507
Energy: 0.44706285038443294
Energy: 0.4515671141182507
Energy: 0.4470628503840109
Energy: 0.4515671141182507
Energy: 0.4686710769075055
Energy: 0.4878597576797848
Energy: 0.4686710769079276
Energy: 0.4878597576797848
Energy: 0.4686710769075055
Energy: 0.4878597576797848
Energy: 0.4726907312025558
Energy: 0.44743743133376374
Energy: 0.4726907312025558
Energy: 0.4474374313341858
Energy: 0.4726907312025558
Energy: 0.4474374313341858
Energy: 0.4675457937274997
Energy: 0.45042917629751217
Energy: 0.4675457937274997
Energy: 0.45042917629751217
Energy: 0.4675457937274997
Energy: 0.45042917629751217
Energy: 0.4455333560871976
Energy: 0.48631779055193414
Energy: 0.4455333560871976
Energy: 0.4863177905515121
Energy: 0.4455333560871976
Energy: 0.48631779055193414
Energy: 0.4528737095696722
Energy: 0.4283127764865597
Energy: 0.4528737095696722
Energy: 0.4283127764861376
Energy: 0.4528737095692501
Energy: 0.4283127764865597
Energy: 0.47313611731831373
Energy: 0.4804074811747322
Energy: 0.47313611731831373
Energy: 0.48040748117515425
Energy: 0.47313611731831373
Energy: 0.4804074811747322
Energy: 0.42133336270957733
Energy: 0.46492813131289823
Energy: 0.42133336270957733
Energy: 0.46492813131289823
Energy: 0.42133336270957733
Energy: 0.46492813131289823
Energy: 0.5062304297817558
Energy: 0.4262008499720747
Energy: 0.5062304297817558
Energy: 0.4262008499720747
Energy: 0.5062304297813337
Energy: 0.4262008499720747
Energy: 0.4590729736274103
Energy: 0.4626057503049831
Energy: 0.4590729736274103
Energy: 0.4626057503054051
Energy: 0.4590729736274103
Energy: 0.4626057503054051
Energy: 0.40470407244548584
Energy: 0.49996044315289845
Energy: 0.40470407244548584
Energy: 0.49996044315289845
Energy: 0.40470407244548584
Energy: 0.4999604431524764
Energy: 0.5105316721619569
Energy: 0.43556084211909296
Energy: 0.510531672162379
Energy: 0.43556084211909296
Energy: 0.510531672162379
Energy: 0.43556084211909296
Energy: 0.48147710407045186
Energy: 0.4632959210090821
Energy: 0.48147710407087396
Energy: 0.4632959210090821
Energy: 0.48147710407087396
Energy: 0.4632959210090821
Energy: 0.437912849191302
Energy: 0.45065433991427667
Energy: 0.437912849191302
Energy: 0.4506543399146988
Energy: 0.437912849191302
Energy: 0.4506543399146988
Energy: 0.45075357241980135
Energy: 0.4406945602396614
Energy: 0.45075357241980135
Energy: 0.4406945602396614
Energy: 0.45075357241980135
Energy: 0.4406945602396614

minimum gb energy = 0.3961742309460247 eV
minimum distance =  2.60570234839028 Angstroms
sigma value = 67


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

Energy: 0.5573858203770615
Energy: 0.5302746181974604
Energy: 0.5573858203770615
Energy: 0.5302746181974604
Energy: 0.5573858203770615
Energy: 0.5302746181974604
Energy: 0.5046724594544645
Energy: 0.5185243633149589
Energy: 0.5046724594544645
Energy: 0.5185243633143575
Energy: 0.5046724594544645
Energy: 0.5185243633149589
Energy: 0.5754781135890997
Energy: 0.5102244639830045
Energy: 0.5754781135890997
Energy: 0.5102244639830045
Energy: 0.5535250481604339
Energy: 0.5102244639830045
Energy: 0.523964037729566
Energy: 0.489815659659705
Energy: 0.5239640377289645
Energy: 0.489815659659705
Energy: 0.5239640377289645
Energy: 0.4898156596591036
Energy: 0.5135560865883201
Energy: 0.5306807035011236
Energy: 0.5135560865883201
Energy: 0.5306807035011236
Energy: 0.5135560865883201
Energy: 0.5306807035011236
Energy: 0.5345523951608745
Energy: 0.5188232391287753
Energy: 0.5345523951608745
Energy: 0.5188232391281736
Energy: 0.5345523951608745
Energy: 0.5188232391281736
Energy: 0.5702735839205654
Energy: 0.4798551250440553
Energy: 0.5702735839205654
Energy: 0.4798551250446567
Energy: 0.5702735839205654
Energy: 0.4798551250446567
Energy: 0.5054102889702689
Energy: 0.553264371426829
Energy: 0.5054102889702689
Energy: 0.553264371426829
Energy: 0.5054102889702689
Energy: 0.553264371426829
Energy: 0.5339834659093194
Energy: 0.5454172531833384
Energy: 0.5339834659093194
Energy: 0.5454172531833384
Energy: 0.5339834659093194
Energy: 0.5454172531833384
Energy: 0.5470907560661525
Energy: 0.5213077882437794
Energy: 0.5470907560661525
Energy: 0.5213077882437794
Energy: 0.5470907560661525
Energy: 0.5213077882437794
Energy: 0.50871401253582
Energy: 0.5480387387679072
Energy: 0.50871401253582
Energy: 0.5480387387679072
Energy: 0.5087140125352186
Energy: 0.5480387387679072
Energy: 0.5030668035514986
Energy: 0.5719575285314181
Energy: 0.5030668035514986
Energy: 0.5719575285320194
Energy: 0.5030668035514986
Energy: 0.5719575285320194
Energy: 0.49848906718926544
Energy: 0.517324354519753
Energy: 0.49848906718986696
Energy: 0.517324354519753
Energy: 0.49848906718986696
Energy: 0.517324354519753
Energy: 0.5298327663661736
Energy: 0.5503492284447524
Energy: 0.5298327663655722
Energy: 0.5503492284441511
Energy: 0.5298327663661736
Energy: 0.5503492284441511
Energy: 0.5128730189372587
Energy: 0.5237332716951866
Energy: 0.5128730189372587
Energy: 0.5237332716951866
Energy: 0.5128730189378601
Energy: 0.5237332716951866
Energy: 0.521660352749549
Energy: 0.5161696864181997
Energy: 0.521660352749549
Energy: 0.5161696864181997
Energy: 0.521660352749549
Energy: 0.5161696864181997
Energy: 0.49821606781695127
Energy: 0.5282521068797674
Energy: 0.49821606781695127
Energy: 0.5282521068797674
Energy: 0.49821606781695127
Energy: 0.5282521068797674
Energy: 0.5556622137839738
Energy: 0.4856905787857192
Energy: 0.5556622137839738
Energy: 0.4856905787857192
Energy: 0.5556622137839738
Energy: 0.4856905787857192
Energy: 0.5495904228003254
Energy: 0.5354512448265442
Energy: 0.5495904228003254
Energy: 0.5354512448265442
Energy: 0.5495904228003254
Energy: 0.5354512448265442
Energy: 0.5247493491172742
Energy: 0.5646660531748582
Energy: 0.5247493491172742
Energy: 0.5646660531748582
Energy: 0.5247493491166728
Energy: 0.5646660531748582
Energy: 0.5343800516244621
Energy: 0.5051444340798005
Energy: 0.5343800516250635
Energy: 0.5051444340804019
Energy: 0.5343800516244621
Energy: 0.5051444340804019
Energy: 0.5270666252896477
Energy: 0.5526536137770484
Energy: 0.527066625290249
Energy: 0.5526536137770484
Energy: 0.5270666252896477
Energy: 0.5526536137770484
Energy: 0.5335186540656566
Energy: 0.51595644211495
Energy: 0.5335186540656566
Energy: 0.51595644211495
Energy: 0.5335186540656566
Energy: 0.51595644211495

minimum gb energy = 0.4798551250440553 eV
minimum distance =  2.65751816880626 Angstroms
sigma value = 33


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

Energy: 0.613435997879742
Energy: 0.5581692395128259
Energy: 0.5972264949122922
Energy: 0.5581692395132075
Energy: 0.613435997879742
Energy: 0.5581692395132075
Energy: 0.5461441984068858
Energy: 0.580136489266089
Energy: 0.5461441984065043
Energy: 0.5801364892645628
Energy: 0.5461441984068858
Energy: 0.5801364892645628
Energy: 0.5918198892421255
Energy: 0.5714468270351964
Energy: 0.5918198892425072
Energy: 0.5714468270355779
Energy: 0.5918198892417439
Energy: 0.5714468270355779
Energy: 0.5623365606614469
Energy: 0.5348952365828527
Energy: 0.5623365606618284
Energy: 0.5348952365820897
Energy: 0.5623365606618284
Energy: 0.5348952365820897
Energy: 0.5370700953102822
Energy: 0.5501500004169971
Energy: 0.5370700953106636
Energy: 0.5501500004173787
Energy: 0.5370700953099006
Energy: 0.5501500004173787
Energy: 0.588757613701121
Energy: 0.5824155667105221
Energy: 0.5887576137015026
Energy: 0.5741403486817483
Energy: 0.5887576137022655
Energy: 0.5741403486809853
Energy: 0.5779933028605385
Energy: 0.5858053107050271
Energy: 0.5779933028609201
Energy: 0.585805310704264
Energy: 0.5779933028605385
Energy: 0.585805310704264
Energy: 0.55843936618781
Energy: 0.5678273068321822
Energy: 0.5584393661881915
Energy: 0.567827306831419
Energy: 0.55843936618781
Energy: 0.567827306831419
Energy: 0.5546700603038688
Energy: 0.6373573779587992
Energy: 0.5546693019889225
Energy: 0.6373573779591808
Energy: 0.5546700603038688
Energy: 0.6373573779591808
Energy: 0.6005510936928283
Energy: 0.5826134869883183
Energy: 0.6005510936928283
Energy: 0.5778959966294012
Energy: 0.6005510936935914
Energy: 0.5778959966290196
Energy: 0.5938760204666798
Energy: 0.58485482577739
Energy: 0.5938711102335069
Energy: 0.58485482577739
Energy: 0.5938760204666798
Energy: 0.5848548257777715
Energy: 0.5313749160850522
Energy: 0.5534232471013899
Energy: 0.5313749160854337
Energy: 0.5534232471006268
Energy: 0.5313749160850522
Energy: 0.5534232471006268
Energy: 0.6106104204375704
Energy: 0.5520252184839872
Energy: 0.6106104204375704
Energy: 0.5520252184836058
Energy: 0.6106104204371889
Energy: 0.5520252184832242
Energy: 0.5580885731219561
Energy: 0.5897920428836106
Energy: 0.5580885731227191
Energy: 0.5897920428828476
Energy: 0.5580885731227191
Energy: 0.589792042883229
Energy: 0.5729426093197251
Energy: 0.563286352475863
Energy: 0.5729426093193436
Energy: 0.563286352475863
Energy: 0.5729426093193436
Energy: 0.563286352475863
Energy: 0.5639043515883098
Energy: 0.5616540758741798
Energy: 0.5639043515879283
Energy: 0.5616540758745613
Energy: 0.5639043515879283
Energy: 0.5616540758741798
Energy: 0.5854855937179305
Energy: 0.572474389119198
Energy: 0.5854855937179305
Energy: 0.5724743891195795
Energy: 0.5854855937179305
Energy: 0.572474389119961
Energy: 0.628875042057694
Energy: 0.5891031008646446
Energy: 0.6288750420584571
Energy: 0.5891031008654076
Energy: 0.6288750420584571
Energy: 0.5891031008654076
Energy: 0.575745564497886
Energy: 0.5524766149968793
Energy: 0.5757455644982675
Energy: 0.5524766149968793
Energy: 0.5757455644982675
Energy: 0.5524766149968793
Energy: 0.6063572471985342
Energy: 0.6062301801547066
Energy: 0.6063572471981525
Energy: 0.6062301801547066
Energy: 0.6063572471981525
Energy: 0.6062301801547066
Energy: 0.5923092444825653
Energy: 0.5872705280572728
Energy: 0.5923021436264275
Energy: 0.5872705280584173
Energy: 0.5923092444829468
Energy: 0.5872705280584173
Energy: 0.5876248520973708
Energy: 0.5669779707120107
Energy: 0.5876248520966078
Energy: 0.5669779707120107
Energy: 0.5876248520969892
Energy: 0.5669779707120107
Energy: 0.5675233846470722
Energy: 0.5854964313240827
Energy: 0.5710444726923048
Energy: 0.5854964313237011
Energy: 0.5675233846466906
Energy: 0.5854964313240827
Energy: 0.5854801768214376
Energy: 0.5580941803746817
Energy: 0.5730087564716153
Energy: 0.5580941803750632
Energy: 0.5854801768206744
Energy: 0.5580941803750632
Energy: 0.5539509018816637
Energy: 0.5664738656714664
Energy: 0.5334407784535876
Energy: 0.5664738656710848
Energy: 0.5539509018812823
Energy: 0.5664738656710848
Energy: 0.5627401970266097
Energy: 0.5713878042308164
Energy: 0.5627401970262281
Energy: 0.5713878042311978
Energy: 0.5627401970262281
Energy: 0.5713878042311978
Energy: 0.5972769848809543
Energy: 0.5539235711411208
Energy: 0.5972769848809543
Energy: 0.5539235711392131
Energy: 0.5972769848805727
Energy: 0.5539235711395947
Energy: 0.5800329946314523
Energy: 0.5951103093160233
Energy: 0.5800329946314523
Energy: 0.5951103093167864
Energy: 0.5800329946318338
Energy: 0.5951103093167864
Energy: 0.56847719668242
Energy: 0.6086437896848325
Energy: 0.5684771966820386
Energy: 0.6086437896848325
Energy: 0.56847719668242
Energy: 0.6086437896848325
Energy: 0.540045626929923
Energy: 0.5367096790481698
Energy: 0.5400456269295414
Energy: 0.5367096790477882
Energy: 0.5400456269295414
Energy: 0.5367096790474066
Energy: 0.6229494705030806
Energy: 0.5785219477773599
Energy: 0.622949470503462
Energy: 0.5785219477765968
Energy: 0.6229494705026991
Energy: 0.5785219477765968
Energy: 0.578740255414567
Energy: 0.6029909142862347
Energy: 0.578739571918461
Energy: 0.6029909142869978
Energy: 0.57874025541533
Energy: 0.6029909142869978
Energy: 0.5899781505272182
Energy: 0.5692570125805242
Energy: 0.589979348305554
Energy: 0.5692570125793796
Energy: 0.5899781505272182
Energy: 0.5692570125793796
Energy: 0.5887663441025173
Energy: 0.5572723269626033
Energy: 0.5887663441028989
Energy: 0.5572723269626033
Energy: 0.5887663441021358
Energy: 0.5572723269626033
Energy: 0.5818956218142196
Energy: 0.5642809175624666
Energy: 0.5818956218146012
Energy: 0.564280917562848
Energy: 0.5818956218146012
Energy: 0.5642809175632296
Energy: 0.5902777497670681
Energy: 0.5483198727443946
Energy: 0.5902777497663051
Energy: 0.5483198727443946
Energy: 0.5902777497663051
Energy: 0.5483198727443946
Energy: 0.5519173114784319
Energy: 0.5694389998221827
Energy: 0.5519173114788134
Energy: 0.5694389998221827
Energy: 0.5519173114784319
Energy: 0.5694389998225642

minimum gb energy = 0.5313749160850522 eV
minimum distance =  2.57254764487461 Angstroms
sigma value = 41


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

Energy: 0.618523290594504
Energy: 0.5863551016212546
Energy: 0.618523290594504
Energy: 0.5863551016212546
Energy: 0.618523290594504
Energy: 0.5863551016212546
Energy: 0.5752342930364273
Energy: 0.5997295374175063
Energy: 0.5752342930353855
Energy: 0.5997295374175063
Energy: 0.5752342930353855
Energy: 0.5997295374175063
Energy: 0.6633078810702947
Energy: 0.5941234773515647
Energy: 0.6259371263988466
Energy: 0.5941234773515647
Energy: 0.6259371263988466
Energy: 0.5941234773515647
Energy: 0.6475206245205843
Energy: 0.6652337588875826
Energy: 0.6475206245205843
Energy: 0.6652337588875826
Energy: 0.6475206245205843
Energy: 0.6652337588875826
Energy: 0.5760572168435234
Energy: 0.6534809361095495
Energy: 0.5760572168435234
Energy: 0.6534809361095495
Energy: 0.5760572168435234
Energy: 0.6534809361095495
Energy: 0.640243574004406
Energy: 0.644102360810951
Energy: 0.640243574004406
Energy: 0.644102360810951
Energy: 0.640243574004406
Energy: 0.644102360810951
Energy: 0.6869977589951747
Energy: 0.6149472237180016
Energy: 0.6869977589951747
Energy: 0.6149472237180016
Energy: 0.6869977589951747
Energy: 0.6149472237180016
Energy: 0.5982862238710352
Energy: 0.6045552925441686
Energy: 0.5982862238710352
Energy: 0.6045552925441686
Energy: 0.5982862238710352
Energy: 0.6045552925452103
Energy: 0.5925178384421038
Energy: 0.5851876979900711
Energy: 0.5925178384421038
Energy: 0.5851876979890295
Energy: 0.5925178384421038
Energy: 0.5851876979900711
Energy: 0.606515192051047
Energy: 0.578663253562904
Energy: 0.606515192051047
Energy: 0.578663253562904
Energy: 0.606515192051047
Energy: 0.578663253562904
Energy: 0.6472283546366843
Energy: 0.6066815226392633
Energy: 0.6472283546366843
Energy: 0.6066815226392633
Energy: 0.6472283546366843
Energy: 0.6066815226392633
Energy: 0.6104182541395323
Energy: 0.5766064293061786
Energy: 0.6104182541395323
Energy: 0.5766064293061786
Energy: 0.6104182541395323
Energy: 0.5766064293061786
Energy: 0.6318196513624679
Energy: 0.5876817375826708
Energy: 0.6318196513614261
Energy: 0.5876817375826708
Energy: 0.6318196513635096
Energy: 0.5876817375826708
Energy: 0.6436643710914636
Energy: 0.6452369277873115
Energy: 0.6436643710914636
Energy: 0.6452369277873115
Energy: 0.6436643710914636
Energy: 0.6452369277873115

minimum gb energy = 0.5752342930353855 eV
minimum distance =  2.53424645847673 Angstroms
sigma value = 11


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

Energy: 0.6120429534916777
Energy: 0.6600239511178047
Energy: 0.6120429534916777
Energy: 0.6600239511178047
Energy: 0.6120429534916777
Energy: 0.6600239511178047
Energy: 0.5763410574773494
Energy: 0.6157540026518822
Energy: 0.5763410574773494
Energy: 0.6157540026518822
Energy: 0.5763410574773494
Energy: 0.6157540026518822
Energy: 0.6230404561182579
Energy: 0.5869155376346161
Energy: 0.6230404561182579
Energy: 0.5869155376346161
Energy: 0.6230404561182579
Energy: 0.5869155376341585
Energy: 0.61827450670919
Energy: 0.6039136706843282
Energy: 0.61827450670919
Energy: 0.6039136706843282
Energy: 0.61827450670919
Energy: 0.6039136706843282
Energy: 0.6248787775935097
Energy: 0.5991739512284902
Energy: 0.6248787775935097
Energy: 0.5991739512284902
Energy: 0.6248787775935097
Energy: 0.5991739512284902
Energy: 0.6159092550501942
Energy: 0.6335901254278179
Energy: 0.6159092550501942
Energy: 0.6335901254278179
Energy: 0.6159092550497366
Energy: 0.6335901254278179
Energy: 0.6009058469643295
Energy: 0.5871328687845273
Energy: 0.6009058469638718
Energy: 0.5871328687845273
Energy: 0.6009058469638718
Energy: 0.5871328687845273
Energy: 0.6016748971964502
Energy: 0.5905698174967996
Energy: 0.6016748971969078
Energy: 0.5905698174967996
Energy: 0.6016748971959925
Energy: 0.5905698174967996
Energy: 0.5978578419038036
Energy: 0.593754353844035
Energy: 0.5978578419038036
Energy: 0.593754353844035
Energy: 0.5978578419038036
Energy: 0.593754353844035
Energy: 0.5931598523547649
Energy: 0.6168115904233752
Energy: 0.5931598523547649
Energy: 0.6168115904233752
Energy: 0.5931598523547649
Energy: 0.6168115904233752
Energy: 0.6325115739980285
Energy: 0.6315272065523243
Energy: 0.632511573997571
Energy: 0.6315272065523243
Energy: 0.6325115739966556
Energy: 0.6315272065523243
Energy: 0.6013534996540811
Energy: 0.6479841078100186
Energy: 0.6013534996540811
Energy: 0.6479841078100186
Energy: 0.6013534996540811
Energy: 0.6479841078100186
Energy: 0.5998856475539519
Energy: 0.653576748802422
Energy: 0.5998856475534942
Energy: 0.653576748802422
Energy: 0.5998856475539519
Energy: 0.653576748802422
Energy: 0.604587029376072
Energy: 0.6039640175156389
Energy: 0.6045870293756145
Energy: 0.6039640175151813
Energy: 0.6045870293756145
Energy: 0.6039640175151813
Energy: 0.5918423001605099
Energy: 0.5913854223525166
Energy: 0.5918423001605099
Energy: 0.5913854223525166
Energy: 0.5918423001605099
Energy: 0.5913854223525166
Energy: 0.5894692222577574
Energy: 0.5997793028279907
Energy: 0.5894692222582151
Energy: 0.5997793028279907
Energy: 0.5894692222577574
Energy: 0.5997793028279907
Energy: 0.6339575829107429
Energy: 0.6076758857856758
Energy: 0.6339575829107429
Energy: 0.6076758857852181
Energy: 0.6339575829107429
Energy: 0.6076758857852181
Energy: 0.6033206688178395
Energy: 0.6290153180076854
Energy: 0.6033206688173818
Energy: 0.6290153180076854
Energy: 0.6033206688173818
Energy: 0.6290153180081429
Energy: 0.5891920145764061
Energy: 0.6215873840201984
Energy: 0.5891920145764061
Energy: 0.6215873840201984
Energy: 0.5891920145759484
Energy: 0.6215873840201984
Energy: 0.599245576560842
Energy: 0.5900899209664043
Energy: 0.599245576560842
Energy: 0.5900899209664043
Energy: 0.599245576560842
Energy: 0.5900899209664043
Energy: 0.5923009674095536
Energy: 0.590281087395384
Energy: 0.5923009674095536
Energy: 0.5902810873958416
Energy: 0.592300967409096
Energy: 0.590281087395384
Energy: 0.632184530776534
Energy: 0.6073966112767425
Energy: 0.632184530776534
Energy: 0.6073966112767425
Energy: 0.632184530776534
Energy: 0.6073966112767425
Energy: 0.6179420597151937
Energy: 0.5949408514041647
Energy: 0.6179420597151937
Energy: 0.5949408514041647
Energy: 0.6179420597151937
Energy: 0.5949408514041647
Energy: 0.6403162816296184
Energy: 0.5910387722278584
Energy: 0.6403162816296184
Energy: 0.5910387722278584
Energy: 0.6403162816296184
Energy: 0.5910387722278584
Energy: 0.6060446734394319
Energy: 0.6375172856097233
Energy: 0.6060446734394319
Energy: 0.6375172856097233
Energy: 0.6060446734398894
Energy: 0.6375172856097233
Energy: 0.5957308825910014
Energy: 0.6219058197359628
Energy: 0.5957308825910014
Energy: 0.6219058197359628
Energy: 0.5957308825910014
Energy: 0.6219058197359628
Energy: 0.5852747722047975
Energy: 0.6153255382705536
Energy: 0.5852747722047975
Energy: 0.6153255382705536
Energy: 0.5852747722052551
Energy: 0.6153255382710113
Energy: 0.600114157625101
Energy: 0.5946467173886115
Energy: 0.600114157625101
Energy: 0.5946467173886115
Energy: 0.600114157625101
Energy: 0.5946467173886115
Energy: 0.5850555980889551
Energy: 0.6162467612107616
Energy: 0.5850555980889551
Energy: 0.6162467612107616
Energy: 0.5850555980889551
Energy: 0.6162467612112192
Energy: 0.6006303315637799
Energy: 0.5956432039373898
Energy: 0.6006303315637799
Energy: 0.595643203936932
Energy: 0.6006303315637799
Energy: 0.5956432039373898
Energy: 0.5992238988960824
Energy: 0.6178764840642416
Energy: 0.5992238988965399
Energy: 0.6178764840642416
Energy: 0.5992238988960824
Energy: 0.6178764840642416

minimum gb energy = 0.5763410574773494 eV
minimum distance =  2.52860168882995 Angstroms
sigma value = 57


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

Energy: 0.4959456262796218
Energy: 0.5210467189979442
Energy: 0.4959456262804362
Energy: 0.5210467189987585
Energy: 0.4959456262804362
Energy: 0.5210467189987585
Energy: 0.5776768901154076
Energy: 0.506924456069729
Energy: 0.5776768901162217
Energy: 0.5069244560705433
Energy: 0.5776768901154076
Energy: 0.5069244560656572
Energy: 0.5384875200789383
Energy: 0.5057915821436052
Energy: 0.5384875200789383
Energy: 0.5057915821436052
Energy: 0.5384875200797526
Energy: 0.5057915821436052
Energy: 0.5175699595341479
Energy: 0.595455809990802
Energy: 0.51756996321747
Energy: 0.6253618258623689
Energy: 0.5175699575952271
Energy: 0.6253618258623689
Energy: 0.538501088843291
Energy: 0.505822256701302
Energy: 0.5385010888441053
Energy: 0.505822256701302
Energy: 0.538501088843291
Energy: 0.505822256701302
Energy: 0.5777832041309253
Energy: 0.5081933156035952
Energy: 0.5777832041309253
Energy: 0.5081933156035952
Energy: 0.5777832041309253
Energy: 0.5081933156035952
Energy: 0.4959456262804362
Energy: 0.5210467189979442
Energy: 0.4959456262804362
Energy: 0.5210467189979442
Energy: 0.4959456262804362
Energy: 0.5210467189979442
Energy: 0.5776768901154076
Energy: 0.5069244560656572
Energy: 0.5776768901154076
Energy: 0.5069244560656572
Energy: 0.5776768901154076
Energy: 0.506924456069729
Energy: 0.5384875200789383
Energy: 0.5057915821436052
Energy: 0.5384875200789383
Energy: 0.5057915821436052
Energy: 0.5384875200797526
Energy: 0.5057915821436052
Energy: 0.5175699651083624
Energy: 0.5771498392685926
Energy: 0.5175699679760537
Energy: 0.5059690504082042
Energy: 0.5175699571605472
Energy: 0.5059690504073899
Energy: 0.5385010888441053
Energy: 0.505822256701302
Energy: 0.538501088843291
Energy: 0.5058222567021163
Energy: 0.5385010888441053
Energy: 0.505822256701302
Energy: 0.5777832041309253
Energy: 0.5081933156027808
Energy: 0.5777832041317397
Energy: 0.5081933156027808
Energy: 0.5777832041309253
Energy: 0.5081933156035952
Energy: 0.4959456262804362
Energy: 0.5210467189979442
Energy: 0.4959456262804362
Energy: 0.5210467189987585
Energy: 0.4959456262804362
Energy: 0.5210467189979442
Energy: 0.5776768901154076
Energy: 0.5069244560689147
Energy: 0.5776768901154076
Energy: 0.506924456069729
Energy: 0.5776768901154076
Energy: 0.5069244560705433
Energy: 0.5384875200789383
Energy: 0.5057915821436052
Energy: 0.5384875200789383
Energy: 0.5057915821436052
Energy: 0.5384875200789383
Energy: 0.5057915821436052
Energy: 0.5175699622618444
Energy: 0.5771498392677783
Energy: 0.5175699572631187
Energy: 0.5059690504073899
Energy: 0.5175699646411269
Energy: 0.5059690504073899
Energy: 0.5385010888441053
Energy: 0.505822256701302
Energy: 0.5385010888441053
Energy: 0.505822256701302
Energy: 0.538501088843291
Energy: 0.505822256701302

minimum gb energy = 0.4959456262796218 eV
minimum distance =  2.57223192320378 Angstroms
sigma value = 9


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

Energy: 0.6048664731459625
Energy: 0.6051245730502235
Energy: 0.6048664731459625
Energy: 0.6051245730495586
Energy: 0.6048664731459625
Energy: 0.6051245730502235
Energy: 0.6260648404728791
Energy: 0.640197310285355
Energy: 0.626064840473544
Energy: 0.640197310285355
Energy: 0.6260648404728791
Energy: 0.640197310285355
Energy: 0.6223220829957973
Energy: 0.5646500606673998
Energy: 0.6499359678731933
Energy: 0.5646500606673998
Energy: 0.6499359678738582
Energy: 0.5646500606673998
Energy: 0.5675665960103973
Energy: 0.6378732916791462
Energy: 0.5675665960103973
Energy: 0.6378732916791462
Energy: 0.5675665960103973
Energy: 0.6378732916791462
Energy: 0.5774120192739498
Energy: 0.5999291374633486
Energy: 0.5774120192739498
Energy: 0.5999291374633486
Energy: 0.5774120192739498
Energy: 0.5999291374633486
Energy: 0.57097911287416
Energy: 0.5845798476461392
Energy: 0.5709791128734951
Energy: 0.5845798476461392
Energy: 0.57097911287416
Energy: 0.5845798476461392
Energy: 0.6257687481653018
Energy: 0.6112935507502995
Energy: 0.6257687481653018
Energy: 0.6112935507502995
Energy: 0.6257687481659667
Energy: 0.6112935507502995
Energy: 0.5638030897027272
Energy: 0.5998952428152486
Energy: 0.5638030897027272
Energy: 0.5998952428152486
Energy: 0.5638030897027272
Energy: 0.5998952428152486
Energy: 0.6175736824581356
Energy: 0.5973727638942655
Energy: 0.6175736824588005
Energy: 0.5973727638942655
Energy: 0.6175736824581356
Energy: 0.5973727638942655
Energy: 0.5863464762707381
Energy: 0.5898081738113039
Energy: 0.5863464762700732
Energy: 0.5898081738119689
Energy: 0.5863464762707381
Energy: 0.5898081738113039
Energy: 0.6189628016246767
Energy: 0.5661774047612543
Energy: 0.6189628016240117
Energy: 0.5661774047619192
Energy: 0.6189628016246767
Energy: 0.5661774047619192
Energy: 0.6197956644908867
Energy: 0.6290304591118573
Energy: 0.6197956644908867
Energy: 0.6290304591118573
Energy: 0.6197956644908867
Energy: 0.6290304591118573
Energy: 0.5618604119579167
Energy: 0.6167180237694945
Energy: 0.5618604119579167
Energy: 0.6167180237694945
Energy: 0.5618604119579167
Energy: 0.6167180237694945
Energy: 0.5795677208760724
Energy: 0.6326562428616328
Energy: 0.5795677208760724
Energy: 0.6326562428616328
Energy: 0.5795677208760724
Energy: 0.6326562428616328
Energy: 0.6084650161138705
Energy: 0.654999337485767
Energy: 0.6084650161138705
Energy: 0.654999337485102
Energy: 0.6084650161138705
Energy: 0.654999337485102
Energy: 0.6159775033783308
Energy: 0.6006279994429846
Energy: 0.6159775033783308
Energy: 0.6006279994429846
Energy: 0.6159775033776659
Energy: 0.6006279994429846
Energy: 0.5976137893436774
Energy: 0.5924732509509202
Energy: 0.5976137893436774
Energy: 0.5924732509509202
Energy: 0.5976137893430126
Energy: 0.5924732509509202
Energy: 0.6344268325780502
Energy: 0.6142167178672971
Energy: 0.6344268325780502
Energy: 0.6142167178679621
Energy: 0.6344268325780502
Energy: 0.6142167178672971
Energy: 0.5656141125512643
Energy: 0.5786354698354925
Energy: 0.5656141125512643
Energy: 0.5786354698361574
Energy: 0.5656141125512643
Energy: 0.5786354698354925
Energy: 0.58454852942472
Energy: 0.5906403341775167
Energy: 0.5845485294253848
Energy: 0.5906403341781816
Energy: 0.5845485294260498
Energy: 0.5906403341781816
Energy: 0.6186502383041415
Energy: 0.5830804355226405
Energy: 0.6186502383048064
Energy: 0.5830804355226405
Energy: 0.6186502383048064
Energy: 0.5830804355226405

minimum gb energy = 0.5618604119579167 eV
minimum distance =  2.52087295675146 Angstroms
sigma value = 27


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

Energy: 0.6226315686650262
Energy: 0.5589316896883734
Energy: 0.6226315686650262
Energy: 0.5589316896883734
Energy: 0.6226315686650262
Energy: 0.5589316896883734
Energy: 0.5546616656075816
Energy: 0.5796619014678993
Energy: 0.5546616656075816
Energy: 0.5796619014684599
Energy: 0.5546616656075816
Energy: 0.5796619014684599
Energy: 0.5859803774015219
Energy: 0.5876446600467423
Energy: 0.5859803774009614
Energy: 0.5876446600467423
Energy: 0.5859803774009614
Energy: 0.5876446600467423
Energy: 0.5783831504592025
Energy: 0.5620428664095196
Energy: 0.5783831504592025
Energy: 0.5620428664095196
Energy: 0.5783831504592025
Energy: 0.5620428664089591
Energy: 0.5709977769225386
Energy: 0.5659475614514875
Energy: 0.5709977769225386
Energy: 0.5659475614514875
Energy: 0.5709977769225386
Energy: 0.5659475614514875
Energy: 0.5815563276029095
Energy: 0.5788260649653258
Energy: 0.5815563276034446
Energy: 0.5788260649653258
Energy: 0.5815563276034446
Energy: 0.5788260649658863
Energy: 0.6240227372603797
Energy: 0.5466911770999688
Energy: 0.6240227372603797
Energy: 0.5466911770999688
Energy: 0.6240227372603797
Energy: 0.5466911770999688
Energy: 0.608847734908008
Energy: 0.6102550350306444
Energy: 0.6088477349074476
Energy: 0.6102550350300839
Energy: 0.6088477349074476
Energy: 0.6102550350306444
Energy: 0.5601397965516335
Energy: 0.5787870808609815
Energy: 0.5601397965516335
Energy: 0.5787870808615421
Energy: 0.5601397965516335
Energy: 0.5787870808615421
Energy: 0.5782062722809762
Energy: 0.5587250753459028
Energy: 0.5782062722804158
Energy: 0.5587250753459028
Energy: 0.5782062722804158
Energy: 0.5587250753459028
Energy: 0.5715534414752473
Energy: 0.5588123853699795
Energy: 0.5715534414752473
Energy: 0.5588123853699795
Energy: 0.571553441474687
Energy: 0.5588123853699795
Energy: 0.5602101199608874
Energy: 0.5787980140159431
Energy: 0.5602101199608874
Energy: 0.5787980140159431
Energy: 0.5602101199608874
Energy: 0.5787980140165037
Energy: 0.6086241355682505
Energy: 0.7389902903108663
Energy: 0.6086241355682505
Energy: 0.7389902903103058
Energy: 0.60862413556769
Energy: 0.7389902903103058
Energy: 0.6239849291566906
Energy: 0.5468133369579318
Energy: 0.6239849291566906
Energy: 0.5468133369573712
Energy: 0.6239849291566906
Energy: 0.5468133369579318
Energy: 0.5816241913569079
Energy: 0.5788152232877288
Energy: 0.5816241913569079
Energy: 0.5788152232877288
Energy: 0.5816241913569079
Energy: 0.5788152232877288
Energy: 0.5708014729248059
Energy: 0.5659386467140751
Energy: 0.5708014729248059
Energy: 0.5659386467140751
Energy: 0.5708014729248059
Energy: 0.5659386467140751
Energy: 0.5781704457783189
Energy: 0.5866464208784355
Energy: 0.5781704457783189
Energy: 0.586646420877875
Energy: 0.5781704457783189
Energy: 0.5866464208773147
Energy: 0.5783654641909146
Energy: 0.5876347666158624
Energy: 0.5783654641897937
Energy: 0.5876347666158624
Energy: 0.5783654641897937
Energy: 0.5876347666158624
Energy: 0.5546260942393978
Energy: 0.5797379865888143
Energy: 0.5546260942393978
Energy: 0.5797379865888143
Energy: 0.5546260942393978
Energy: 0.5797379865893746
Energy: 0.6226315686650262
Energy: 0.5589316896883734
Energy: 0.6226315686650262
Energy: 0.5589316896883734
Energy: 0.6226315686650262
Energy: 0.5589316896883734
Energy: 0.5546616656075816
Energy: 0.5796619014684599
Energy: 0.5546616656075816
Energy: 0.5796619014684599
Energy: 0.5546616656075816
Energy: 0.5796619014684599
Energy: 0.5859803774020824
Energy: 0.5876446600467423
Energy: 0.5859803774015219
Energy: 0.5876446600467423
Energy: 0.5859803774015219
Energy: 0.5876446600467423
Energy: 0.5783831504586422
Energy: 0.5620428664095196
Energy: 0.5783831504586422
Energy: 0.5620428664095196
Energy: 0.5783831504586422
Energy: 0.5620428664083986
Energy: 0.5709977769225386
Energy: 0.5659475614514875
Energy: 0.5709977769225386
Energy: 0.5659475614514875
Energy: 0.5709977769225386
Energy: 0.5659475614514875
Energy: 0.5815563276034446
Energy: 0.5788260649653258
Energy: 0.5815563276029095
Energy: 0.5788260649653258
Energy: 0.5815563276034446
Energy: 0.5788260649653258

minimum gb energy = 0.5466911770999688 eV
minimum distance =  2.54364587863057 Angstroms
sigma value = 19


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

Energy: 0.5970663629985149
Energy: 0.639777053073783
Energy: 0.5970663629985149
Energy: 0.6397770530732994
Energy: 0.5970663629985149
Energy: 0.6397770530732994
Energy: 0.6737074559011054
Energy: 0.6009970900491434
Energy: 0.6737074559011054
Energy: 0.6009970900491434
Energy: 0.6737074559011054
Energy: 0.6009970900491434
Energy: 0.6831581589477771
Energy: 0.5963980474835868
Energy: 0.6551627362114871
Energy: 0.5963980474835868
Energy: 0.6551627362114871
Energy: 0.5963980474835868
Energy: 0.5787535068413693
Energy: 0.6391932521828381
Energy: 0.5787535068413693
Energy: 0.6391932521833218
Energy: 0.5787535068413693
Energy: 0.6391932521833218
Energy: 0.5927356194002874
Energy: 0.6630015516504899
Energy: 0.5927356194002874
Energy: 0.6630015516509737
Energy: 0.5927356194002874
Energy: 0.6630015516504899
Energy: 0.6172227948395118
Energy: 0.5807897153002266
Energy: 0.6172227948390281
Energy: 0.5807897153007104
Energy: 0.6172227948390281
Energy: 0.5807897153007104
Energy: 0.5959702841570832
Energy: 0.6529113751056923
Energy: 0.5959702841570832
Energy: 0.6529113751061761
Energy: 0.5959702841570832
Energy: 0.6529113751056923
Energy: 0.5889005450561277
Energy: 0.6755702645064318
Energy: 0.5889005450561277
Energy: 0.6755702645064318
Energy: 0.5889005450561277
Energy: 0.6755702645064318
Energy: 0.6341697953551222
Energy: 0.5648799722359517
Energy: 0.6341697953551222
Energy: 0.5648799722359517
Energy: 0.6341697953551222
Energy: 0.5648799722359517
Energy: 0.6224203675299153
Energy: 0.5984867916335543
Energy: 0.6224203675299153
Energy: 0.5984867916340381
Energy: 0.6224203675299153
Energy: 0.5984867916335543
Energy: 0.5662609313562381
Energy: 0.652690381806488
Energy: 0.5662609313562381
Energy: 0.652690381806488
Energy: 0.566260931356722
Energy: 0.652690381806488
Energy: 0.6679637834739257
Energy: 0.5935007411625466
Energy: 0.6679637834739257
Energy: 0.5935007411620628
Energy: 0.6679637834739257
Energy: 0.5935007411620628
Energy: 0.6262000488812053
Energy: 0.6102017033312301
Energy: 0.6262000488807216
Energy: 0.6102017033312301
Energy: 0.6262000488812053
Energy: 0.610201703331714
Energy: 0.5770169226687732
Energy: 0.61579667684328
Energy: 0.5770169226692571
Energy: 0.61579667684328
Energy: 0.5770169226692571
Energy: 0.61579667684328
Energy: 0.6204989097927224
Energy: 0.5982328133834507
Energy: 0.6204989097927224
Energy: 0.5982328133834507
Energy: 0.6204989097927224
Energy: 0.5982328133834507
Energy: 0.6664767956083647
Energy: 0.590642475909229
Energy: 0.6664767956083647
Energy: 0.590642475909229
Energy: 0.6664767956083647
Energy: 0.590642475909229
Energy: 0.572182986787394
Energy: 0.6416106594300801
Energy: 0.572182986787394
Energy: 0.6416106594305638
Energy: 0.572182986787394
Energy: 0.6416106594305638
Energy: 0.6367327712473598
Energy: 0.6589240156161366
Energy: 0.6367327712473598
Energy: 0.6589240156161366
Energy: 0.6367327712473598
Energy: 0.6589240156161366
Energy: 0.6354607809637942
Energy: 0.5772016097478879
Energy: 0.6354607809637942
Energy: 0.5772016097478879
Energy: 0.6354607809637942
Energy: 0.5772016097478879
Energy: 0.6030598242102948
Energy: 0.6051215027329617
Energy: 0.6030598242102948
Energy: 0.6051215027329617
Energy: 0.6030598242102948
Energy: 0.6051215027329617
Energy: 0.5613705340948053
Energy: 0.6843651501229688
Energy: 0.5613705340948053
Energy: 0.6843651501229688
Energy: 0.5613705340948053
Energy: 0.6843651501229688
Energy: 0.6742298654417087
Energy: 0.5921799594897514
Energy: 0.6742298654417087
Energy: 0.5921799594902352
Energy: 0.6742298654417087
Energy: 0.5921799594902352
Energy: 0.65139682757712
Energy: 0.5825655586267167
Energy: 0.65139682757712
Energy: 0.5825655586267167
Energy: 0.65139682757712
Energy: 0.5825655586267167
Energy: 0.5960483083671244
Energy: 0.633171475493401
Energy: 0.5960483083671244
Energy: 0.633171475493401
Energy: 0.5960483083676082
Energy: 0.633171475493401
Energy: 0.5984959666887478
Energy: 0.588638089014807
Energy: 0.5984959666887478
Energy: 0.588638089014807
Energy: 0.598495966688264
Energy: 0.588638089014807
Energy: 0.6529064749315038
Energy: 0.6086556849554363
Energy: 0.6529064749315038
Energy: 0.6086556849554363
Energy: 0.6529064749315038
Energy: 0.6086556849554363
Energy: 0.5616223482737
Energy: 0.6111848084196055
Energy: 0.5616223482737
Energy: 0.6111848084196055
Energy: 0.5616223482737
Energy: 0.6111848084200893
Energy: 0.6099927581768106
Energy: 0.6255089945267157
Energy: 0.6099927581763269
Energy: 0.6255089945267157
Energy: 0.6099927581768106
Energy: 0.6255089945267157
Energy: 0.602416629890138
Energy: 0.5760391980212456
Energy: 0.602416629890138
Energy: 0.5760391980212456
Energy: 0.602416629890138
Energy: 0.5760391980212456

minimum gb energy = 0.5613705340948053 eV
minimum distance =  2.53499722254231 Angstroms
sigma value = 101


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

Energy: 0.5640268232049233
Energy: 0.6537130047897848
Energy: 0.5640268232049233
Energy: 0.6537130047897848
Energy: 0.5640268232049233
Energy: 0.6537130047897848
Energy: 0.6723632470080875
Energy: 0.5824717690961848
Energy: 0.6723632470080875
Energy: 0.5824717690961848
Energy: 0.6723632470080875
Energy: 0.5824717690961848
Energy: 0.6719106852417227
Energy: 0.5899150027195956
Energy: 0.6719106852417227
Energy: 0.5899150027195956
Energy: 0.6719106852417227
Energy: 0.5899150027191703
Energy: 0.5346543018719188
Energy: 0.6486962948674797
Energy: 0.5346543018719188
Energy: 0.6486962948674797
Energy: 0.5346543018719188
Energy: 0.6486962948674797
Energy: 0.5809934574140907
Energy: 0.6382818546264596
Energy: 0.5809934574140907
Energy: 0.6382818546264596
Energy: 0.5809934574140907
Energy: 0.6382818546264596
Energy: 0.6442706581964777
Energy: 0.5518583534718385
Energy: 0.6442706581964777
Energy: 0.5518583534718385
Energy: 0.6442706581964777
Energy: 0.5518583534718385
Energy: 0.5820584655339401
Energy: 0.676840806911808
Energy: 0.5820584655339401
Energy: 0.676840806911808
Energy: 0.5820584655339401
Energy: 0.676840806911808
Energy: 0.5388422136257573
Energy: 0.6896931607900914
Energy: 0.5388422136257573
Energy: 0.7040764644988285
Energy: 0.5388422136257573
Energy: 0.7040764644988285
Energy: 0.6351176960949254
Energy: 0.5409036992437338
Energy: 0.6351176960953507
Energy: 0.5409036992441593
Energy: 0.6351176960949254
Energy: 0.5409036992433086
Energy: 0.5804258247511908
Energy: 0.6343686418233108
Energy: 0.5804258247511908
Energy: 0.6343686418233108
Energy: 0.5804258247516161
Energy: 0.6343686418228855
Energy: 0.5350416583107996
Energy: 0.6609191012772733
Energy: 0.5350416583107996
Energy: 0.6609191012772733
Energy: 0.5350416583107996
Energy: 0.660919101276848
Energy: 0.6528116116782537
Energy: 0.5989644665574055
Energy: 0.6528116116782537
Energy: 0.5989644665574055
Energy: 0.6528116116782537
Energy: 0.5989644665574055
Energy: 0.6361556612001519
Energy: 0.5927599500700577
Energy: 0.6361556612005772
Energy: 0.5927599500704831
Energy: 0.6361556612005772
Energy: 0.5927599500700577
Energy: 0.5660864573543053
Energy: 0.6608477628585498
Energy: 0.5660864573543053
Energy: 0.6608477628581245
Energy: 0.5660864573543053
Energy: 0.6608477628585498
Energy: 0.6800209560585994
Energy: 0.5585276621871516
Energy: 0.6800209560585994
Energy: 0.5585276621871516
Energy: 0.6800209560581741
Energy: 0.5585276621871516
Energy: 0.6723556380419614
Energy: 0.5448655835591383
Energy: 0.6723556380419614
Energy: 0.5448655835591383
Energy: 0.6723556380423866
Energy: 0.5448655835591383
Energy: 0.5382411250461402
Energy: 0.641380697266716
Energy: 0.5382411250461402
Energy: 0.641380697266716
Energy: 0.5382411250461402
Energy: 0.641380697266716
Energy: 0.5433439569734926
Energy: 0.6004803683127354
Energy: 0.5433439569739179
Energy: 0.6004803683123101
Energy: 0.5433439569739179
Energy: 0.6004803683118849
Energy: 0.6560557377042481
Energy: 0.5409858162232285
Energy: 0.6560557377042481
Energy: 0.5409858162249296
Energy: 0.6560557377042481
Energy: 0.5409858162257801
Energy: 0.5794452233127685
Energy: 0.6131036222329939
Energy: 0.5794452233127685
Energy: 0.6131036222329939
Energy: 0.5794452233127685
Energy: 0.6131036222329939
Energy: 0.5363545975457236
Energy: 0.6604116409156755
Energy: 0.5363545975457236
Energy: 0.6604116409156755
Energy: 0.5363545975457236
Energy: 0.6604116409156755
Energy: 0.721789720666923
Energy: 0.5431625742916094
Energy: 0.721789720666923
Energy: 0.5431625742911842
Energy: 0.721789720666923
Energy: 0.5431625742903337
Energy: 0.6430344134184456
Energy: 0.5407097761518947
Energy: 0.6430344134184456
Energy: 0.5407097761527453
Energy: 0.6430344134180204
Energy: 0.5407097761527453
Energy: 0.5316466668215893
Energy: 0.6483187125873708
Energy: 0.5316466668215893
Energy: 0.6483187125873708
Energy: 0.5316466668211639
Energy: 0.6483187125873708
Energy: 0.6790735343102422
Energy: 0.6364161423386907
Energy: 0.6790735343102422
Energy: 0.636416142339116
Energy: 0.6790735343102422
Energy: 0.636416142339116
Energy: 0.6526560976773644
Energy: 0.5444040677542794
Energy: 0.6526560976773644
Energy: 0.5444040677542794
Energy: 0.6526560976773644
Energy: 0.5444040677547046
Energy: 0.5642043318049468
Energy: 0.6485027004372139
Energy: 0.5642043318049468
Energy: 0.6485027004372139
Energy: 0.5642043318049468
Energy: 0.6485027004372139
Energy: 0.5734345694791425
Energy: 0.6064986640615885
Energy: 0.5734345694795678
Energy: 0.6064986640615885
Energy: 0.5734345694795678
Energy: 0.6064986640615885
Energy: 0.6445785392655757
Energy: 0.5401111469626366
Energy: 0.6445785392655757
Energy: 0.5401111469592343
Energy: 0.6445785392655757
Energy: 0.5401111469605102
Energy: 0.5397709374199162
Energy: 0.670291296187397
Energy: 0.5397709374199162
Energy: 0.670291296187397
Energy: 0.5397709374203414
Energy: 0.6702912961869718
Energy: 0.5384169910153079
Energy: 0.6107248725264726
Energy: 0.5384169910153079
Energy: 0.6107248725264726
Energy: 0.5384169910153079
Energy: 0.6107248725264726
Energy: 0.6500400917166298
Energy: 0.543198928470798
Energy: 0.6500400917166298
Energy: 0.543198928470798
Energy: 0.6500400917166298
Energy: 0.5431989284712232
Energy: 0.6939386364468658
Energy: 0.5408410021505814
Energy: 0.6939386364472911
Energy: 0.5408410021510066
Energy: 0.6939386364472911
Energy: 0.5408410021497307

minimum gb energy = 0.5316466668211639 eV
minimum distance =  2.55487900811403 Angstroms
sigma value = 33


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

Energy: 0.011721849639386928
Energy: 0.6389668173181484
Energy: 0.011721849639386928
Energy: 0.6389668173178147
Energy: 0.011721849639386928
Energy: 0.6389668173181484
Energy: 0.012540544785049634
Energy: 0.19350478249847544
Energy: 0.012540544785049634
Energy: 0.19350478249847544
Energy: 0.012540544785049634
Energy: 0.19350478249847544
Energy: 0.6395126318326876
Energy: 0.19383176665952223
Energy: 0.639516554868726
Energy: 0.19395827954123643
Energy: 0.639541398007324
Energy: 0.1938214803036122
Energy: 0.012540544785049634
Energy: 0.19350478249847544
Energy: 0.012540544785402988
Energy: 0.1935047824988288
Energy: 0.012540544785402988
Energy: 0.1935047824988288

minimum gb energy = 0.011721849639386928 eV
minimum distance =  2.85657743979048 Angstroms
sigma value = 1