Model name: model_name=Sim_LAMMPS_MEAM_AsadiZaeemNouranian_2015_Cu__SM_239791545509_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.620386689901352
cohesive_energy=3.5402784093701025
mass=63.546
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: 0.013646320323719936
Energy: 0.5419017626365589
Energy: 0.013646320323719936
Energy: 0.5419017626365589
Energy: 0.013646320324032611
Energy: 0.5419017626362461
Energy: 0.5419017626365589
Energy: 0.013791519643024372
Energy: 0.5419017626365589
Energy: 0.013791519642399021
Energy: 0.5419017626365589
Energy: 0.013791519642399021
Energy: 0.013646320324032611
Energy: 0.5419017626365589
Energy: 0.013646320323719936
Energy: 0.5419017626365589
Energy: 0.013646320324032611
Energy: 0.5419017626365589
Energy: 0.5419017626365589
Energy: 0.013791519642121088
Energy: 0.5419017626365589
Energy: 0.013791519642399021
Energy: 0.5419017626365589
Energy: 0.013791519642399021
Energy: 0.013646320323719936
Energy: 0.5419017626365589
Energy: 0.013646320323719936
Energy: 0.5419017626365589
Energy: 0.013646320323719936
Energy: 0.5419017626365589
Energy: 0.5419017626365589
Energy: 0.013791519643024372
Energy: 0.5419017626365589
Energy: 0.013791519642121088
Energy: 0.5419017626365589
Energy: 0.013791519642711697

minimum gb energy = 0.013646320323719936 eV
minimum distance =  2.55828909189085 Angstroms
sigma value = 1


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

Energy: 0.9062632844500464
Energy: 1.0103813966122808
Energy: 0.9062632844485412
Energy: 1.0103813966122808
Energy: 0.9062632844492938
Energy: 1.0103813966122808
Energy: 1.0425008711185935
Energy: 0.8492569386176408
Energy: 1.0425008711170882
Energy: 0.8492569386176408
Energy: 1.0425008711178407
Energy: 0.8492569386176408
Energy: 0.8666106047223003
Energy: 1.1190872549798525
Energy: 0.8666106047223003
Energy: 1.1190872549798525
Energy: 0.8666106047223003
Energy: 1.1190872549798525
Energy: 1.0629585413674303
Energy: 0.8904026604731891
Energy: 1.0629585413666778
Energy: 0.8904026604731891
Energy: 1.0629585413674303
Energy: 0.8904026604731891
Energy: 0.9126601466888288
Energy: 0.9884091970905428
Energy: 0.9126601466888288
Energy: 0.9884091970905428
Energy: 0.9126601466888288
Energy: 0.9884091970905428
Energy: 0.9304656569174615
Energy: 0.8484341100807538
Energy: 0.9304656569174615
Energy: 0.8484341100807538
Energy: 0.9304656569167091
Energy: 0.8484341100800011
Energy: 0.8835889783077541
Energy: 1.03708309776717
Energy: 0.8835889783077541
Energy: 1.0370830977664174
Energy: 0.8835889783085068
Energy: 1.0370830977664174
Energy: 0.9210795359893181
Energy: 1.052921598173982
Energy: 0.9210795359900708
Energy: 1.0529215981732292
Energy: 0.9210795359900708
Energy: 1.0529215981732292
Energy: 0.9658086655667346
Energy: 0.9217631095998808
Energy: 0.9658086655674872
Energy: 0.9217631096006336
Energy: 0.9658086655674872
Energy: 0.9217631095998808
Energy: 0.8477840654784707
Energy: 1.0485153573585893
Energy: 0.8477840654777181
Energy: 1.0485153573585893
Energy: 0.8477840654784707
Energy: 1.0485153573578363
Energy: 0.9591842075543802
Energy: 0.8374974036432155
Energy: 0.9591842075536273
Energy: 0.8374974036432155
Energy: 0.9591842075536273
Energy: 0.8374974036439681
Energy: 0.8065088091075513
Energy: 1.0288670576402463
Energy: 0.8065088091075513
Energy: 1.028867057640999
Energy: 0.8065088091075513
Energy: 1.028867057640999
Energy: 1.0622574471620014
Energy: 0.8314849085856286
Energy: 1.0622574471612487
Energy: 0.8314849085856286
Energy: 1.0622574471612487
Energy: 0.8314849085856286
Energy: 0.865059160208887
Energy: 1.0761418011398503
Energy: 0.8650591602081343
Energy: 1.0761418011398503
Energy: 0.865059160208887
Energy: 1.0761418011398503
Energy: 1.07471848773519
Energy: 0.8578369615795141
Energy: 1.07471848773519
Energy: 0.8578369615795141
Energy: 1.07471848773519
Energy: 0.8578369615787615
Energy: 1.0598441983195497
Energy: 0.9707419188812553
Energy: 1.059844198318797
Energy: 0.9707419188812553
Energy: 1.0598441983195497
Energy: 0.9707419188812553
Energy: 0.9512809802340064
Energy: 0.9470808827490815
Energy: 0.9512809802340064
Energy: 0.9470808827490815
Energy: 0.9512809802340064
Energy: 0.9470808827490815
Energy: 1.0231984065358126
Energy: 0.9123796444111144
Energy: 1.0231984065358126
Energy: 0.9123796444103618
Energy: 1.0231984065358126
Energy: 0.9123796444103618
Energy: 0.9137665082429114
Energy: 0.9844895888742793
Energy: 0.9137665082429114
Energy: 0.9844895888742793
Energy: 0.9137665082421588
Energy: 0.9844895888742793
Energy: 0.9495719870646916
Energy: 0.8490583331600344
Energy: 0.9495719870646916
Energy: 0.8490583331600344
Energy: 0.9495719870646916
Energy: 0.8490583331600344
Energy: 0.8626966319381087
Energy: 1.1235265349181744
Energy: 0.8626966319388615
Energy: 1.123526534917422
Energy: 0.8626966319388615
Energy: 1.123526534917422
Energy: 1.0311654474999346
Energy: 0.8895588994440561
Energy: 1.0311654474999346
Energy: 0.8895588994433034
Energy: 1.0311654474999346
Energy: 0.8895588994433034
Energy: 0.8074433957125405
Energy: 1.076737976457546
Energy: 0.8074433957125405
Energy: 1.076737976457546
Energy: 0.8074433957125405
Energy: 1.076737976457546

minimum gb energy = 0.8065088091075513 eV
minimum distance =  2.36711475188246 Angstroms
sigma value = 33


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

Energy: 0.9591487505769597
Energy: 1.0470143587928336
Energy: 0.9348678029390829
Energy: 1.0470143587928336
Energy: 0.9591487505769597
Energy: 1.0470143587924057
Energy: 1.0784274175567392
Energy: 0.8786201571568109
Energy: 1.0784274175567392
Energy: 0.8786201571572388
Energy: 1.0784274175567392
Energy: 0.8786201571572388
Energy: 0.8466410979542303
Energy: 1.0257882287692546
Energy: 0.8466410979538022
Energy: 1.025788228770967
Energy: 0.8466410979538022
Energy: 1.0257882287701108
Energy: 1.048481251430917
Energy: 0.8949831400545251
Energy: 1.048481251430917
Energy: 0.8949831400540968
Energy: 1.048481251430917
Energy: 0.8949831400540968
Energy: 0.9807082912036078
Energy: 1.0087655625523486
Energy: 0.9807082912036078
Energy: 1.0087655625523486
Energy: 0.9807082912036078
Energy: 1.0087655625523486
Energy: 0.9572528076374733
Energy: 0.9545460976051641
Energy: 0.9572528076374733
Energy: 0.9545460976055922
Energy: 0.9572528076374733
Energy: 0.9545460976055922
Energy: 1.028916265483277
Energy: 0.9134493182394957
Energy: 1.0569016638145041
Energy: 0.9134493182394957
Energy: 1.0289162628640207
Energy: 0.9134493182394957
Energy: 0.8573703677159797
Energy: 1.0792012554267667
Energy: 0.8537202621670146
Energy: 1.0792012554271948
Energy: 0.8573703677159797
Energy: 1.0792012554271948
Energy: 0.9579814529719259
Energy: 0.8554814472170161
Energy: 0.9579814529719259
Energy: 0.8554814472170161
Energy: 0.9579814529719259
Energy: 0.8554814472174441
Energy: 0.8266860090509375
Energy: 1.074215784553084
Energy: 0.8267080328023461
Energy: 1.074215784552656
Energy: 0.8266860090505092
Energy: 1.074215784553084
Energy: 1.0135657161667482
Energy: 0.8525070849431815
Energy: 1.0135657161671763
Energy: 0.8525070849436096
Energy: 1.0135657161667482
Energy: 0.8525070849436096
Energy: 0.8467420222512229
Energy: 0.9509836578236318
Energy: 0.8467413614341956
Energy: 0.9509836578236318
Energy: 0.8467420222516508
Energy: 0.9509836578240599
Energy: 1.0521108010499238
Energy: 0.8392348982476893
Energy: 1.0521108010494957
Energy: 0.8392348982476893
Energy: 1.0521108010494957
Energy: 0.8392348982472612
Energy: 0.8870357583089282
Energy: 1.0211020974285965
Energy: 0.8870357583085001
Energy: 1.0211020974298808
Energy: 0.8870357583085001
Energy: 1.0211020974294527
Energy: 1.1214260817703972
Energy: 0.9530809654922233
Energy: 1.1214260817721096
Energy: 0.9530809654917952
Energy: 1.1214260817729658
Energy: 0.9530809654917952
Energy: 0.9553776269359543
Energy: 0.8853929320017974
Energy: 0.9553776269355263
Energy: 0.8853929320013694
Energy: 0.9553776269359543
Energy: 0.8853929320017974
Energy: 0.9485155679085656
Energy: 1.0122179211550568
Energy: 0.9485155679081375
Energy: 1.0122179211550568
Energy: 0.9485155679077095
Energy: 1.0122179211550568
Energy: 0.9983314294791819
Energy: 0.8796981217253951
Energy: 0.9983314294791819
Energy: 0.8796981217253951
Energy: 0.9983314294791819
Energy: 0.8796981217253951
Energy: 0.8947833401839317
Energy: 1.0034036332458607
Energy: 0.8947833401839317
Energy: 1.0034036332458607
Energy: 0.8947833401835036
Energy: 1.0034036332458607
Energy: 1.0443248840591701
Energy: 0.9140820119521593
Energy: 1.0443248840591701
Energy: 0.9140820119525873
Energy: 1.0443248840591701
Energy: 0.9140820119525873
Energy: 0.8216786381327675
Energy: 1.0905002686739749
Energy: 0.8216786381331956
Energy: 1.0905002686748313
Energy: 0.8216786381331956
Energy: 1.0905002686748313
Energy: 1.0253541564144457
Energy: 0.8488732845532698
Energy: 1.025354156415302
Energy: 0.8488732845532698
Energy: 1.0253541564144457
Energy: 0.8488732845532698
Energy: 0.8299599473503982
Energy: 1.0521185216904387
Energy: 0.829953717617614
Energy: 1.0521185216904387
Energy: 0.8299599473503982
Energy: 1.0521185216904387
Energy: 1.0252447192637768
Energy: 0.9305758070243051
Energy: 1.0252447192633487
Energy: 0.9305758070247331
Energy: 1.025244719264205
Energy: 0.9305758070243051
Energy: 0.8467125217675554
Energy: 0.9597221359560771
Energy: 0.8466510701112574
Energy: 0.9597221359560771
Energy: 0.8467125217679837
Energy: 0.9597221359565055
Energy: 1.1088417105369146
Energy: 1.007025364459203
Energy: 1.0747290317197467
Energy: 1.0070253644596312
Energy: 1.1088417105369146
Energy: 1.007025364459203
Energy: 1.0535983079704707
Energy: 0.9580167948009377
Energy: 1.038492750431965
Energy: 0.9580167948009377
Energy: 1.0535983079704707
Energy: 0.9580167948013659
Energy: 0.8532735475764802
Energy: 0.9561046118710953
Energy: 0.8532735475760522
Energy: 0.9561046118715233
Energy: 0.8532735475760522
Energy: 0.9561046118710953
Energy: 1.0910233456990865
Energy: 0.8695326305026185
Energy: 1.0910233456990865
Energy: 0.8695326305026185
Energy: 1.0910233456990865
Energy: 0.8695326305026185
Energy: 0.8530300015272174
Energy: 1.0146291549406776
Energy: 0.8530300015272174
Energy: 1.0146291549402497
Energy: 0.8530300015272174
Energy: 1.0146291549406776
Energy: 1.0675049236525285
Energy: 0.8556847858269914
Energy: 1.0675049236525285
Energy: 0.8556847858265632
Energy: 1.0675049236521006
Energy: 0.8556847858269914
Energy: 0.8384767223130063
Energy: 1.0696266047276137
Energy: 0.8384767223134344
Energy: 1.0696266047284702
Energy: 0.8384767223134344
Energy: 1.0696266047259015
Energy: 1.048569772804317
Energy: 0.913842246127311
Energy: 1.0480915519983942
Energy: 0.913842246127311
Energy: 1.048569772804317
Energy: 0.913842246127739
Energy: 0.9521554024014478
Energy: 1.089805945552584
Energy: 0.9521554024010197
Energy: 1.089805945552584
Energy: 0.9521554024014478
Energy: 1.089805945552584
Energy: 0.8851022138717689
Energy: 0.8462535257091076
Energy: 0.8851022138717689
Energy: 0.8462535257086795
Energy: 0.8851022138717689
Energy: 0.8462535257082515
Energy: 0.8943597383568627
Energy: 0.9944626749545854
Energy: 0.8943597383572908
Energy: 0.9944626749545854
Energy: 0.8943597383572908
Energy: 0.9944626749550135
Energy: 0.8815051036810619
Energy: 0.9996593544986109
Energy: 0.882621006144072
Energy: 0.9996593544981829
Energy: 0.8815051036810619
Energy: 0.9996593544981829
Energy: 0.9636046851810401
Energy: 0.9441822850918845
Energy: 0.9636046851814684
Energy: 0.9441822850918845
Energy: 0.9636046851806122
Energy: 0.9441822850914563
Energy: 0.8864869450389311
Energy: 1.021187187966626
Energy: 0.886486945038503
Energy: 1.0211871879764725
Energy: 0.8864869450389311
Energy: 1.0211871879794692
Energy: 1.097492710902434
Energy: 0.8232668313951467
Energy: 1.0974927109015777
Energy: 0.8232668313947185
Energy: 1.097492710902434
Energy: 0.8232668313947185
Energy: 0.8467777011077403
Energy: 0.9494141560044265
Energy: 0.8467777011073122
Energy: 0.9494141560044265
Energy: 0.8467777011073122
Energy: 0.9494141560048545

minimum gb energy = 0.8216786381327675 eV
minimum distance =  2.39785699207382 Angstroms
sigma value = 51


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

Energy: 0.9514449140162639
Energy: 1.040803644284116
Energy: 0.9514449140152719
Energy: 1.040803644284116
Energy: 0.9514449140152719
Energy: 1.0408036442831243
Energy: 1.057523569780898
Energy: 0.9299026474412329
Energy: 1.05752356978189
Energy: 0.9299026474412329
Energy: 1.057523569780898
Energy: 0.9299026474412329
Energy: 0.8531778759791073
Energy: 1.1365798010724646
Energy: 0.8531778759791073
Energy: 1.1365798010714725
Energy: 0.8531778759791073
Energy: 1.1365798010724646
Energy: 0.9349479078402673
Energy: 0.8744953903196941
Energy: 0.9349479078412591
Energy: 0.8744953903196941
Energy: 0.9349479078402673
Energy: 0.8744953903196941
Energy: 1.0061886783604745
Energy: 0.9743755517095248
Energy: 1.0061886783604745
Energy: 0.9743755517095248
Energy: 1.0061886783604745
Energy: 0.9743755517095248
Energy: 1.024435667311487
Energy: 0.9309857779605654
Energy: 1.024435667311487
Energy: 0.9309857779595735
Energy: 1.024435667311487
Energy: 0.9309857779595735
Energy: 0.9125452582348911
Energy: 0.9315405727895865
Energy: 0.9125452582348911
Energy: 0.9315405727885946
Energy: 0.9125452582348911
Energy: 0.9315405727885946
Energy: 0.8799462055994944
Energy: 0.9761896960499993
Energy: 0.8799462055994944
Energy: 0.9761896960499993
Energy: 0.8799462055994944
Energy: 0.9761896960499993
Energy: 1.0790970542941138
Energy: 0.8545730793589371
Energy: 1.0790970542941138
Energy: 0.8545730793589371
Energy: 1.0790970542941138
Energy: 0.8545730793589371
Energy: 0.8887162755583438
Energy: 1.1091059866379325
Energy: 0.8887162755573518
Energy: 1.1091059866379325
Energy: 0.8887162755573518
Energy: 1.1091059866379325
Energy: 1.0808874564657036
Energy: 0.8492730261728114
Energy: 1.080887456464712
Energy: 0.8492730261728114
Energy: 1.080887456464712
Energy: 0.8492730261728114
Energy: 0.9697777101687408
Energy: 1.0109001014324082
Energy: 0.9697777101687408
Energy: 1.0109001014324082
Energy: 0.9697777101697329
Energy: 1.0109001014324082
Energy: 1.058777686300543
Energy: 0.912639712534363
Energy: 1.058777686300543
Energy: 0.912639712534363
Energy: 1.058777686300543
Energy: 0.912639712534363
Energy: 0.9278666091712898
Energy: 0.9250577085567747
Energy: 0.9278666091712898
Energy: 0.9250577085567747
Energy: 0.9278666091712898
Energy: 0.9250577085567747
Energy: 0.9383517344106053
Energy: 0.9403834386130562
Energy: 0.9383517344106053
Energy: 0.9403834386130562
Energy: 0.9383517344115974
Energy: 0.9403834386130562
Energy: 1.021871634177964
Energy: 0.9311759984180717
Energy: 1.021871634177964
Energy: 0.9311759984190636
Energy: 1.021871634177964
Energy: 0.9311759984190636
Energy: 0.9588303925876186
Energy: 1.0896408028037705
Energy: 0.9588303925886105
Energy: 1.0896408028037705
Energy: 0.9588303925876186
Energy: 1.0896408028037705
Energy: 0.9529512643141427
Energy: 0.9135581675975167
Energy: 0.9529512643141427
Energy: 0.9135581675975167
Energy: 0.9529512643141427
Energy: 0.9135581675975167

minimum gb energy = 0.8492730261728114 eV
minimum distance =  2.30550879550403 Angstroms
sigma value = 19


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

Energy: 0.8375667504978913
Energy: 0.8038942614159117
Energy: 0.8375667504984796
Energy: 0.8038942614159117
Energy: 0.8375667504984796
Energy: 0.8038942614159117
Energy: 0.9465354625889081
Energy: 0.9336536736524889
Energy: 0.9465354625889081
Energy: 0.9336536736524889
Energy: 0.9465354625889081
Energy: 0.9336536736530773
Energy: 0.7809139575455895
Energy: 0.9464027451264171
Energy: 0.7809139575450011
Energy: 0.9464027451270055
Energy: 0.7809139575450011
Energy: 0.9464027451270055
Energy: 0.8347423698079013
Energy: 0.7584842177618105
Energy: 0.8347423698079013
Energy: 0.7584842177623989
Energy: 0.8347423698073129
Energy: 0.7584842177623989
Energy: 0.7877800616143683
Energy: 0.8153279125420005
Energy: 0.7877800616143683
Energy: 0.8153279125425889
Energy: 0.7877800616143683
Energy: 0.8153279125425889
Energy: 0.7877873620326733
Energy: 0.8151281520990783
Energy: 0.7877873620326733
Energy: 0.8151281520990783
Energy: 0.7877873620332616
Energy: 0.8151281520996666
Energy: 0.8349171630671338
Energy: 0.7584100835683336
Energy: 0.8349171630665455
Energy: 0.7584100835677451
Energy: 0.8349171630665455
Energy: 0.7584100835683336
Energy: 0.7804301633706616
Energy: 0.9471996433983277
Energy: 0.7804301633700733
Energy: 0.9471996433971509
Energy: 0.7804301633706616
Energy: 0.9471996433971509
Energy: 0.9465070704679865
Energy: 0.9335199137492702
Energy: 0.9465070704673982
Energy: 0.9335199137486819
Energy: 0.9465070704679865
Energy: 0.9335199137486819
Energy: 0.8375667504984796
Energy: 0.8038942614159117
Energy: 0.8375667504984796
Energy: 0.8038942614159117
Energy: 0.8375667504984796
Energy: 0.8038942614159117
Energy: 0.9465354625883197
Energy: 0.9336536736530773
Energy: 0.9465354625889081
Energy: 0.9336536736530773
Energy: 0.9465354625889081
Energy: 0.9336536736524889
Energy: 0.7809139575450011
Energy: 0.9464027451264171
Energy: 0.7809139575450011
Energy: 0.9464027451264171
Energy: 0.7809139575450011
Energy: 0.9464027451264171
Energy: 0.8347423698084896
Energy: 0.7584842177623989
Energy: 0.8347423698079013
Energy: 0.7584842177629872
Energy: 0.8347423698079013
Energy: 0.7584842177623989
Energy: 0.7877800616143683
Energy: 0.8153279125425889
Energy: 0.7877800616143683
Energy: 0.8153279125425889
Energy: 0.7877800616143683
Energy: 0.8153279125425889
Energy: 0.7877873620326733
Energy: 0.8151281520990783
Energy: 0.7877873620326733
Energy: 0.8151281520990783
Energy: 0.7877873620326733
Energy: 0.8151281520990783
Energy: 0.8349171630665455
Energy: 0.7584100835677451
Energy: 0.8349171630665455
Energy: 0.7584100835683336
Energy: 0.8349171630671338
Energy: 0.7584100835683336
Energy: 0.7804301633706616
Energy: 0.9471996433971509
Energy: 0.7804301633706616
Energy: 0.9471996433977392
Energy: 0.7804301633712499
Energy: 0.9471996433983277
Energy: 0.9465070704679865
Energy: 0.9335199137492702
Energy: 0.9465070704673982
Energy: 0.9335199137492702
Energy: 0.9465070704679865
Energy: 0.9335199137492702
Energy: 0.8375667504984796
Energy: 0.8038942614159117
Energy: 0.8375667504984796
Energy: 0.8038942614159117
Energy: 0.8375667504984796
Energy: 0.8038942614159117
Energy: 0.9465354625889081
Energy: 0.9336536736524889
Energy: 0.9465354625889081
Energy: 0.9336536736524889
Energy: 0.9465354625889081
Energy: 0.9336536736530773
Energy: 0.7809139575450011
Energy: 0.9464027451264171
Energy: 0.7809139575450011
Energy: 0.9464027451264171
Energy: 0.7809139575450011
Energy: 0.9464027451264171
Energy: 0.8347423698079013
Energy: 0.7584842177623989
Energy: 0.8347423698084896
Energy: 0.7584842177629872
Energy: 0.8347423698079013
Energy: 0.7584842177623989
Energy: 0.7877800616143683
Energy: 0.8153279125425889
Energy: 0.7877800616143683
Energy: 0.8153279125425889
Energy: 0.7877800616143683
Energy: 0.8153279125425889
Energy: 0.7877873620326733
Energy: 0.8151281520990783
Energy: 0.7877873620332616
Energy: 0.8151281520990783
Energy: 0.7877873620326733
Energy: 0.8151281520990783
Energy: 0.8349171630671338
Energy: 0.7584100835683336
Energy: 0.8349171630671338
Energy: 0.7584100835677451
Energy: 0.8349171630665455
Energy: 0.7584100835677451
Energy: 0.7804301633706616
Energy: 0.9471996433989162
Energy: 0.7804301633700733
Energy: 0.9471996433983277
Energy: 0.7804301633706616
Energy: 0.9471996433977392
Energy: 0.9465070704679865
Energy: 0.9335199137492702
Energy: 0.9465070704673982
Energy: 0.9335199137486819
Energy: 0.9465070704673982
Energy: 0.9335199137492702
Energy: 0.8375667504984796
Energy: 0.8038942614159117
Energy: 0.8375667504984796
Energy: 0.8038942614159117
Energy: 0.8375667504984796
Energy: 0.8038942614159117
Energy: 0.9465354625889081
Energy: 0.9336536736524889
Energy: 0.9465354625883197
Energy: 0.9336536736530773
Energy: 0.9465354625889081
Energy: 0.9336536736524889
Energy: 0.7809139575450011
Energy: 0.9464027451270055
Energy: 0.7809139575450011
Energy: 0.9464027451270055
Energy: 0.7809139575450011
Energy: 0.9464027451264171

minimum gb energy = 0.7584100835677451 eV
minimum distance =  2.31744263156577 Angstroms
sigma value = 27


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

Energy: 0.7629105666586242
Energy: 0.7215034518682254
Energy: 0.7629105666586242
Energy: 0.7215034518667841
Energy: 0.7629105666586242
Energy: 0.7215034518682254
Energy: 0.9484011854356253
Energy: 0.7533904007581259
Energy: 0.948401185432743
Energy: 0.7533904007581259
Energy: 0.9484011854341843
Energy: 0.7533904007581259
Energy: 0.7710899259349704
Energy: 0.9667013938391247
Energy: 0.7710899259349704
Energy: 0.9667013938391247
Energy: 0.7710899259349704
Energy: 0.9667013938391247
Energy: 0.9062427189699219
Energy: 0.7187293851417951
Energy: 0.9062427189699219
Energy: 0.718729385140354
Energy: 0.9062427189713629
Energy: 0.718729385140354
Energy: 0.9200907207410735
Energy: 0.7087703198373702
Energy: 0.9200907207410735
Energy: 0.7087703198373702
Energy: 0.9200907207410735
Energy: 0.7087703198388113
Energy: 0.7830678183666806
Energy: 0.9096382650314527
Energy: 0.7830678183666806
Energy: 0.9096382650314527
Energy: 0.7830678183666806
Energy: 0.9096382650314527
Energy: 0.7187031244259665
Energy: 0.7549045440036936
Energy: 0.7187031244259665
Energy: 0.7549045440036936
Energy: 0.7187031244259665
Energy: 0.7549045440036936
Energy: 0.7573434746686747
Energy: 0.722917149526594
Energy: 0.7573434746686747
Energy: 0.722917149526594
Energy: 0.7573434746686747
Energy: 0.722917149526594
Energy: 0.8771423267535181
Energy: 0.7633556236402096
Energy: 0.8771423267520768
Energy: 0.7633556236358859
Energy: 0.8771423267535181
Energy: 0.7633556236445332
Energy: 0.9017928931285565
Energy: 0.8044885731450125
Energy: 0.9017928931299976
Energy: 0.8044885731435713
Energy: 0.9017928931299976
Energy: 0.8044885731435713
Energy: 0.7501690056375214
Energy: 0.7184723842653803
Energy: 0.7501690056375214
Energy: 0.7184723842653803
Energy: 0.7501690056375214
Energy: 0.7184723842653803
Energy: 0.8924380044321453
Energy: 0.7717742703181484
Energy: 0.8924380044307041
Energy: 0.7717742703181484
Energy: 0.8924380044321453
Energy: 0.7717742703181484

minimum gb energy = 0.7087703198373702 eV
minimum distance =  2.30247519641199 Angstroms
sigma value = 9


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

Energy: 0.666486011536383
Energy: 0.7836272079121478
Energy: 0.666486011536383
Energy: 0.7836272079121478
Energy: 0.666486011536383
Energy: 0.7836272079121478
Energy: 0.8981242443388411
Energy: 0.6835570804039236
Energy: 0.8981242443347917
Energy: 0.6835570804035187
Energy: 0.8981242443384361
Energy: 0.6835570804039236
Energy: 0.6048454863965218
Energy: 1.1552346942418135
Energy: 0.6048454863961168
Energy: 1.1552346942418135
Energy: 0.6048454863965218
Energy: 1.1552346942418135
Energy: 0.6292435282406404
Energy: 0.6182806922268244
Energy: 0.6292435282406404
Energy: 0.6182806922271926
Energy: 0.6292435282406404
Energy: 0.6182806922275975
Energy: 0.6558409982273165
Energy: 0.699776563107203
Energy: 0.6558409982281264
Energy: 0.699776563107203
Energy: 0.6558409982281264
Energy: 0.699776563107203
Energy: 0.6778548751709599
Energy: 0.6414884755847465
Energy: 0.6778548751705549
Energy: 0.6414884755839365
Energy: 0.67785487517015
Energy: 0.6414884755859613
Energy: 0.6313595999255489
Energy: 0.8124367626839339
Energy: 0.6313595999255489
Energy: 0.8124367626839339
Energy: 0.6313595999251439
Energy: 0.8124367626843391
Energy: 0.6020458258436444
Energy: 0.8124190201896202
Energy: 0.6020458258440493
Energy: 0.8124190201896202
Energy: 0.6020458258436444
Energy: 0.8124190201896202
Energy: 0.9234096803604701
Energy: 0.6985102630183234
Energy: 0.9234096803616848
Energy: 0.6985102630171086
Energy: 0.9234096803616848
Energy: 0.6985102630190966
Energy: 0.7368618173207132
Energy: 0.8983623366525129
Energy: 0.7368618173207132
Energy: 0.8983623366533228
Energy: 0.7368618173211181
Energy: 0.8983623366533228
Energy: 0.6267008958303643
Energy: 0.6225413526176401
Energy: 0.6267008958307692
Energy: 0.6225413526176401
Energy: 0.6267008958307692
Energy: 0.6225413526176401
Energy: 0.6949436004144409
Energy: 0.6861221047367847
Energy: 0.6949436004144409
Energy: 0.6861221047367847
Energy: 0.6949436004144409
Energy: 0.6861221047367847
Energy: 0.6521189115846318
Energy: 0.6310518674089656
Energy: 0.6521189115797724
Energy: 0.63105186741261
Energy: 0.652118911583417
Energy: 0.6310518674065357
Energy: 0.6632872911628362
Energy: 0.7850824337428615
Energy: 0.6632872911624313
Energy: 0.7850824337432664
Energy: 0.6632872911612165
Energy: 0.7850824337424565
Energy: 0.6255625938174961
Energy: 0.8002069374538312
Energy: 0.6255625938174961
Energy: 0.8002069374542361
Energy: 0.6255625938166862
Energy: 0.8002069374542361
Energy: 0.8523037218774288
Energy: 0.6405463267015417
Energy: 0.8523037218786437
Energy: 0.6405463267011366
Energy: 0.8523037218766191
Energy: 0.6405463267027564
Energy: 0.8867548213323295
Energy: 0.7973761270312915
Energy: 0.8867548213335443
Energy: 0.7973761270337212
Energy: 0.8867548213343543
Energy: 0.7973761270349358
Energy: 0.6307864839031548
Energy: 0.7806395772432008
Energy: 0.6307864839023449
Energy: 0.7806395772436057
Energy: 0.6307864839027498
Energy: 0.7806395772436057
Energy: 0.6003203643292206
Energy: 0.8729854399353543
Energy: 0.6003203643288157
Energy: 0.8729854399345446
Energy: 0.6003203643288157
Energy: 0.8729854399349495
Energy: 0.8408724607913736
Energy: 0.6448277562362239
Energy: 0.8408724607921836
Energy: 0.644827756235819
Energy: 0.8408724607917786
Energy: 0.644827756235819
Energy: 0.6002413977311377
Energy: 0.8730020228460644
Energy: 0.6002413977315427
Energy: 0.8730020228456595
Energy: 0.6002413977315427
Energy: 0.8730020228456595
Energy: 0.630598273369037
Energy: 0.7805326844715282
Energy: 0.6305982733694419
Energy: 0.7805326844719331
Energy: 0.6305982733694419
Energy: 0.780532684472743
Energy: 0.886827762266791
Energy: 0.7973458264775796
Energy: 0.8868277622663862
Energy: 0.7973458264945874
Energy: 0.8868277622663862
Energy: 0.7973458264913478
Energy: 0.9007216083431968
Energy: 0.630658983494883
Energy: 0.9007216083423868
Energy: 0.6306589834880357
Energy: 0.9007216083431968
Energy: 0.6306589834831765
Energy: 0.625741731931338
Energy: 0.8001721128088842
Energy: 0.625741731931338
Energy: 0.8001721128088842
Energy: 0.625741731931743
Energy: 0.8001721128084793
Energy: 0.6629954207044136
Energy: 0.7849657945552599
Energy: 0.6629954207064382
Energy: 0.7849657945572848
Energy: 0.6629954207044136
Energy: 0.7849657945568799
Energy: 0.6523803978185351
Energy: 0.6312190527240888
Energy: 0.6523803978173203
Energy: 0.6312190527240888
Energy: 0.6523803978197499
Energy: 0.6312190527244937
Energy: 0.6948415774531094
Energy: 0.6201707894595809
Energy: 0.6948415774531094
Energy: 0.6201707894607957
Energy: 0.6948415774522996
Energy: 0.6201707894607957
Energy: 0.6265552429553445
Energy: 0.6225599045527509
Energy: 0.6265552429553445
Energy: 0.6225599045527509
Energy: 0.6265552429553445
Energy: 0.6225599045527509
Energy: 0.7374059906135934
Energy: 1.0183109867936184
Energy: 0.7374059906135934
Energy: 1.0183109867936184
Energy: 0.7374059906139983
Energy: 1.0183109867940234
Energy: 0.9233225251165874
Energy: 0.6995312991108471
Energy: 0.9233225251169923
Energy: 0.6995312991108471
Energy: 0.9233225251173973
Energy: 0.6995312991104421
Energy: 0.6021301439215433
Energy: 0.8124338821727431
Energy: 0.6021301439215433
Energy: 0.8124338821723381
Energy: 0.6021301439215433
Energy: 0.8124338821727431
Energy: 0.6299748634748744
Energy: 0.7751442177706918
Energy: 0.6299748634781139
Energy: 0.7751442177698818
Energy: 0.6299748634764942
Energy: 0.7751442177719067
Energy: 0.6778932415912567
Energy: 0.8219537109825519
Energy: 0.6778932415924714
Energy: 0.821953710982957
Energy: 0.6778932415920667
Energy: 0.8219537109902461
Energy: 0.6558861682147108
Energy: 0.6995783306552722
Energy: 0.6558861682147108
Energy: 0.699578330656892
Energy: 0.6558861682147108
Energy: 0.699578330656487
Energy: 0.6262736497743235
Energy: 0.6171117912133622
Energy: 0.6262736497739186
Energy: 0.6171117912137672
Energy: 0.6262736497739186
Energy: 0.6171117912141721
Energy: 0.6048286629443285
Energy: 1.15535791926842
Energy: 0.6048286629439237
Energy: 1.15535791926842
Energy: 0.6048286629443285
Energy: 1.15535791926842
Energy: 0.8989486607009567
Energy: 0.7236769862566419
Energy: 0.8989486607021714
Energy: 0.7236769862558321
Energy: 0.898948660698527
Energy: 0.7236769862566419
Energy: 0.666486011536383
Energy: 0.7836272079125527
Energy: 0.666486011536788
Energy: 0.7836272079125527
Energy: 0.666486011536383
Energy: 0.7836272079125527
Energy: 0.8981242443372214
Energy: 0.5988661241509975
Energy: 0.8981242443307422
Energy: 0.5988661241505926
Energy: 0.898124244348523
Energy: 0.5988661241514024
Energy: 0.6048454863969267
Energy: 1.1552346942410037
Energy: 0.6048454863973316
Energy: 1.1552346942414087
Energy: 0.6048454863977366
Energy: 1.1552346942410037
Energy: 0.6292435282406404
Energy: 0.6182806922264195
Energy: 0.6292435282406404
Energy: 0.6182806922268244
Energy: 0.6292435282410455
Energy: 0.6182806922268244
Energy: 0.6558409982277215
Energy: 0.6997765631055833
Energy: 0.6558409982281264
Energy: 0.6997765631051783
Energy: 0.6558409982277215
Energy: 0.6997765631051783

minimum gb energy = 0.5988661241505926 eV
minimum distance =  2.38032004728531 Angstroms
sigma value = 57


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

Energy: 0.2317714529089516
Energy: 0.2396849454536051
Energy: 0.2317714529089516
Energy: 0.2396849454536051
Energy: 0.2317714529089516
Energy: 0.2396849454536051
Energy: 0.8280034516539463
Energy: 0.8379798989867613
Energy: 0.8280034516548679
Energy: 0.8379798989858396
Energy: 0.8280034516548679
Energy: 0.8379798989867613
Energy: 0.2755582771907365
Energy: 0.7883537591252031
Energy: 0.2755582771916583
Energy: 0.7883537591252031
Energy: 0.2755582771907365
Energy: 0.7883537591252031
Energy: 0.2404978963149273
Energy: 0.23154180989320966
Energy: 0.24049789631400545
Energy: 0.23154180989228784
Energy: 0.24049789631400545
Energy: 0.23154180989228784
Energy: 0.3213357476366179
Energy: 0.32335900805649714
Energy: 0.3213357476366179
Energy: 0.32335900805741896
Energy: 0.3213357476366179
Energy: 0.32335900805741896
Energy: 0.23175753838472732
Energy: 0.9892641509168622
Energy: 0.23175753838472732
Energy: 0.9892641509159402
Energy: 0.23175753838472732
Energy: 0.9892641509168622
Energy: 0.23177788315898185
Energy: 0.9900503568318563
Energy: 0.23177788315990366
Energy: 0.9900503568309345
Energy: 0.23177788315990366
Energy: 0.9900503568309345
Energy: 0.32099937483922925
Energy: 0.3262228952182599
Energy: 0.32099937483922925
Energy: 0.3262228952182599
Energy: 0.32099937483922925
Energy: 0.3262228952182599
Energy: 0.2411441289896712
Energy: 0.23152232077636087
Energy: 0.2411441289896712
Energy: 0.23152232077636087
Energy: 0.2411441289887494
Energy: 0.23152232077636087
Energy: 0.2755986305218583
Energy: 0.7883666981767948
Energy: 0.2755986305218583
Energy: 0.7883666981767948
Energy: 0.2755986305227801
Energy: 0.7883666981767948
Energy: 0.8280198645646734
Energy: 0.8379583043240696
Energy: 0.8280198645646734
Energy: 0.8379583043240696
Energy: 0.8280198645646734
Energy: 0.8379583043240696
Energy: 0.2317714529089516
Energy: 0.2396849454536051
Energy: 0.2317714529089516
Energy: 0.2396849454536051
Energy: 0.2317714529089516
Energy: 0.2396849454536051
Energy: 0.8280034516548679
Energy: 0.8379798989867613
Energy: 0.8280034516548679
Energy: 0.8379798989867613
Energy: 0.8280034516548679
Energy: 0.8379798989867613
Energy: 0.2755582771916583
Energy: 0.7883537591242814
Energy: 0.2755582771907365
Energy: 0.7883537591252031
Energy: 0.2755582771907365
Energy: 0.7883537591242814
Energy: 0.24049789631400545
Energy: 0.23154180989228784
Energy: 0.24049789631400545
Energy: 0.23154180989320966
Energy: 0.24049789631400545
Energy: 0.23154180989228784
Energy: 0.32133574763569606
Energy: 0.3233590080583407
Energy: 0.3213357476366179
Energy: 0.32335900805741896
Energy: 0.3213357476375397
Energy: 0.32335900805741896
Energy: 0.23175753838472732
Energy: 0.9892641509168622
Energy: 0.23175753838472732
Energy: 0.9892641509168622
Energy: 0.23175753838472732
Energy: 0.9892641509159402
Energy: 0.23177788315990366
Energy: 0.9900503568300125
Energy: 0.23177788315898185
Energy: 0.9900503568309345
Energy: 0.23177788315990366
Energy: 0.9900503568300125
Energy: 0.32099937483922925
Energy: 0.3262228952182599
Energy: 0.3209993748401511
Energy: 0.3262228952182599
Energy: 0.32099937483922925
Energy: 0.3262228952182599

minimum gb energy = 0.23152232077636087 eV
minimum distance =  2.45506644597483 Angstroms
sigma value = 11


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

Energy: 0.5562813292179809
Energy: 0.6575266647280031
Energy: 0.5562813292179809
Energy: 0.6575266647286784
Energy: 0.5562813292179809
Energy: 0.6575266647286784
Energy: 0.681858244438906
Energy: 0.6219760503100951
Energy: 0.6818582444395812
Energy: 0.6219760503100951
Energy: 0.6818582444395812
Energy: 0.6219760503094197
Energy: 0.7634572800428445
Energy: 1.1836372710835508
Energy: 0.7634572800428445
Energy: 1.1836372710794996
Energy: 0.7634572800428445
Energy: 1.1836372710815253
Energy: 0.8538116682241417
Energy: 0.49772215844586526
Energy: 0.8538116682234664
Energy: 0.49772215844586526
Energy: 0.853811668224817
Energy: 0.49772215844654055
Energy: 0.6462800897341142
Energy: 0.46851617667156426
Energy: 0.646280089733439
Energy: 0.46851617667156426
Energy: 0.6462800897347895
Energy: 0.46851617667223944
Energy: 0.5863638469383974
Energy: 0.7029193313531129
Energy: 0.5863638469383974
Energy: 0.7029193313531129
Energy: 0.5863638469383974
Energy: 0.7029193313531129
Energy: 0.46360067083194306
Energy: 0.7181242753775994
Energy: 0.4636006708326183
Energy: 0.71812427537895
Energy: 0.4636006708326183
Energy: 0.7181242753775994
Energy: 0.652289924392795
Energy: 0.44489894693412735
Energy: 0.652289924392795
Energy: 0.4448989469347412
Energy: 0.6522899243934702
Energy: 0.44489894693412735
Energy: 0.6534805821317391
Energy: 0.44888983916158404
Energy: 0.6534805821324143
Energy: 0.44888983916158404
Energy: 0.6534805821317391
Energy: 0.44888983916225933
Energy: 0.4564815567532515
Energy: 0.835184883377882
Energy: 0.4564815567532515
Energy: 0.8351848833772068
Energy: 0.4564815567532515
Energy: 0.8351848833772068
Energy: 0.7194601763757086
Energy: 0.9003020450778968
Energy: 0.7194601763750332
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Energy: 0.719460176374358
Energy: 0.9003020450778968
Energy: 0.6470065732854869
Energy: 0.4701679272103682
Energy: 0.6470065732861622
Energy: 0.4701679272096929
Energy: 0.6470065732854869
Energy: 0.4701679272096929
Energy: 0.6606388519441266
Energy: 0.500211337437553
Energy: 0.6606388519448019
Energy: 0.5002113374382282
Energy: 0.6606388519448019
Energy: 0.5002113374382282
Energy: 0.7309748168258133
Energy: 0.9029702969358834
Energy: 0.7309748168258133
Energy: 0.9029702969358834
Energy: 0.7309748168258133
Energy: 0.902970296937234
Energy: 0.8071675366720648
Energy: 0.6212136987070611
Energy: 0.8071675366713895
Energy: 0.6212136987057105
Energy: 0.8071675366713895
Energy: 0.6212136987057105
Energy: 0.5546830538000757
Energy: 0.6536896642466647
Energy: 0.5546830537994003
Energy: 0.65368966424734
Energy: 0.5546830537994003
Energy: 0.6536896642459895
Energy: 0.5587292894515903
Energy: 0.6429051537912241
Energy: 0.558729289450915
Energy: 0.6429051537912241
Energy: 0.5587292894515903
Energy: 0.6429051537905488
Energy: 0.8307355322868729
Energy: 0.7340543545045412
Energy: 0.830735532287548
Energy: 0.7340543545079173
Energy: 0.8307355322868729
Energy: 0.7340543545099429
Energy: 0.8820897202090477
Energy: 0.4925445919790172
Energy: 0.8820897202090477
Energy: 0.49254459198104295
Energy: 0.8820897202090477
Energy: 0.4925445919790172
Energy: 0.6470337965845717
Energy: 0.5609057397647489
Energy: 0.6470337965838965
Energy: 0.5609057397647489
Energy: 0.647033796585247
Energy: 0.5609057397647489
Energy: 0.45775996590572776
Energy: 0.6517402230651005
Energy: 0.45775996590640294
Energy: 0.6517402230651005
Energy: 0.45775996590640294
Energy: 0.6517402230651005
Energy: 0.6903048855580337
Energy: 0.7177827863325299
Energy: 0.6903048855573585
Energy: 0.7177827863298291
Energy: 0.6903048855573585
Energy: 0.7177827863325299
Energy: 0.648424463987955
Energy: 0.5686076213704008
Energy: 0.648424463987955
Energy: 0.568607621371076
Energy: 0.648424463987955
Energy: 0.568607621371076
Energy: 0.6554709098840824
Energy: 0.5555405024164087
Energy: 0.6554709098840824
Energy: 0.5555405024164087
Energy: 0.6554709098840824
Energy: 0.5555405024164087
Energy: 0.45775001681954225
Energy: 0.9036566316754031
Energy: 0.45775001681954225
Energy: 0.903656631674728
Energy: 0.4577500168202175
Energy: 0.9036566316760783
Energy: 1.0998118051297956
Energy: 0.8886143993839366
Energy: 1.0998118051304708
Energy: 0.888614399384612
Energy: 1.099811805131146
Energy: 0.888614399384612

minimum gb energy = 0.44489894693412735 eV
minimum distance =  2.36138096740401 Angstroms
sigma value = 41


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

Energy: 0.6328417764924733
Energy: 0.6262015268535082
Energy: 0.6328417764924733
Energy: 0.6262015268540404
Energy: 0.6328417764924733
Energy: 0.6262015268540404
Energy: 0.7199773012534618
Energy: 0.8125025716155639
Energy: 0.7199773012523973
Energy: 0.8125025716155639
Energy: 0.7199773012534618
Energy: 0.8125025716155639
Energy: 0.9347886301112623
Energy: 1.1417007888376995
Energy: 0.9347886301112623
Energy: 1.1417007888382316
Energy: 0.93478863011073
Energy: 1.1417007888382316
Energy: 0.7032742373465237
Energy: 0.5279489975165431
Energy: 0.7032742373454594
Energy: 0.5279489975165431
Energy: 0.7032742373443949
Energy: 0.5279489975165431
Energy: 0.5182065732679366
Energy: 0.6531188041167261
Energy: 0.5182065732684689
Energy: 0.6531188041167261
Energy: 0.5182065732684689
Energy: 0.6531188041167261
Energy: 0.6945101416542039
Energy: 0.9193742350219356
Energy: 0.6945101416542039
Energy: 0.9193742350219356
Energy: 0.6945101416542039
Energy: 0.9193742350224678
Energy: 0.5312615540605304
Energy: 0.8407492443121904
Energy: 0.5312615540605304
Energy: 0.8407492443121904
Energy: 0.5312615540600225
Energy: 0.8407492443121904
Energy: 0.5104877951072501
Energy: 0.5279176410957732
Energy: 0.5104877951072501
Energy: 0.5279176410963055
Energy: 0.5104877951072501
Energy: 0.5279176410957732
Energy: 0.5294517040345099
Energy: 0.6491440279887142
Energy: 0.5294517040345099
Energy: 0.6491440279881819
Energy: 0.5294517040345099
Energy: 0.6491440279887142
Energy: 0.5756695861245184
Energy: 0.9930419717131076
Energy: 0.575669586123986
Energy: 0.9930419717125756
Energy: 0.5756695861245184
Energy: 0.9930419717125756
Energy: 0.5779449755387331
Energy: 0.9425106247291393
Energy: 0.5779449755387331
Energy: 0.9425106247291393
Energy: 0.5779449755387331
Energy: 0.942510624728607
Energy: 0.5053693584704234
Energy: 0.6529460758049543
Energy: 0.5053693584698913
Energy: 0.6529460758049543
Energy: 0.5053693584704234
Energy: 0.6529460758049543
Energy: 0.5116225857553445
Energy: 0.6185195820115508
Energy: 0.5116225857553445
Energy: 0.6185195820110186
Energy: 0.5116225857553445
Energy: 0.6185195820115508
Energy: 0.4919558738539248
Energy: 1.153531446548259
Energy: 0.4919558738539248
Energy: 1.153531446548259
Energy: 0.4919558738539248
Energy: 1.153531446548259
Energy: 0.6927773625544802
Energy: 0.8758895106406123
Energy: 0.6927773625550124
Energy: 0.8758895106406123
Energy: 0.6927773625550124
Energy: 0.8758895106406123
Energy: 0.4897042623562977
Energy: 0.6728199107219099
Energy: 0.48970426235682996
Energy: 0.6728199107213777
Energy: 0.4897042623562977
Energy: 0.6728199107219099
Energy: 0.5199722323314273
Energy: 0.6184213758327854
Energy: 0.5199722323314273
Energy: 0.6184213758327854
Energy: 0.5199722323314273
Energy: 0.6184213758327854
Energy: 0.7556186763158046
Energy: 1.222015348506097
Energy: 0.7556186763163366
Energy: 1.222015348505565
Energy: 0.7556186763158046
Energy: 1.222015348506097
Energy: 0.7219342137787261
Energy: 0.759597786787999
Energy: 0.7219342137787261
Energy: 0.7595977867874667
Energy: 0.7219342137787261
Energy: 0.759597786787999
Energy: 0.6305586633349697
Energy: 0.655122910071852
Energy: 0.6305586633344374
Energy: 0.6551229100739808
Energy: 0.6305586633344374
Energy: 0.655122910071852
Energy: 0.5311535087118378
Energy: 0.8017879478912294
Energy: 0.5311535087118378
Energy: 0.8017879478912294
Energy: 0.5311535087118378
Energy: 0.8017879478912294
Energy: 0.9331813920313212
Energy: 0.9655269014103169
Energy: 0.9331813920307889
Energy: 0.9655269013730627
Energy: 0.9331813920307889
Energy: 0.9655269013869
Energy: 0.7027648347175756
Energy: 0.5296781454495247
Energy: 0.7027648347186399
Energy: 0.5296781454495247
Energy: 0.7027648347181078
Energy: 0.5296781454495247
Energy: 0.48990620003306434
Energy: 0.7828103410588394
Energy: 0.4899062000304033
Energy: 0.7846621333929571
Energy: 0.4899062000325321
Energy: 0.7846621333929571
Energy: 0.48978347056884075
Energy: 0.8106924444290077
Energy: 0.48978347056884075
Energy: 0.8106924444284755
Energy: 0.489783470569373
Energy: 0.8106924444290077
Energy: 0.5303524114034598
Energy: 0.5319535552061818
Energy: 0.5303524113997344
Energy: 0.5319535552056497
Energy: 0.5303524114045242
Energy: 0.5319535552061818
Energy: 0.5161913477262364
Energy: 0.5307951353692208
Energy: 0.5161913477257043
Energy: 0.5307951353686886
Energy: 0.5161913477262364
Energy: 0.5307951353686886
Energy: 0.5299904863785161
Energy: 0.7711796748047665
Energy: 0.5299904863785161
Energy: 0.7648614221372623
Energy: 0.5299904863785161
Energy: 0.6772249825288257
Energy: 0.626969866078596
Energy: 0.7979395167676642
Energy: 0.6269698660780637
Energy: 0.7979395167676642
Energy: 0.626969866078596
Energy: 0.7979395167676642
Energy: 1.0709106243802093
Energy: 0.4900554920136211
Energy: 1.0709106243796769
Energy: 0.4900554920136211
Energy: 1.0709106243802093
Energy: 0.4900554920141533
Energy: 0.5107439094887732
Energy: 0.6512629829590653
Energy: 0.5107439094893053
Energy: 0.6512629829585331
Energy: 0.5107439094887732
Energy: 0.6512629829585331
Energy: 0.5345660906478517
Energy: 0.619452484007891
Energy: 0.5345660906473195
Energy: 0.619452484007891
Energy: 0.5345660906478517
Energy: 0.619452484007891
Energy: 0.4902849011319382
Energy: 0.6753771436848496
Energy: 0.4902849011319382
Energy: 0.6753771436848496
Energy: 0.4902849011319382
Energy: 0.6753771436843173

minimum gb energy = 0.4897042623562977 eV
minimum distance =  2.40448190361537 Angstroms
sigma value = 33


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

Energy: 0.7323580382571652
Energy: 0.618895456230124
Energy: 0.7130505840104788
Energy: 0.6188954562308709
Energy: 0.7323580382564182
Energy: 0.618895456230124
Energy: 0.9137060889600721
Energy: 0.5772898526141351
Energy: 0.9137060889596986
Energy: 0.5772898526141351
Energy: 0.9137060889600721
Energy: 0.5772898526141351
Energy: 0.9941879355287297
Energy: 1.000633065866211
Energy: 0.9941879355283562
Energy: 1.0006330658669582
Energy: 0.9941879355291031
Energy: 1.0006330658669582
Energy: 0.8804297077229218
Energy: 0.5943239650229954
Energy: 0.8804297077225484
Energy: 0.5943239650229954
Energy: 0.8804297077229218
Energy: 0.5943239650229954
Energy: 0.6111720633404988
Energy: 1.0155051338547814
Energy: 0.6111321749426428
Energy: 1.0155051338547814
Energy: 0.6111720633401253
Energy: 1.0155051338551548
Energy: 0.842924073962242
Energy: 0.5811154262779789
Energy: 0.8429240739626155
Energy: 0.5811154262776055
Energy: 0.842924073962242
Energy: 0.5811154262783526
Energy: 0.6115601027721299
Energy: 0.7507039229179987
Energy: 0.6115601027728769
Energy: 0.7507039245610828
Energy: 0.6115601027725035
Energy: 0.750703924675681
Energy: 0.6967883118651361
Energy: 0.6935909633651205
Energy: 0.6967883118643889
Energy: 0.6935909633651205
Energy: 0.6967883118651361
Energy: 0.693590963364747
Energy: 0.9956866625595674
Energy: 0.6364593001367754
Energy: 0.9956853869725764
Energy: 0.6364593001367754
Energy: 0.9956866625599408
Energy: 0.6364593001375223
Energy: 0.885880386318516
Energy: 0.5977101735781098
Energy: 0.885880386318516
Energy: 0.5977101735781098
Energy: 0.885880386318516
Energy: 0.5977101735781098
Energy: 0.6494494125684698
Energy: 0.6136942538854382
Energy: 0.6494494125688431
Energy: 0.6136942538850647
Energy: 0.6494494125680962
Energy: 0.6136942538843176
Energy: 1.020049173595747
Energy: 0.5948166348412312
Energy: 1.020049173595747
Energy: 0.5948166348408578
Energy: 1.0200491735953734
Energy: 0.5948166348405183
Energy: 0.5979674342456505
Energy: 0.996916756972666
Energy: 0.5979674342449035
Energy: 0.9969167569734131
Energy: 0.5979674342456505
Energy: 0.9969167569722927
Energy: 0.6921925783764069
Energy: 0.6562208198753805
Energy: 0.6921925783767803
Energy: 0.6562208198753805
Energy: 0.6921925783767803
Energy: 0.656220819876501
Energy: 0.6263878549235028
Energy: 0.5751628827283534
Energy: 0.6263878549235028
Energy: 0.5751628827279799
Energy: 0.6263878549235028
Energy: 0.5751628827283534
Energy: 0.6127989303610231
Energy: 0.8366611330085072
Energy: 0.6127989303599025
Energy: 0.8366611330088809
Energy: 0.6127989303602761
Energy: 0.8366611330085072
Energy: 0.9874760822450878
Energy: 0.612131041266764
Energy: 0.9874760822447142
Energy: 0.6121310412663904
Energy: 0.9874760822447142
Energy: 0.612131041266764
Energy: 0.5904611278414357
Energy: 0.8462491677868473
Energy: 0.5904437189590475
Energy: 0.8462491677864739
Energy: 0.5904611278414357
Energy: 0.8462491677868473
Energy: 0.843157074307455
Energy: 0.9312097344912049
Energy: 0.8431570743070815
Energy: 0.9312097344912049
Energy: 0.8431570743070815
Energy: 0.9312097344908314
Energy: 0.987819024682576
Energy: 0.602985393689357
Energy: 0.9878190246829494
Energy: 0.602985393689357
Energy: 0.9878190246829494
Energy: 0.6029853936897305
Energy: 0.5883055387869901
Energy: 0.7095027802294847
Energy: 0.5883055387869901
Energy: 0.7095027802294847
Energy: 0.5883055387869901
Energy: 0.7095027802294847
Energy: 0.5733727442235897
Energy: 0.8848411703471147
Energy: 0.5733827146601059
Energy: 0.8848411703467411
Energy: 0.5733727442232162
Energy: 0.8848411703474881
Energy: 0.8019278996380392
Energy: 0.7945957897898646
Energy: 0.8019278996380392
Energy: 0.7945957897894911
Energy: 0.8019278996387862
Energy: 0.7945957897898646
Energy: 0.5899381536266484
Energy: 0.8808541973034733
Energy: 0.589938153626275
Energy: 0.8808541973038466
Energy: 0.5899381536266484
Energy: 0.8808541973038466
Energy: 1.0129045930979341
Energy: 0.6119834651949936
Energy: 1.0129045930983074
Energy: 0.6119834651942466
Energy: 1.0129045930983074
Energy: 0.6119834651942466
Energy: 0.5769449354075304
Energy: 0.8134198311715245
Energy: 0.5769449354079039
Energy: 0.813419831169657
Energy: 0.5769449354079039
Energy: 0.8134198311700305
Energy: 0.8440251889914115
Energy: 0.6167153956342972
Energy: 0.8440251889906645
Energy: 0.6167153956339237
Energy: 0.8440251889906645
Energy: 0.6167153956346707
Energy: 0.7363202449167972
Energy: 0.585032111395938
Energy: 0.7114849583732155
Energy: 0.5850321113963116
Energy: 0.7363202449164236
Energy: 0.585032111395938
Energy: 0.6382802529198495
Energy: 1.0058044140021705
Energy: 0.638280252919476
Energy: 1.0058044140021705
Energy: 0.638280252920223
Energy: 1.0058044140021705
Energy: 0.5955727857960703
Energy: 0.8536278763691768
Energy: 0.5955727857960703
Energy: 0.8536278763702972
Energy: 0.5955727857964438
Energy: 0.8536278763669357
Energy: 1.115043143360556
Energy: 0.5879453079270103
Energy: 1.1150431433601826
Energy: 0.5879453079266368
Energy: 1.115043143360556
Energy: 0.5879453079270103
Energy: 0.5900307875717493
Energy: 1.0207271242971465
Energy: 0.5901439449432918
Energy: 1.020727124296773
Energy: 0.5900307875717493
Energy: 1.0207271242971465
Energy: 1.010130492547803
Energy: 0.6120655242242834
Energy: 1.0101304925474297
Energy: 0.6120655242239099
Energy: 1.0101304925474297
Energy: 0.6120655242231628
Energy: 0.6551204718080508
Energy: 0.6213936299007532
Energy: 0.6551204718084241
Energy: 0.6213936299015003
Energy: 0.6551204718080508
Energy: 0.6213936299015003
Energy: 0.7081900984564128
Energy: 0.6268530013381115
Energy: 0.7081900984552922
Energy: 0.6268530013381115
Energy: 0.7081900984545452
Energy: 0.6268530013381115
Energy: 0.9882915106121454
Energy: 0.6368549296352531
Energy: 0.9883072951575971
Energy: 0.6368549296360002
Energy: 0.9882915106117719
Energy: 0.6368549296356266
Energy: 0.6122994772405841
Energy: 0.9867740291551872
Energy: 0.612299477239837
Energy: 0.9867740291551872
Energy: 0.612299477239837
Energy: 0.9867740291555607
Energy: 1.1445143573127865
Energy: 0.5881525843946963
Energy: 1.1445143573124128
Energy: 0.5881525843965638
Energy: 1.1445143573124128
Energy: 0.5881525843965638
Energy: 0.6314004925912566
Energy: 0.8454794555119901
Energy: 0.6314002762148407
Energy: 0.8454794555119901
Energy: 0.6314004925908832
Energy: 0.8454794555119901
Energy: 0.600026282924642
Energy: 0.995770176097315
Energy: 0.6000262829250155
Energy: 0.9957701760969414
Energy: 0.600026282924642
Energy: 0.995770176097315
Energy: 0.7117247483192564
Energy: 0.5980298048130355
Energy: 0.7117247483192564
Energy: 0.598029804813409
Energy: 0.7117247483192564
Energy: 0.598029804813409
Energy: 0.883855890570006
Energy: 0.5814772086071891
Energy: 0.8838558905696325
Energy: 0.5814772086075625
Energy: 0.8838558905696325
Energy: 0.5814772086071891
Energy: 0.6145530025991348
Energy: 0.8045767990471716
Energy: 0.6145530025991348
Energy: 0.8045767990475451
Energy: 0.6145530025987613
Energy: 0.8045767990475451
Energy: 0.9813317563218003
Energy: 0.6127062622183814
Energy: 0.9813317563218003
Energy: 0.6127062622180078
Energy: 0.9813317563218003
Energy: 0.6127062622187549
Energy: 0.6117125324546713
Energy: 0.8687002028200259
Energy: 0.6119101194309455
Energy: 0.8687002028196523
Energy: 0.6117125324464541
Energy: 0.8687002028192788
Energy: 0.8463904837634871
Energy: 0.7871388567957003
Energy: 0.8463904837657281
Energy: 0.7871388567957003
Energy: 0.8463904837646078
Energy: 0.7871388567953267
Energy: 0.573338596881127
Energy: 0.8450255087547466
Energy: 0.5733385968807534
Energy: 0.8450255087551201
Energy: 0.5733385968815004
Energy: 0.8450255087547466

minimum gb energy = 0.5733385968807534 eV
minimum distance =  2.38134615181708 Angstroms
sigma value = 67


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

Energy: 0.6604024071599489
Energy: 0.6260296173127746
Energy: 0.6604024071596936
Energy: 0.62602961731303
Energy: 0.6604024071596936
Energy: 0.62602961731303
Energy: 0.6040870522041744
Energy: 0.5869010617755456
Energy: 0.6040870522041744
Energy: 0.5869010617753189
Energy: 0.6040870522041744
Energy: 0.5869010617758009
Energy: 0.9822898812232715
Energy: 0.904158485308316
Energy: 0.9822898812232715
Energy: 0.9041584853080606
Energy: 0.9822898812232715
Energy: 0.904158485308316
Energy: 0.6040817726173446
Energy: 0.5866114179699455
Energy: 0.6040817726175999
Energy: 0.5866114179699455
Energy: 0.6040817726173446
Energy: 0.586611417969435
Energy: 0.6604024071596936
Energy: 0.6260296173127746
Energy: 0.6604024071599489
Energy: 0.62602961731303
Energy: 0.6604024071596936
Energy: 0.6260296173132853
Energy: 0.6040870522041744
Energy: 0.5869010617758009
Energy: 0.604087052203919
Energy: 0.5869010617760563
Energy: 0.604087052203919
Energy: 0.5869010617760563
Energy: 0.9822898812235269
Energy: 0.904158485308316
Energy: 0.9822898812235269
Energy: 0.904158485308316
Energy: 0.9822898812237537
Energy: 0.904158485308316

minimum gb energy = 0.586611417969435 eV
minimum distance =  2.37333219515019 Angstroms
sigma value = 3


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

Energy: 0.9935083913093741
Energy: 0.7687326914018786
Energy: 0.9935083913093741
Energy: 0.7687326914018786
Energy: 0.9935083913097447
Energy: 0.7687326914018786
Energy: 0.9229854069143212
Energy: 0.815177613036204
Energy: 0.9229854069150008
Energy: 0.8151776130365745
Energy: 0.9229854069146919
Energy: 0.8151776130372539
Energy: 0.729441400727578
Energy: 1.1031440486712552
Energy: 0.729441400727578
Energy: 1.1031440486709463
Energy: 0.7294414007278868
Energy: 1.1031440486709463
Energy: 0.9509067528873908
Energy: 0.8286866351563263
Energy: 0.9509067528873908
Energy: 0.8286866351559558
Energy: 0.9509067528873908
Energy: 0.8286866351563263
Energy: 0.8796595760442815
Energy: 0.8759972950523213
Energy: 0.8796595760439727
Energy: 0.8759972950516419
Energy: 0.8796595760442815
Energy: 0.8759972950513331
Energy: 0.869845777262328
Energy: 1.012674098718041
Energy: 0.8698457772619576
Energy: 1.012674098717732
Energy: 0.869845777262328
Energy: 1.0126740987184113
Energy: 0.8870638507394825
Energy: 1.0615846839965142
Energy: 0.8870638507394825
Energy: 1.061584683996823
Energy: 0.8870638507384325
Energy: 1.0615846839965142
Energy: 0.9440511326800555
Energy: 0.8763452573037708
Energy: 0.9440511326803643
Energy: 0.8763452573037708
Energy: 0.9440511326807349
Energy: 0.8763452573037708
Energy: 0.7573325676324971
Energy: 0.8639636085290763
Energy: 0.7573325676297795
Energy: 0.8639636085290763
Energy: 0.7573325676297795
Energy: 0.8639636085293851
Energy: 0.8169888846307383
Energy: 1.051694266662362
Energy: 0.8169888846311089
Energy: 1.051694266662362
Energy: 0.8169888846314176
Energy: 1.051694266662362
Energy: 0.9998696739276399
Energy: 1.0750056203452854
Energy: 0.9998696739276399
Energy: 1.075005620345656
Energy: 0.9998696739279488
Energy: 1.075005620345656
Energy: 0.8850359801886364
Energy: 0.8013573782873668
Energy: 0.8850359801886364
Energy: 0.8013573782870579
Energy: 0.8850359801889452
Energy: 0.8013573782870579
Energy: 0.7773295202882463
Energy: 0.8332468165603556
Energy: 0.7773295202889255
Energy: 0.8332468165610349
Energy: 0.7773295202896049
Energy: 0.8332468165606645
Energy: 0.8427704030680432
Energy: 0.9814099902361367
Energy: 0.8427704030690932
Energy: 0.9814099902361367
Energy: 0.8427704030680432
Energy: 0.9814099902358279
Energy: 1.1276072794692444
Energy: 0.9591652854076829
Energy: 1.1276072794692444
Energy: 0.9591652854083622
Energy: 1.1276072794692444
Energy: 0.9591652854080536
Energy: 0.9364088100612455
Energy: 0.7799630536102724
Energy: 0.936408810060566
Energy: 0.7799630536102724
Energy: 0.9364088100612455
Energy: 0.7799630536105813
Energy: 0.865850556102042
Energy: 0.8328915242712608
Energy: 0.865850556102042
Energy: 0.8328915242712608
Energy: 0.8658505561016714
Energy: 0.8328915242709519
Energy: 0.8782398178082593
Energy: 0.9989815391538412
Energy: 0.8782398178079505
Energy: 0.9989815391534707
Energy: 0.8782398178082593
Energy: 0.9989815391534707
Energy: 1.0818742063912172
Energy: 0.9141309428238082
Energy: 1.0818742063918967
Energy: 0.9141309428238082
Energy: 1.0818742063912172
Energy: 0.9141309428238082
Energy: 0.9342998529124079
Energy: 0.8083564627828453
Energy: 0.9342998529124079
Energy: 0.8083564627817954
Energy: 0.9342998529117286
Energy: 0.8083564627824747
Energy: 0.8209323654059115
Energy: 0.9453524610137766
Energy: 0.8209323654072702
Energy: 0.9453524610144559
Energy: 0.8209323654056027
Energy: 0.9453524610137766
Energy: 0.8012020931893127
Energy: 1.0288487099812818
Energy: 0.8012020931883245
Energy: 1.0288487099815906
Energy: 0.8012020931883245
Energy: 1.0288487099809112
Energy: 1.0659461523298543
Energy: 0.8054171541878585
Energy: 1.0659461523291751
Energy: 0.8054171541875498
Energy: 1.0659461523298543
Energy: 0.8054171541878585
Energy: 0.8437078105878357
Energy: 0.8553827597952807
Energy: 0.8437078105878357
Energy: 0.8553827597959601
Energy: 0.8437078105885151
Energy: 0.8553827597949103
Energy: 0.8305016796844495
Energy: 0.9454668514954218
Energy: 0.8305016796847581
Energy: 0.945466851495113
Energy: 0.8305016796844495
Energy: 0.9454668514954218
Energy: 0.8281803325686204
Energy: 1.0416177443218366
Energy: 0.8281803325458298
Energy: 1.0416177443218366
Energy: 0.8281803325672616
Energy: 1.0416177443222072
Energy: 1.036436204422437
Energy: 0.7895184781878233
Energy: 1.036436204422437
Energy: 0.7895184781881321
Energy: 1.0364362044227458
Energy: 0.7895184781878233
Energy: 0.8381817663976252
Energy: 0.8246671989511486
Energy: 0.8381817663976252
Energy: 0.8246671989497898
Energy: 0.8381817663976252
Energy: 0.8246671989508397
Energy: 0.8693022628218824
Energy: 0.8328364737662873
Energy: 0.8693022628218824
Energy: 0.8328364737662873
Energy: 0.8693022628215736
Energy: 0.8328364737665962
Energy: 1.052450130346549
Energy: 0.8754479218228646
Energy: 1.0524501303469196
Energy: 0.8754479218235439
Energy: 1.052450130346549
Energy: 0.8754479218228646
Energy: 1.221874756182219
Energy: 0.9029402007637466
Energy: 1.2218747561825896
Energy: 0.9029402007657849
Energy: 1.221874756182219
Energy: 0.9029402007637466
Energy: 0.8916734975365065
Energy: 0.8664446682574617
Energy: 0.8916734975361359
Energy: 0.8664446682574617
Energy: 0.8916734975365065
Energy: 0.8664446682574617
Energy: 0.8437539150304982
Energy: 0.8187544148166367
Energy: 0.8437539150304982
Energy: 0.8187544148163279
Energy: 0.8437539150301275
Energy: 0.8187544148163279
Energy: 1.0559528756047738
Energy: 0.8479504059640259
Energy: 1.0559528756037238
Energy: 0.8479504059637172
Energy: 1.0559528756037238
Energy: 0.8479504059640259
Energy: 0.9164668015694276
Energy: 0.9492248822774153
Energy: 0.9164668015690569
Energy: 0.9492248823008853
Energy: 0.9164668015690569
Energy: 0.949224882286618
Energy: 0.7783431190969766
Energy: 0.9558355460585387
Energy: 0.7783431190973471
Energy: 0.9558355460589093
Energy: 0.7783431190980264
Energy: 0.9558355460585387
Energy: 0.7581586823241588
Energy: 0.8425177292610696
Energy: 0.7581586823241588
Energy: 0.8425177292610696
Energy: 0.7581586823238501
Energy: 0.8425177292610696
Energy: 1.155223801656215
Energy: 0.7773357960926618
Energy: 1.155223801656215
Energy: 0.7773357960929707
Energy: 1.1552238016555356
Energy: 0.7773357960926618
Energy: 0.7267099751356898
Energy: 1.0077765840340305
Energy: 0.7267099751356898
Energy: 1.0077765840336599
Energy: 0.7267099751346399
Energy: 1.0077765840340305
Energy: 0.8358288322830547
Energy: 0.9558891328083472
Energy: 0.8358288322833637
Energy: 0.9558891328087179
Energy: 0.8358288322830547
Energy: 0.9558891328083472
Energy: 0.8672741990387065
Energy: 0.8659533608667243
Energy: 0.8672741990387065
Energy: 0.8659533608667243
Energy: 0.867274199038336
Energy: 0.8659533608667243
Energy: 1.1020834036542035
Energy: 0.7910622066343727
Energy: 1.1020834036542035
Energy: 0.7910622066343727
Energy: 1.1020834036542035
Energy: 0.7910622066343727
Energy: 0.7208527916205946
Energy: 1.0208136347060752
Energy: 0.7208527916202241
Energy: 1.0208136347057046
Energy: 0.7208527916199152
Energy: 1.0208136347053958
Energy: 0.8797882310109368
Energy: 0.8665527890502879
Energy: 0.8797882310109368
Energy: 0.8665527890496084
Energy: 0.8797882310105664
Energy: 0.8665527890499173
Energy: 0.9373152203596411
Energy: 0.8469089879730087
Energy: 0.9373152203603204
Energy: 0.8469089879740587
Energy: 0.9373152203609999
Energy: 0.8469089879733793
Energy: 1.045684714512472
Energy: 0.8500057515697426
Energy: 1.0456847145114219
Energy: 0.8500057515704219
Energy: 1.0456847145114219
Energy: 0.8500057515704219
Energy: 0.7826664295597763
Energy: 0.9706808908729636
Energy: 0.7826664295597763
Energy: 0.9706808908726547
Energy: 0.7826664295597763
Energy: 0.9706808908729636
Energy: 0.7920736964872328
Energy: 0.8448495180961252
Energy: 0.792073696485874
Energy: 0.8448495180961252
Energy: 0.7920736964862445
Energy: 0.8448495180964957
Energy: 0.8729753130315749
Energy: 0.8595021798739108
Energy: 0.8729753130312663
Energy: 0.8595021798736019
Energy: 0.8729753130305867
Energy: 0.8595021798736019
Energy: 1.086911747834891
Energy: 0.9790717400584733
Energy: 1.0869117478355703
Energy: 0.9790717400561264
Energy: 1.086911747834891
Energy: 0.9790717400584733
Energy: 0.8422142507045313
Energy: 0.9466430520162603
Energy: 0.8422142507038519
Energy: 0.9466430520159516
Energy: 0.8422142507034814
Energy: 0.9466430520162603

minimum gb energy = 0.7208527916199152 eV
minimum distance =  2.30564057115419 Angstroms
sigma value = 81


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

Energy: 0.9308231270798843
Energy: 0.8822241422514534
Energy: 0.9308231270798843
Energy: 0.8822241422514534
Energy: 0.9308231270798843
Energy: 0.8822241422519197
Energy: 0.7468069975744455
Energy: 0.9366572276302104
Energy: 0.7468069975749116
Energy: 0.9366572276302104
Energy: 0.7468069975744455
Energy: 0.9366572276302104
Energy: 0.8452987155187969
Energy: 0.920526056077631
Energy: 0.8452987155187969
Energy: 0.9205260560771648
Energy: 0.8452987155187969
Energy: 0.9205260560780972
Energy: 0.8227619749736966
Energy: 0.8578546318602072
Energy: 0.8227619749741627
Energy: 0.8578546318606733
Energy: 0.822761974972764
Energy: 0.8578546318602072
Energy: 0.7476077562652513
Energy: 0.7788409477466943
Energy: 0.7476077562661838
Energy: 0.7788409477466943
Energy: 0.7476077562652513
Energy: 0.7788409477471606
Energy: 0.7786238894334536
Energy: 0.8497604867802991
Energy: 0.778623889432521
Energy: 0.8497604867802991
Energy: 0.7786238894329873
Energy: 0.8497604867802991
Energy: 0.7562353840682643
Energy: 0.938715868338202
Energy: 0.756235384067798
Energy: 0.9387158683386683
Energy: 0.7562353840682643
Energy: 0.938715868338202
Energy: 0.7470915901894781
Energy: 0.9953548257795138
Energy: 0.7470915901894781
Energy: 0.9953548257795138
Energy: 0.7470915901894781
Energy: 0.9953548257799801
Energy: 0.911923011153693
Energy: 0.8884994329228099
Energy: 0.911923011153693
Energy: 0.8884994329228099
Energy: 0.9119230111532268
Energy: 0.8884994329228099
Energy: 0.749446734478962
Energy: 1.179834019449543
Energy: 0.7494467344784959
Energy: 1.1798340194500092
Energy: 0.7494467344794282
Energy: 1.1798340194500092
Energy: 0.7716722546050346
Energy: 1.0124861441952404
Energy: 0.7716722546050346
Energy: 1.0124861441952404
Energy: 0.7716722546050346
Energy: 1.0124861441952404
Energy: 0.8503979378550639
Energy: 0.8778236519050289
Energy: 0.8503979378545977
Energy: 0.8778236519050289
Energy: 0.8503979378550639
Energy: 0.8778236519054952
Energy: 0.7491199747514573
Energy: 0.7640274454316028
Energy: 0.7491199747519236
Energy: 0.7640274454325353
Energy: 0.7491199747509911
Energy: 0.7640274454316028
Energy: 0.8443975890079958
Energy: 0.922082360262787
Energy: 0.844397589008462
Energy: 0.9220823602641857
Energy: 0.8443975890079958
Energy: 0.9220823602618545
Energy: 1.0421359279342712
Energy: 0.9150587489446562
Energy: 1.0421359279342712
Energy: 0.9150587489446562
Energy: 1.0421359279338052
Energy: 0.9150587489441899
Energy: 0.9269012195917103
Energy: 0.7772831701008814
Energy: 0.9269012195917103
Energy: 0.7772831701013476
Energy: 0.9269012195917103
Energy: 0.7772831701013476
Energy: 0.9008744951431994
Energy: 0.8538677796592635
Energy: 0.9008744951427331
Energy: 0.8538677796592635
Energy: 0.9008744951427331
Energy: 0.8538677796592635
Energy: 0.7378910113591146
Energy: 0.9197981571254922
Energy: 0.7378910113595808
Energy: 0.919798157125026
Energy: 0.7378910113595808
Energy: 0.9197981571254922
Energy: 0.7943994431669879
Energy: 0.8756511328596874
Energy: 0.7943994431688528
Energy: 0.8756511328596874
Energy: 0.7943994431646568
Energy: 0.8756511328596874
Energy: 0.8692175250623034
Energy: 0.9119135135619065
Energy: 0.8692175250627697
Energy: 0.9119135135619065
Energy: 0.8692175250623034
Energy: 0.9119135135619065
Energy: 0.8755033215355159
Energy: 0.7491811166706326
Energy: 0.8755033215350497
Energy: 0.7491811166710989
Energy: 0.8755033215345834
Energy: 0.7491811166710989
Energy: 0.775827118694705
Energy: 0.8175083397167588
Energy: 0.775827118694705
Energy: 0.8175083397167588
Energy: 0.7758271186937725
Energy: 0.8175083397167588
Energy: 0.850988315641272
Energy: 0.7899858123439502
Energy: 0.8509883156408058
Energy: 0.7899858123434839
Energy: 0.850988315641272
Energy: 0.7899858123434839
Energy: 0.995431311689602
Energy: 0.7727106931540096
Energy: 0.9954313116900683
Energy: 0.7727106931544757
Energy: 0.9954313116900683
Energy: 0.7727106931544757
Energy: 0.8841796348511661
Energy: 0.9076085261329788
Energy: 0.8841796348502337
Energy: 0.9076085261329788
Energy: 0.8841796348507
Energy: 0.9076085261329788
Energy: 0.9388133681508963
Energy: 0.9120567950982836
Energy: 0.9388133681513626
Energy: 0.9120567950982836
Energy: 0.9388133681518288
Energy: 0.9120567950982836
Energy: 0.7317318978056677
Energy: 0.8241130604727243
Energy: 0.7317318978056677
Energy: 0.8241130604731904
Energy: 0.7317318978056677
Energy: 0.8241130604727243
Energy: 0.8914840482439749
Energy: 0.8536816815401844
Energy: 0.891484048244441
Energy: 0.8536816815401844
Energy: 0.891484048244441
Energy: 0.8536816815406507
Energy: 0.936988076102378
Energy: 0.7515087967365591
Energy: 0.936988076102378
Energy: 0.7515087967365591
Energy: 0.936988076102378
Energy: 0.7515087967365591
Energy: 1.0247711868332656
Energy: 0.7564901697878829
Energy: 1.0247711868327993
Energy: 0.7564901697883492
Energy: 1.0247711868327993
Energy: 0.7564901697878829
Energy: 0.8661213913749323
Energy: 1.042091150072175
Energy: 0.8661213913749323
Energy: 1.0420911500731072
Energy: 0.8661213913749323
Energy: 1.042091150072175
Energy: 0.7771838595924977
Energy: 0.7728134638653735
Energy: 0.7771838595924977
Energy: 0.772813463866306
Energy: 0.7771838595920314
Energy: 0.7728134638653735
Energy: 0.8503874588798586
Energy: 0.8676146531226199
Energy: 0.8503874588803247
Energy: 0.867614653123086
Energy: 0.8503874588798586
Energy: 0.8676146531226199
Energy: 0.9359064789751662
Energy: 0.8613590436060277
Energy: 0.9359064789746999
Energy: 0.8613590436060277
Energy: 0.9359064789751662
Energy: 0.8613590436060277
Energy: 0.7510237936267211
Energy: 1.1919844001393618
Energy: 0.7510237936267211
Energy: 1.191984400139828
Energy: 0.7510237936267211
Energy: 1.1919844001393618
Energy: 0.9015974818197809
Energy: 0.8685406810622673
Energy: 0.9015974818197809
Energy: 0.8685406810622673
Energy: 0.9015974818197809
Energy: 0.8685406810622673
Energy: 0.7931001889147583
Energy: 0.8767297473486109
Energy: 0.7931001889147583
Energy: 0.8767297473486109
Energy: 0.7931001889156908
Energy: 0.8767297473486109
Energy: 0.8166452269139667
Energy: 0.945047489967497
Energy: 0.8166452269139667
Energy: 0.945047489967497
Energy: 0.8166452269135005
Energy: 0.945047489967497

minimum gb energy = 0.7317318978056677 eV
minimum distance =  2.31492105249787 Angstroms
sigma value = 43


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

Energy: 0.9757763939034115
Energy: 0.7499308509286399
Energy: 0.9757763939034115
Energy: 0.7499308509280672
Energy: 0.9757763939034115
Energy: 0.7499308509280672
Energy: 0.9527029924065193
Energy: 0.7802360921429484
Energy: 0.9527029924059467
Energy: 0.7802360921429484
Energy: 0.9527029924059467
Energy: 0.7802360921435211
Energy: 0.8190981301068367
Energy: 0.9748777254433263
Energy: 0.8190981301068367
Energy: 0.9748777254427536
Energy: 0.8190981301068367
Energy: 0.9748777254433263
Energy: 0.9018048214025001
Energy: 0.8419461416641688
Energy: 0.9018048214025001
Energy: 0.8419461416641688
Energy: 0.9018048214025001
Energy: 0.8419461416641688
Energy: 0.8514010186751165
Energy: 0.8544989047171047
Energy: 0.8514010186751165
Energy: 0.8544989047171047
Energy: 0.8514010186751165
Energy: 0.8544989047153867
Energy: 0.8756336830325592
Energy: 0.8555580040080644
Energy: 0.8756336830325592
Energy: 0.8555580040092097
Energy: 0.8756336830325592
Energy: 0.8555580040086371
Energy: 0.9328758293784881
Energy: 1.0156825205339435
Energy: 0.9328758293784881
Energy: 1.0156825205339435
Energy: 0.9328758293779154
Energy: 1.0156825205339435
Energy: 0.9052154851166054
Energy: 0.8029902139045013
Energy: 0.9052154851171782
Energy: 0.8029902139045013
Energy: 0.9052154851166054
Energy: 0.8029902139045013
Energy: 0.8775689798403129
Energy: 0.7946067154612466
Energy: 0.8775689798403129
Energy: 0.7946067154612466
Energy: 0.8775689798403129
Energy: 0.7946067154612466
Energy: 0.8030915394342181
Energy: 0.9210343926169701
Energy: 0.8030915394347906
Energy: 0.9210343926169701
Energy: 0.8030915394347906
Energy: 0.9210343926169701
Energy: 0.968217625277675
Energy: 0.8674293999582641
Energy: 0.9682176252771023
Energy: 0.8674293999582641
Energy: 0.968217625277675
Energy: 0.8674293999576915
Energy: 0.9393079506236718
Energy: 0.7903100813576159
Energy: 0.9393079506242444
Energy: 0.7903100781657855
Energy: 0.9393079506242444
Energy: 0.7903100782155825
Energy: 0.8158838245124276
Energy: 0.9443034731131849
Energy: 0.815883824511855
Energy: 0.9443034731126123
Energy: 0.8158838245124276
Energy: 0.9443034731126123
Energy: 0.82881482318581
Energy: 1.0128450712160637
Energy: 0.82881482318581
Energy: 1.0128450712160637
Energy: 0.82881482318581
Energy: 1.0128450712166364
Energy: 0.9443299270824065
Energy: 0.8407535272029221
Energy: 0.9443299270824065
Energy: 0.8407535272029221
Energy: 0.9443299270824065
Energy: 0.8407535272023494
Energy: 0.8473644635628605
Energy: 0.8041589820757402
Energy: 0.8473644635622878
Energy: 0.8041589820751674
Energy: 0.8473644635622878
Energy: 0.8041589820757402
Energy: 0.9314850848045841
Energy: 0.8686338846054344
Energy: 0.9314850848040114
Energy: 0.8686338846060072
Energy: 0.9314850848045841
Energy: 0.8686338846060072
Energy: 0.9542752734637645
Energy: 0.8800886575859519
Energy: 0.9542752734637645
Energy: 0.8800886575859519
Energy: 0.9542752734631917
Energy: 0.8800886575859519
Energy: 0.9540223707790442
Energy: 0.8803988815878401
Energy: 0.9540223707796169
Energy: 0.8803988815872673
Energy: 0.9540223707790442
Energy: 0.8803988815872673
Energy: 0.9329981315627881
Energy: 0.8640083579404385
Energy: 0.9329981315627881
Energy: 0.8640083579404385
Energy: 0.9329981315627881
Energy: 0.8640083579398657
Energy: 0.8466776689923383
Energy: 0.8196031621786413
Energy: 0.8466776689923383
Energy: 0.8196031621780686
Energy: 0.8466776689929111
Energy: 0.8196031621780686
Energy: 0.9436660720650337
Energy: 0.7683317056838131
Energy: 0.9436660720650337
Energy: 0.7683317056838131
Energy: 0.9436660720650337
Energy: 0.7683317056838131
Energy: 0.8269084591676915
Energy: 0.9218356595722091
Energy: 0.8269084591682642
Energy: 0.9218356595722091
Energy: 0.8269084591682642
Energy: 0.9218356595722091
Energy: 0.8169291193912024
Energy: 0.9366460935923332
Energy: 0.8169291193929205
Energy: 0.9366460935923332
Energy: 0.8169291193929205
Energy: 0.9366460935917604
Energy: 0.9386092163547334
Energy: 0.823090274002892
Energy: 0.9386092163547334
Energy: 0.823090274002892
Energy: 0.9386092163553061
Energy: 0.823090274002892
Energy: 0.9339473540967077
Energy: 0.8417692393286624
Energy: 0.9339473541006905
Energy: 0.8417692393286624
Energy: 0.9339473540932716
Energy: 0.8417692393292351
Energy: 0.8503790840021322
Energy: 0.8843926521620779
Energy: 0.8503790840021322
Energy: 0.8843926521620779
Energy: 0.8503790840021322
Energy: 0.8843926521609324
Energy: 0.8830553685554047
Energy: 0.7939960467201619
Energy: 0.8830553685536865
Energy: 0.7939960467207346
Energy: 0.8830553685542593
Energy: 0.7939960467201619
Energy: 0.9385741133053894
Energy: 0.8095383690733869
Energy: 0.9385741133053894
Energy: 0.8095383690733869
Energy: 0.9385741133053894
Energy: 0.8095383690733869
Energy: 0.908354217692278
Energy: 0.9424848056889871
Energy: 0.908354217692278
Energy: 0.9424848056889871
Energy: 0.9083542176928507
Energy: 0.9424848056889871
Energy: 0.8146849560777194
Energy: 0.9301848970538645
Energy: 0.8146849560777194
Energy: 0.9301848970601642
Energy: 0.8146849560777194
Energy: 0.9301848970601642

minimum gb energy = 0.7499308509280672 eV
minimum distance =  2.32376919457585 Angstroms
sigma value = 57


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

Energy: 0.9055225447064101
Energy: 0.6964153252825621
Energy: 0.9055225447064101
Energy: 0.6964153252833035
Energy: 0.9055225447056685
Energy: 0.6964153252833035
Energy: 0.757371810470417
Energy: 0.870837170060237
Energy: 0.757371810470417
Energy: 0.8708371700609784
Energy: 0.7573718104719
Energy: 0.8708371700609784
Energy: 0.8210492403912376
Energy: 0.8647521599291106
Energy: 0.8210492403912376
Energy: 0.8647521599268861
Energy: 0.8210492403912376
Energy: 0.8647521599283691
Energy: 1.0516335862768245
Energy: 0.965407190040586
Energy: 1.0516335862768245
Energy: 0.965407190040586
Energy: 1.0516335862768245
Energy: 0.965407190040586
Energy: 0.7760031419179879
Energy: 0.7879245697990876
Energy: 0.7760031419179879
Energy: 0.7879245697998292
Energy: 0.7760031419179879
Energy: 0.7879245697998292
Energy: 0.8210938655636671
Energy: 0.75748488242196
Energy: 0.8210938655636671
Energy: 0.7574848824227014
Energy: 0.8210938655644087
Energy: 0.75748488242196
Energy: 0.906257175391093
Energy: 0.9131653329112317
Energy: 0.906257175391093
Energy: 0.9131653329104901
Energy: 0.906257175391093
Energy: 0.9131653329112317
Energy: 0.9670867107266207
Energy: 0.7616652317068874
Energy: 0.9670867107258793
Energy: 0.7616652317068874
Energy: 0.9670867107281036
Energy: 0.7616652317068874
Energy: 0.7639015956031887
Energy: 0.9504121945873828
Energy: 0.7639015956031887
Energy: 0.9504121945866412
Energy: 0.7639015956024472
Energy: 0.9504121945873828
Energy: 0.6722056256987352
Energy: 0.7585553152964062
Energy: 0.6722056256987352
Energy: 0.7585553152964062
Energy: 0.6722056256987352
Energy: 0.7585553152964062
Energy: 0.7790792205295337
Energy: 0.9519551848403536
Energy: 0.7790792205302751
Energy: 0.9519551848403536
Energy: 0.7790792205302751
Energy: 0.951955184839612
Energy: 0.8456050018917113
Energy: 0.87022738422205
Energy: 0.8456050018909698
Energy: 0.87022738422205
Energy: 0.8456050018909698
Energy: 0.87022738422205
Energy: 0.7650417510878941
Energy: 0.9506199873378198
Energy: 0.7650417510878941
Energy: 0.9506199873378198
Energy: 0.7650417510878941
Energy: 0.9506199873378198
Energy: 0.9466611802566961
Energy: 0.8911174587408865
Energy: 0.9466611802566961
Energy: 0.8911174587408865
Energy: 0.9466611802566961
Energy: 0.8911174587401449
Energy: 0.9089504338010244
Energy: 0.7624215233209122
Energy: 0.908950433801766
Energy: 0.7624215233223951
Energy: 0.908950433801766
Energy: 0.7624215233209122
Energy: 0.9261193221014812
Energy: 0.8456842237713524
Energy: 0.9261193221014812
Energy: 0.845684223772094
Energy: 0.9261193221014812
Energy: 0.845684223772094
Energy: 0.6723079452087394
Energy: 0.759782616839628
Energy: 0.6723079452094808
Energy: 0.7597826168374036
Energy: 0.6723079452087394
Energy: 0.7597826168381451
Energy: 0.7767849634089941
Energy: 0.7646148127530947
Energy: 0.7767849634089941
Energy: 0.7646148127530947
Energy: 0.7767849634097357
Energy: 0.7646148127530947
Energy: 0.6723933346321319
Energy: 0.7598728843685372
Energy: 0.6723933346313904
Energy: 0.7598728843677957
Energy: 0.6723933346321319
Energy: 0.7598728843677957
Energy: 0.9262661365302428
Energy: 0.8457154241956177
Energy: 0.9262661365302428
Energy: 0.8457154241956177
Energy: 0.9262661365302428
Energy: 0.8457154241956177
Energy: 0.9089112578526077
Energy: 0.7632014930306439
Energy: 0.9089112578526077
Energy: 0.7632014930299025
Energy: 0.9089112578518662
Energy: 0.7632014930306439
Energy: 0.946536919895001
Energy: 0.9425170112633432
Energy: 0.946536919895001
Energy: 0.9425170112633432
Energy: 0.946536919895001
Energy: 0.9425170112633432
Energy: 0.764910558867305
Energy: 0.950629937966982
Energy: 0.764910558867305
Energy: 0.950629937966982
Energy: 0.764910558867305
Energy: 0.950629937966982
Energy: 0.8455835766968836
Energy: 0.8702405183380099
Energy: 0.8455835766968836
Energy: 0.8702405183387514
Energy: 0.8455835766968836
Energy: 0.8702405183380099

minimum gb energy = 0.6722056256987352 eV
minimum distance =  2.35119247875288 Angstroms
sigma value = 17


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

Energy: 0.9819575630237181
Energy: 0.7022979888423928
Energy: 0.9819575630237181
Energy: 0.7022979888434414
Energy: 0.9819575630237181
Energy: 0.7022979888434414
Energy: 0.7852402928671776
Energy: 0.8360285266114523
Energy: 0.7852402928671776
Energy: 0.8360285266114523
Energy: 0.785240292866129
Energy: 0.8360285266114523
Energy: 0.7725643875175521
Energy: 0.8053305798381156
Energy: 0.7725643875165034
Energy: 0.8053305798381156
Energy: 0.7725643875175521
Energy: 0.8053305798381156
Energy: 0.8925223908435203
Energy: 0.901591103427753
Energy: 0.8925223908424715
Energy: 0.901591103427753
Energy: 0.8925223908435203
Energy: 0.901591103427753
Energy: 0.7661413382380932
Energy: 0.9250173787039287
Energy: 0.7661413382391417
Energy: 0.9250173787039287
Energy: 0.7661413382380932
Energy: 0.9250173787039287
Energy: 0.8713309396367033
Energy: 0.7663232916823944
Energy: 0.8713309396367033
Energy: 0.7663232916834432
Energy: 0.8713309396367033
Energy: 0.7663232916834432
Energy: 0.720619486532206
Energy: 0.6598600897392126
Energy: 0.720619486532206
Energy: 0.659860089738164
Energy: 0.7206194865364005
Energy: 0.6598600897392126
Energy: 0.7666813769189813
Energy: 0.8687219852564023
Energy: 0.7666813769189813
Energy: 0.868721985257451
Energy: 0.7666813769179327
Energy: 0.868721985257451
Energy: 0.7273540804709453
Energy: 0.9558515029448565
Energy: 0.7273540804719939
Energy: 0.9558515029448565
Energy: 0.7273540804709453
Energy: 0.9558515029448565
Energy: 0.843634720088614
Energy: 0.8278304977371389
Energy: 0.843634720088614
Energy: 0.8278304977381875
Energy: 0.843634720088614
Energy: 0.8278304977381875
Energy: 0.8516539962791249
Energy: 0.7616706979985898
Energy: 0.8516539962781002
Energy: 0.7616706979996384
Energy: 0.8516539962791249
Energy: 0.7616706979985898
Energy: 0.725846795741724
Energy: 0.9601074952151933
Energy: 0.7258467962259793
Energy: 0.9601074952141448
Energy: 0.7258467958947771
Energy: 0.9601074952151933
Energy: 0.6204087121838238
Energy: 0.8684601261512778
Energy: 0.6204087121838238
Energy: 0.8684601261512778
Energy: 0.6204087121838238
Energy: 0.8684601261512778
Energy: 0.714576943016619
Energy: 0.7376910335106429
Energy: 0.714576943016619
Energy: 0.7376910335106429
Energy: 0.714576943016619
Energy: 0.7376910335106429
Energy: 0.7087469913832195
Energy: 0.8595320436420019
Energy: 0.7087469913853168
Energy: 0.8595320436420019
Energy: 0.7087469913863655
Energy: 0.8595320436420019
Energy: 0.7091833214250376
Energy: 0.8676995508363573
Energy: 0.7091833214250376
Energy: 0.8676995508363573
Energy: 0.7091833214250376
Energy: 0.8676995508363573
Energy: 0.7136768639865714
Energy: 0.7372431977913894
Energy: 0.7136768639865714
Energy: 0.7372431977913894
Energy: 0.7136768639865714
Energy: 0.7372431977913894

minimum gb energy = 0.6204087121838238 eV
minimum distance =  2.38146977930453 Angstroms
sigma value = 17


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

Energy: 0.9251014567128544
Energy: 0.6360914013057731
Energy: 0.9251014567124495
Energy: 0.6360914013073928
Energy: 0.9251014567124495
Energy: 0.6360914013065829
Energy: 0.7552359589812256
Energy: 0.7632510746029536
Energy: 0.7552359589808207
Energy: 0.7632510746041684
Energy: 0.7552359589808207
Energy: 0.7632510746033585
Energy: 0.6840547173847379
Energy: 0.7417270070187594
Energy: 0.684054717384333
Energy: 0.7417270070179496
Energy: 0.684054717384333
Energy: 0.7417270070187594
Energy: 0.8435311303230045
Energy: 0.6733531535731143
Energy: 0.8435311303234094
Energy: 0.6733531535698748
Energy: 0.8435311303230045
Energy: 0.6733531535694699
Energy: 0.9007888612811283
Energy: 0.7711813749858141
Energy: 0.9007888612807234
Energy: 0.7711813749854091
Energy: 0.9007888612807234
Energy: 0.7711813749854091
Energy: 0.6635327843324865
Energy: 0.6431206031088161
Energy: 0.6635327843320816
Energy: 0.643120603109626
Energy: 0.6635327843320816
Energy: 0.643120603109626
Energy: 0.7554997260234468
Energy: 0.7689341375731267
Energy: 0.7554997260238517
Energy: 0.7689341375735317
Energy: 0.7554997260234468
Energy: 0.7689341375735317
Energy: 0.8088555853261877
Energy: 0.8423311865502718
Energy: 0.8088555853257828
Energy: 0.8423311865498667
Energy: 0.8088555853261877
Energy: 0.8423311865498667
Energy: 0.7686743541689023
Energy: 0.6872851226714046
Energy: 0.7686743541689023
Energy: 0.6872851226718096
Energy: 0.7686743541689023
Energy: 0.6872851226726195
Energy: 0.6450550247627402
Energy: 0.5741736652274646
Energy: 0.6450550247655749
Energy: 0.5741736652274646
Energy: 0.6450550247663848
Energy: 0.5741736652270596
Energy: 0.881195589083839
Energy: 0.8179705926533518
Energy: 0.8811955890842439
Energy: 0.8179705926533518
Energy: 0.8811955890842439
Energy: 0.8179705926533518
Energy: 0.6900929913001145
Energy: 0.9022448119929389
Energy: 0.6900929912997095
Energy: 0.9022448119929389
Energy: 0.6900929913001145
Energy: 0.9022448119925338
Energy: 0.7742345612434754
Energy: 0.7762548569923439
Energy: 0.7742345612434754
Energy: 0.7762548569923439
Energy: 0.7742345612426655
Energy: 0.7762548569919389
Energy: 0.7670081240193046
Energy: 0.7158793990396464
Energy: 0.7670081240188996
Energy: 0.7158793990400514
Energy: 0.7670081240184947
Energy: 0.7158793990400514
Energy: 0.7895519280792762
Energy: 0.8667900542711765
Energy: 0.7895519280788713
Energy: 0.8667900542732011
Energy: 0.7895519280792762
Energy: 0.8667900542679368
Energy: 0.722782965954947
Energy: 0.7563353861448452
Energy: 0.7227829659565667
Energy: 0.7563353861440353
Energy: 0.7227829659553519
Energy: 0.7563353861448452
Energy: 0.6632165833989869
Energy: 0.6565386056643209
Energy: 0.663216583398582
Energy: 0.6565386056643209
Energy: 0.6632165833993919
Energy: 0.6565386056647258
Energy: 0.875788882132634
Energy: 0.9053299669108148
Energy: 0.875788882132634
Energy: 0.9053299669104099
Energy: 0.875788882132634
Energy: 0.9053299669104099
Energy: 0.8041911473319601
Energy: 0.7558572617921395
Energy: 0.8041911473319601
Energy: 0.7558572617925444
Energy: 0.8041911473323649
Energy: 0.7558572617925444
Energy: 0.6591921780568073
Energy: 0.6435186245167257
Energy: 0.6591921780568073
Energy: 0.6435186245171307
Energy: 0.6591921780559975
Energy: 0.6435186245163208
Energy: 0.8032787191877674
Energy: 0.755910449362304
Energy: 0.8032787191873623
Energy: 0.755910449362304
Energy: 0.8032787191877674
Energy: 0.755910449362304
Energy: 0.875648358866191
Energy: 0.8636646445295064
Energy: 0.875648358866191
Energy: 0.8636646445295064
Energy: 0.8756483588665959
Energy: 0.8636646445295064
Energy: 0.6592937259953695
Energy: 0.656565891777483
Energy: 0.6592937259957744
Energy: 0.656565891777483
Energy: 0.6592937259953695
Energy: 0.656565891777483
Energy: 0.723246569048446
Energy: 0.8074046333211534
Energy: 0.723246569048446
Energy: 0.8074046333211534
Energy: 0.723246569048041
Energy: 0.8074046333211534
Energy: 0.7894061312456437
Energy: 0.8667162522064725
Energy: 0.7894061312468587
Energy: 0.8667162522068774
Energy: 0.7894061312456437
Energy: 0.8667162522072825
Energy: 0.7663336248754214
Energy: 0.7574481456369877
Energy: 0.7663336248721819
Energy: 0.7574481456377977
Energy: 0.7663336248738017
Energy: 0.7574481456377977
Energy: 0.7742275293487206
Energy: 0.7762640481418251
Energy: 0.7742275293487206
Energy: 0.7762640481414202
Energy: 0.7742275293479107
Energy: 0.7762640481414202
Energy: 0.6902955694313692
Energy: 0.9023311484693881
Energy: 0.6902955694309643
Energy: 0.9023311484693881
Energy: 0.6902955694301544
Energy: 0.902331148469793
Energy: 0.8811535973203144
Energy: 0.8179492233294756
Energy: 0.8811535973203144
Energy: 0.8179492233294756
Energy: 0.8811535973203144
Energy: 0.8179492233298805
Energy: 0.6450191480035475
Energy: 0.6907855990531715
Energy: 0.6450191480039524
Energy: 0.6907855990539814
Energy: 0.6450191480039524
Energy: 0.6907855990539814
Energy: 0.7691237266704437
Energy: 0.6872905042261352
Energy: 0.7691237266700388
Energy: 0.6872905042318046
Energy: 0.7691237266704437
Energy: 0.6872905042281601
Energy: 0.8089175384429359
Energy: 0.8423654018739274
Energy: 0.8089175384425308
Energy: 0.8423654018735225
Energy: 0.8089175384429359
Energy: 0.8423654018735225
Energy: 0.7555406667932103
Energy: 0.7617236664716539
Energy: 0.7555406667932103
Energy: 0.7617236664716539
Energy: 0.7555406667936153
Energy: 0.7617236664720588
Energy: 0.6632882731032262
Energy: 0.62945337446336
Energy: 0.6632882731032262
Energy: 0.6294533744625501
Energy: 0.6632882731036313
Energy: 0.6294533744641698
Energy: 0.900941213750999
Energy: 0.7719240955636364
Energy: 0.9009412137514039
Energy: 0.7719240955636364
Energy: 0.900941213750999
Energy: 0.7719240955640413
Energy: 0.8434270764671232
Energy: 0.6647831764704111
Energy: 0.8434270764667181
Energy: 0.6647831764704111
Energy: 0.8434270764663132
Energy: 0.6647831764704111
Energy: 0.6841560347244863
Energy: 0.7414262840546758
Energy: 0.6841560347244863
Energy: 0.7414262840550807
Energy: 0.6841560347244863
Energy: 0.7414262840542709
Energy: 0.7552601475788531
Energy: 0.7475387148881861
Energy: 0.755260147579663
Energy: 0.747538714888591
Energy: 0.755260147579258
Energy: 0.747538714888996
Energy: 0.9251014567128544
Energy: 0.6360914013086076
Energy: 0.9251014567128544
Energy: 0.6360914013069879
Energy: 0.9251014567128544
Energy: 0.6360914013086076
Energy: 0.7552359589808207
Energy: 0.745036085142254
Energy: 0.7552359589808207
Energy: 0.745036085141849
Energy: 0.7552359589808207
Energy: 0.7450360851414441
Energy: 0.6840547173847379
Energy: 0.7417270070187594
Energy: 0.684054717384333
Energy: 0.7417270070187594
Energy: 0.684054717384333
Energy: 0.7417270070187594
Energy: 0.8435311303234094
Energy: 0.6733531535731143
Energy: 0.8435311303246243
Energy: 0.6733531535714946
Energy: 0.8435311303234094
Energy: 0.6733531535731143
Energy: 0.9007888612807234
Energy: 0.7711813749854091
Energy: 0.9007888612807234
Energy: 0.7711813749850042
Energy: 0.9007888612807234
Energy: 0.7711813749845993

minimum gb energy = 0.5741736652270596 eV
minimum distance =  2.32339814565924 Angstroms
sigma value = 57


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

Energy: 0.8813554375429409
Energy: 0.756759870420826
Energy: 0.8813554375429409
Energy: 0.7567598704201668
Energy: 0.8813554375422814
Energy: 0.756759870420826
Energy: 0.6830353680627269
Energy: 0.6898226370056807
Energy: 0.6830353680633864
Energy: 0.6898226370076587
Energy: 0.6830353680633864
Energy: 0.6898226370063401
Energy: 0.6609553871409221
Energy: 0.6863560721259998
Energy: 0.6609553871409221
Energy: 0.6863560721259998
Energy: 0.6609553871409221
Energy: 0.6863560721259998
Energy: 0.8109652591878749
Energy: 0.6400610907684011
Energy: 0.8109652591885342
Energy: 0.6400610907684011
Energy: 0.8109652591885342
Energy: 0.6400610907677418
Energy: 0.815715260297042
Energy: 0.6581728750589337
Energy: 0.8157152602977014
Energy: 0.6581728750582744
Energy: 0.8157152602977014
Energy: 0.6581728750589337
Energy: 0.6226268878554821
Energy: 0.5769107078097347
Energy: 0.6226268878548229
Energy: 0.5769107078097347
Energy: 0.6226268878554821
Energy: 0.5769107078097347
Energy: 0.8190297961981093
Energy: 0.7060507997894104
Energy: 0.81902979619745
Energy: 0.7060507997900699
Energy: 0.8190297961981093
Energy: 0.7060507997900699
Energy: 0.7412098273056889
Energy: 0.7742262511966613
Energy: 0.7412098273063482
Energy: 0.7742262511973208
Energy: 0.7412098273063482
Energy: 0.7742262511973208
Energy: 0.6772051712739798
Energy: 0.5784252095163069
Energy: 0.6772051712746391
Energy: 0.5784252095149882
Energy: 0.6772051712746391
Energy: 0.5784252095149882
Energy: 0.6708428755666588
Energy: 0.5980220048654782
Energy: 0.6708428755659995
Energy: 0.5980220048661375
Energy: 0.6708428755659995
Energy: 0.5980220048661375
Energy: 0.7989352670628362
Energy: 0.7648110155055212
Energy: 0.7989352670634956
Energy: 0.764811015504862
Energy: 0.7989352670628362
Energy: 0.764811015504862
Energy: 0.6036573192075205
Energy: 0.7868149700612048
Energy: 0.6036573192075205
Energy: 0.7868149700612048
Energy: 0.6036573192081799
Energy: 0.7868149700612048
Energy: 0.6704607953437839
Energy: 0.6592208000043227
Energy: 0.6704607953444434
Energy: 0.6592208000043227
Energy: 0.6704607953451026
Energy: 0.6592208000036633
Energy: 0.8083794526564164
Energy: 0.7392985542474553
Energy: 0.8083794526564164
Energy: 0.7392985542461367
Energy: 0.8083794526564164
Energy: 0.7392985542481147
Energy: 0.6466833414053976
Energy: 0.8610604757181158
Energy: 0.6466833414047383
Energy: 0.8610604757181158
Energy: 0.6466833414053976
Energy: 0.8610604757181158
Energy: 0.7048471676567583
Energy: 0.7101410633110096
Energy: 0.7048471676567583
Energy: 0.7101410633116689
Energy: 0.7048471676567583
Energy: 0.7101410633116689
Energy: 0.7192188290805527
Energy: 0.7112065649909998
Energy: 0.7192188290818116
Energy: 0.7112065649909998
Energy: 0.7192188290805527
Energy: 0.7112065649909998
Energy: 0.6270447106933726
Energy: 0.8603626011152449
Energy: 0.6270447106927133
Energy: 0.8603626011152449
Energy: 0.6270447106927133
Energy: 0.8603626011152449
Energy: 0.6942956943117898
Energy: 0.7219468947148653
Energy: 0.6942956943111304
Energy: 0.7219468947148653
Energy: 0.6942956943111304
Energy: 0.7219468947148653
Energy: 0.6790216887076308
Energy: 0.6239473534186434
Energy: 0.6790216887076308
Energy: 0.6239473534179841
Energy: 0.6790216887082903
Energy: 0.6239473534179841
Energy: 0.7129032793487862
Energy: 0.8480133365962496
Energy: 0.7129032793494454
Energy: 0.8480133365962496
Energy: 0.7129032793487862
Energy: 0.8480133365962496
Energy: 0.6380781817370121
Energy: 0.7203183172680713
Energy: 0.6380781817376715
Energy: 0.7203183172680713
Energy: 0.6380781817383309
Energy: 0.7203183172680713
Energy: 0.6051805667633049
Energy: 0.600211667851325
Energy: 0.6051805667633049
Energy: 0.600211667851325
Energy: 0.6051805667633049
Energy: 0.600211667851325
Energy: 0.6222984370672276
Energy: 0.7202257613891768
Energy: 0.6222984370672276
Energy: 0.7202257613891768
Energy: 0.6222984370659089
Energy: 0.7202257613898362
Energy: 0.7370125109863114
Energy: 0.8353536902876184
Energy: 0.7370125109863114
Energy: 0.8353536902862996
Energy: 0.7370125109869707
Energy: 0.8353536902882777
Energy: 0.5868817558851722
Energy: 0.6004898887060978
Energy: 0.586881755886491
Energy: 0.6004898887060978
Energy: 0.5868817558858316
Energy: 0.6004898887060978
Energy: 0.6461367101180079
Energy: 0.7206557688764434
Energy: 0.6461367101180079
Energy: 0.7206557688757842
Energy: 0.6461367101173485
Energy: 0.7206557688757842

minimum gb energy = 0.5769107078097347 eV
minimum distance =  2.33975303285926 Angstroms
sigma value = 43


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

Energy: 0.8806942222354007
Energy: 0.6551908936144056
Energy: 0.8806942222354007
Energy: 0.6551908936139252
Energy: 0.8806942222354007
Energy: 0.6551908936139252
Energy: 0.6194223504038714
Energy: 0.6188047569324632
Energy: 0.6194223504014693
Energy: 0.6188047569319828
Energy: 0.6194223504024301
Energy: 0.6188047569343849
Energy: 0.5780913437034362
Energy: 0.6231063394039087
Energy: 0.5762575313145992
Energy: 0.623106339404389
Energy: 0.5780913437034362
Energy: 0.6231063394039087
Energy: 0.7866470019620497
Energy: 0.554088733804745
Energy: 0.7866470019620497
Energy: 0.5540887338052254
Energy: 0.7866470019620497
Energy: 0.5540887338061861
Energy: 0.7136938360773444
Energy: 0.6627989884283855
Energy: 0.7136938360778248
Energy: 0.6627989884283855
Energy: 0.713693836076864
Energy: 0.6627989884283855
Energy: 0.5399505843451134
Energy: 0.5825013259910138
Energy: 0.5399505843451134
Energy: 0.582501325990053
Energy: 0.5399505843451134
Energy: 0.5825013259914942
Energy: 0.7308491430980114
Energy: 0.5938469459554215
Energy: 0.7308491430984918
Energy: 0.5938469459549411
Energy: 0.7308491430984918
Energy: 0.5938469459549411
Energy: 0.7322619473305539
Energy: 0.6413498883421811
Energy: 0.7322619473310344
Energy: 0.6413498883421811
Energy: 0.7322619473305539
Energy: 0.6413498883421811
Energy: 0.5159149739283041
Energy: 0.5730914968025326
Energy: 0.5159149739283041
Energy: 0.5730914968020522
Energy: 0.5159149739283041
Energy: 0.5730914968025326
Energy: 0.770456503748547
Energy: 0.5746751949260313
Energy: 0.770456503748547
Energy: 0.5746751949260313
Energy: 0.770456503748547
Energy: 0.5746751949260313
Energy: 0.6662451776105044
Energy: 0.676222574961902
Energy: 0.6662451776105044
Energy: 0.676222574961902
Energy: 0.6662451776105044
Energy: 0.6762225749623825
Energy: 0.49771257891649423
Energy: 0.5723132053327077
Energy: 0.4977125789169747
Energy: 0.5723132053331881
Energy: 0.4977125789169747
Energy: 0.5723132053331881
Energy: 0.5841862814465179
Energy: 0.4887100236316649
Energy: 0.5841862814460375
Energy: 0.48871002363118443
Energy: 0.584186281447959
Energy: 0.4887100236316649
Energy: 0.6946378271238823
Energy: 0.6618491273493508
Energy: 0.6946378271238823
Energy: 0.6618491273493508
Energy: 0.6946378271238823
Energy: 0.6618491273493508
Energy: 0.5729527668134379
Energy: 0.7509372729133654
Energy: 0.5729527668134379
Energy: 0.7509372729133654
Energy: 0.5729527668134379
Energy: 0.7509372729133654
Energy: 0.5998874859095257
Energy: 0.5375921168658042
Energy: 0.5998874859090453
Energy: 0.5375921168662846
Energy: 0.5998874859095257
Energy: 0.5375921168658042
Energy: 0.7007803808758837
Energy: 0.6603690157770726
Energy: 0.7007803808763203
Energy: 0.6603690157765923
Energy: 0.7007803808763203
Energy: 0.6603690157770726
Energy: 0.5255573475915943
Energy: 0.7635185776660216
Energy: 0.5255573475920746
Energy: 0.7635185776660216
Energy: 0.5255573475930354
Energy: 0.7635185776655412
Energy: 0.581987599656892
Energy: 0.5749982024559828
Energy: 0.5819875996564114
Energy: 0.5749982024564632
Energy: 0.5819875996564114
Energy: 0.5749982024564632
Energy: 0.738725249435036
Energy: 0.6942489059370498
Energy: 0.738725249435036
Energy: 0.6942489059370498
Energy: 0.738725249435036
Energy: 0.6942489059370498
Energy: 0.5656000524795387
Energy: 0.8213680377242515
Energy: 0.5656000524800191
Energy: 0.8213680377242515
Energy: 0.5656000524800191
Energy: 0.8213680377242515
Energy: 0.6320876280340872
Energy: 0.6183977658536041
Energy: 0.6320876280340872
Energy: 0.6183977658540845
Energy: 0.6320876280340872
Energy: 0.6183977658536041
Energy: 0.7071313516443071
Energy: 0.6077808573656902
Energy: 0.7071313516433463
Energy: 0.6077808573656902
Energy: 0.7071313516447876
Energy: 0.6077808573661707
Energy: 0.5966748073184839
Energy: 0.8212811345352025
Energy: 0.5966748073184839
Energy: 0.8212811345352025
Energy: 0.5966748073184839
Energy: 0.8212811345342417
Energy: 0.5900783323376774
Energy: 0.618529374289693
Energy: 0.590078332337197
Energy: 0.6185293742892126
Energy: 0.5900783323376774
Energy: 0.618529374289693
Energy: 0.5932113612098625
Energy: 0.54636581210962
Energy: 0.5932113612089017
Energy: 0.5463658121101004
Energy: 0.5932113612098625
Energy: 0.54636581210962
Energy: 0.5552525547164069
Energy: 0.7399959732140049
Energy: 0.5552525547164069
Energy: 0.7399959732144853
Energy: 0.5552525547164069
Energy: 0.7399959732140049
Energy: 0.5697680514524518
Energy: 0.5782700937976138
Energy: 0.5697680514524518
Energy: 0.5782700937980942
Energy: 0.5697680514524518
Energy: 0.5782700937985746
Energy: 0.503258978305994
Energy: 0.5135376965555306
Energy: 0.503258978305994
Energy: 0.5135376965550502
Energy: 0.5032589783064744
Energy: 0.5135376965550502
Energy: 0.5787424399024297
Energy: 0.6950850753728124
Energy: 0.5787424399024297
Energy: 0.6950850753732929
Energy: 0.5787424399019493
Energy: 0.6950850753732929
Energy: 0.5624721058508934
Energy: 0.7281297333258515
Energy: 0.5624721058499327
Energy: 0.7281297333263319
Energy: 0.5624721058508934
Energy: 0.7281297333258515
Energy: 0.5040153651521548
Energy: 0.4987594805287799
Energy: 0.5040153651516744
Energy: 0.4987594805287799
Energy: 0.5040153651507137
Energy: 0.4987594805287799
Energy: 0.4941855899818966
Energy: 0.5959465672976869
Energy: 0.49418558998141626
Energy: 0.5959465672986478
Energy: 0.49418558998141626
Energy: 0.5959465672976869
Energy: 0.677948254777098
Energy: 0.7369579417969652
Energy: 0.677948254777098
Energy: 0.7369579417964848
Energy: 0.677948254777098
Energy: 0.7369579417964848
Energy: 0.5691680792428587
Energy: 0.5523124926787399
Energy: 0.5691680792428587
Energy: 0.5523124926782595
Energy: 0.5691680792428587
Energy: 0.5523124926782595
Energy: 0.5212951591543005
Energy: 0.5967755311263586
Energy: 0.5212951591543005
Energy: 0.5967755311263586
Energy: 0.5212951591543005
Energy: 0.5967755311263586

minimum gb energy = 0.48871002363118443 eV
minimum distance =  2.31895341199926 Angstroms
sigma value = 81


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

Energy: 0.023838581222802815
Energy: 0.05564459968961787
Energy: 0.023838581222802815
Energy: 0.05564459968961787
Energy: 0.023838581222802815
Energy: 0.05564459968961787
Energy: 0.35065992896348824
Energy: 0.025103757938933765
Energy: 0.35065992896348824
Energy: 0.025103757884235176
Energy: 0.35065992896348824
Energy: 0.025103757953054702
Energy: 0.3506679444856881
Energy: 0.02463590870950961
Energy: 0.3506679444856881
Energy: 0.02463590870950961
Energy: 0.3506679444856881
Energy: 0.02463590870950961
Energy: 0.023838581222802815
Energy: 0.05564459968961787
Energy: 0.023838581222802815
Energy: 0.05564459968961787
Energy: 0.023838581222802815
Energy: 0.05564459968961787
Energy: 0.35065992896348824
Energy: 0.025103758083613224
Energy: 0.35065992896348824
Energy: 0.025103758117130403
Energy: 0.35065992896348824
Energy: 0.025103758104774575
Energy: 0.3506679444856881
Energy: 0.02463590870950961
Energy: 0.3506679444856881
Energy: 0.02463590870950961
Energy: 0.3506679444856881
Energy: 0.02463590870950961
Energy: 0.023838581222802815
Energy: 0.05564459968961787
Energy: 0.023838581222802815
Energy: 0.05564459968961787
Energy: 0.023838581222802815
Energy: 0.05564459968961787
Energy: 0.35065992896348824
Energy: 0.025103758268870333
Energy: 0.35065992896348824
Energy: 0.025103758237118273
Energy: 0.35065992896348824
Energy: 0.025103758238883393
Energy: 0.3506679444856881
Energy: 0.02463590870774449
Energy: 0.3506679444856881
Energy: 0.024635908705979367
Energy: 0.3506679444856881
Energy: 0.024635908705979367
Energy: 0.023838581222802815
Energy: 0.05564459968961787
Energy: 0.023838581222802815
Energy: 0.05564459968961787
Energy: 0.023838581222802815
Energy: 0.05564459968961787

minimum gb energy = 0.023838581222802815 eV
minimum distance =  2.53662869868376 Angstroms
sigma value = 3


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

Energy: 0.7635458261374348
Energy: 0.48842211295780713
Energy: 0.7635458261374348
Energy: 0.48842211295780713
Energy: 0.7635458261374348
Energy: 0.48842211295780713
Energy: 0.5407935077962345
Energy: 0.511563819494046
Energy: 0.5407935077962345
Energy: 0.5115638194945742
Energy: 0.5407935077967626
Energy: 0.5115638194945742
Energy: 0.5610416204866743
Energy: 0.5045719774708066
Energy: 0.5610416204866743
Energy: 0.5045719774702785
Energy: 0.5610416204866743
Energy: 0.5045719774702785
Energy: 0.6888967706444065
Energy: 0.5233965911596744
Energy: 0.6888967706444065
Energy: 0.5233965911596744
Energy: 0.68889677064335
Energy: 0.5233965911596744
Energy: 0.5518675443994168
Energy: 0.5548761475402252
Energy: 0.5518675443999449
Energy: 0.5548761475349431
Energy: 0.5518675443999449
Energy: 0.5548761475386406
Energy: 0.5651124870190931
Energy: 0.5531718338345022
Energy: 0.5651124870196212
Energy: 0.5531718338334458
Energy: 0.5651124870196212
Energy: 0.5531718338334458
Energy: 0.6421779300001038
Energy: 0.5770103495900284
Energy: 0.6421779300001038
Energy: 0.5770103495900284
Energy: 0.6421779300001038
Energy: 0.5770103495905565
Energy: 0.5441767631530013
Energy: 0.5535542138134049
Energy: 0.5441767631530013
Energy: 0.5535542138134049
Energy: 0.5441767631530013
Energy: 0.5535542138144613
Energy: 0.5238448593894613
Energy: 0.5760472446911815
Energy: 0.5238448593894613
Energy: 0.576047244692238
Energy: 0.5238448593894613
Energy: 0.5760472446927661
Energy: 0.6535508541472298
Energy: 0.5474440900247204
Energy: 0.6535508541472298
Energy: 0.5474440900247204
Energy: 0.6535508541472298
Energy: 0.5474440900247204
Energy: 0.5648857742432598
Energy: 0.5539014558579691
Energy: 0.5648857742437882
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Energy: 0.5539014558579691
Energy: 0.5770387293335058
Energy: 0.6197965687373511
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Energy: 0.6197965687368229
Energy: 0.5770387293329775
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Energy: 0.6403366099608397
Energy: 0.5297637686310394
Energy: 0.640336609961368
Energy: 0.5297637686310394
Energy: 0.640336609961368
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Energy: 0.49097284329833146
Energy: 0.6784121597498907
Energy: 0.49097284329833146
Energy: 0.6784121597504189
Energy: 0.4909728432978033
Energy: 0.6784121597498907
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Energy: 0.5592041155423387
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Energy: 0.5592041155418106
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Energy: 0.5592041155529032
Energy: 0.6434357861074462
Energy: 0.5337917439312603
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Energy: 0.6434357861074462
Energy: 0.5337917439312603
Energy: 0.4845251165133424
Energy: 0.7814761205832448
Energy: 0.4845251165128142
Energy: 0.7814761205832448
Energy: 0.4845251165117578
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Energy: 0.5059087279575181
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Energy: 0.5059087279564617
Energy: 0.5351133802896993
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Energy: 0.5859105469935568
Energy: 0.5944286214720106
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Energy: 0.5944286214720106
Energy: 0.5555614207938309
Energy: 0.7131123267104246
Energy: 0.5555614207938309
Energy: 0.713112326711481
Energy: 0.5555614207933026
Energy: 0.7131123267120091
Energy: 0.5381220232033993
Energy: 0.60750221553626
Energy: 0.5381220232039274
Energy: 0.60750221553626
Energy: 0.5381220232039274
Energy: 0.6075022155357319
Energy: 0.5362052638642045
Energy: 0.5498803707192897
Energy: 0.5362052638668457
Energy: 0.549880370719818
Energy: 0.5362052638668457
Energy: 0.549880370719818
Energy: 0.5373857586250212
Energy: 0.7050600214280809
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Energy: 0.7050600214280809
Energy: 0.5373857586250212
Energy: 0.7050600214259681
Energy: 0.6418993872720351
Energy: 0.5772201327747079
Energy: 0.6418993872715069
Energy: 0.5772201327741796
Energy: 0.6418993872720351
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Energy: 0.6322320759563761
Energy: 0.5116881742932682
Energy: 0.632232075955848
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Energy: 0.6322320759563761
Energy: 0.5116881742932682
Energy: 0.501210659145872
Energy: 0.6408619873899504
Energy: 0.5012106591464003
Energy: 0.6408619873888939
Energy: 0.5012106591464003
Energy: 0.6408619873883656
Energy: 0.5616380239632708
Energy: 0.5714877075098067
Energy: 0.5616380239637991
Energy: 0.5714877075098067
Energy: 0.5616380239643273
Energy: 0.5714877075103351
Energy: 0.6291242165522123
Energy: 0.560386717667715
Energy: 0.6291242165511559
Energy: 0.560386717667715
Energy: 0.629124216551684
Energy: 0.560386717667715
Energy: 0.4807073424279667
Energy: 0.680451645629723
Energy: 0.4807073424279667
Energy: 0.6804516456302512
Energy: 0.4807073424274385
Energy: 0.680451645629723
Energy: 0.5722388752824242
Energy: 0.4912448523048283
Energy: 0.5722388752824242
Energy: 0.4912448523048283
Energy: 0.5722388752808396
Energy: 0.4912448523053565
Energy: 0.5962116079974452
Energy: 0.5562696506121204
Energy: 0.5962116079974452
Energy: 0.5562696506121204
Energy: 0.5962116079974452
Energy: 0.5562696506121204
Energy: 0.5913233150770753
Energy: 0.5234112101264751
Energy: 0.5913233150770753
Energy: 0.5234112101270034
Energy: 0.5913233150770753
Energy: 0.5234112101270034
Energy: 0.599461097131776
Energy: 0.5570718156689433
Energy: 0.5994610971323042
Energy: 0.5570718156684151
Energy: 0.5994610971323042
Energy: 0.5570718156684151

minimum gb energy = 0.4807073424274385 eV
minimum distance =  2.39344004942022 Angstroms
sigma value = 67


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

Energy: 0.9582460688950468
Energy: 0.6352336544003735
Energy: 0.9582460688950468
Energy: 0.6352336544003735
Energy: 0.9582460688957994
Energy: 0.6352336543996209
Energy: 0.7244093391995178
Energy: 0.6480189799245352
Energy: 0.7244093391995178
Energy: 0.6480189799245352
Energy: 0.7244093391995178
Energy: 0.6480189799252878
Energy: 0.7062920250443723
Energy: 0.6986265850620234
Energy: 0.7062920250451249
Energy: 0.6986265850627761
Energy: 0.706292025042867
Energy: 0.6986265850627761
Energy: 0.8012130805112576
Energy: 0.6228180455459883
Energy: 0.8012130805112576
Energy: 0.6228180455467409
Energy: 0.8012130805112576
Energy: 0.6228180455467409
Energy: 0.6883776605115977
Energy: 0.6318002605024173
Energy: 0.6883776605115977
Energy: 0.6318002605024173
Energy: 0.6883776605108451
Energy: 0.6318002605024173
Energy: 0.6885731963996559
Energy: 0.7001319831517584
Energy: 0.6885731963996559
Energy: 0.7001319831525111
Energy: 0.6885731963996559
Energy: 0.7001319831525111
Energy: 0.8178376946265774
Energy: 0.7035145659709472
Energy: 0.8178376946258247
Energy: 0.7035145659709472
Energy: 0.8178376946258247
Energy: 0.7035145659709472
Energy: 0.7276010622548595
Energy: 0.6299130194363108
Energy: 0.7276010622548595
Energy: 0.6299130194363108
Energy: 0.7276010622548595
Energy: 0.6299130194363108
Energy: 0.724260654817663
Energy: 0.7407524177075684
Energy: 0.7242606548184156
Energy: 0.7407524177068158
Energy: 0.7242606548184156
Energy: 0.7407524177075684
Energy: 0.5873999387869221
Energy: 0.6930293785258272
Energy: 0.5873999387869221
Energy: 0.6930293785258272
Energy: 0.5873999387861695
Energy: 0.6930293785258272
Energy: 0.679995488842068
Energy: 0.7072138915904664
Energy: 0.6799954888413153
Energy: 0.7072138915897138
Energy: 0.679995488842068
Energy: 0.7072138915904664
Energy: 0.6297642540505092
Energy: 0.6739890605748163
Energy: 0.6297642540505092
Energy: 0.6739890605740637
Energy: 0.6297642540505092
Energy: 0.6739890605763218
Energy: 0.6782694718808311
Energy: 0.7170654149181284
Energy: 0.6782694718808311
Energy: 0.7170654149181284
Energy: 0.6782694718808311
Energy: 0.7170654149181284
Energy: 0.6159470910961248
Energy: 0.7671120818851324
Energy: 0.6159470910968775
Energy: 0.767112081885885
Energy: 0.6159470910968775
Energy: 0.7671120818851324
Energy: 0.6481361551173287
Energy: 0.6438183475221623
Energy: 0.6481361551165761
Energy: 0.6438183475221623
Energy: 0.6481361551173287
Energy: 0.6438183475214095
Energy: 0.6410738522634224
Energy: 0.6692129512627976
Energy: 0.6410738522611645
Energy: 0.6692129512635502
Energy: 0.6410738522634224
Energy: 0.6692129512635502
Energy: 0.6401667800629135
Energy: 0.7679432386599431
Energy: 0.6401667800629135
Energy: 0.7679432386584377
Energy: 0.6401667800621608
Energy: 0.7679432386667169
Energy: 0.7504767725970352
Energy: 0.6249137394765304
Energy: 0.7504767725962826
Energy: 0.6249137394765304
Energy: 0.7504767725970352
Energy: 0.6249137394765304
Energy: 0.7356537930168798
Energy: 0.7013236158994492
Energy: 0.7356537930161272
Energy: 0.7013236158994492
Energy: 0.7356537930168798
Energy: 0.7013236158994492
Energy: 0.7165223273919399
Energy: 0.8595248223808151
Energy: 0.7165223273926924
Energy: 0.8595248223800624
Energy: 0.7165223273926924
Energy: 0.8595248223800624
Energy: 0.7999190983360865
Energy: 0.6299109894985182
Energy: 0.799919098336839
Energy: 0.6299109894985182
Energy: 0.7999190983375917
Energy: 0.6299109894985182
Energy: 0.7716296914843127
Energy: 0.7317875036227217
Energy: 0.77162969148356
Energy: 0.7317875036227217
Energy: 0.77162969148356
Energy: 0.7317875036234743
Energy: 0.6639867609579415
Energy: 0.6051628161029695
Energy: 0.6639867609579415
Energy: 0.6051628161022169
Energy: 0.6639867609571889
Energy: 0.6051628161022169

minimum gb energy = 0.5873999387861695 eV
minimum distance =  2.40477751241442 Angstroms
sigma value = 33


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

Energy: 0.9383953989098531
Energy: 0.6763637166783906
Energy: 0.9383953989098531
Energy: 0.6763637166779131
Energy: 0.9383953989098531
Energy: 0.6763637166779131
Energy: 0.7923027066967546
Energy: 0.7393001504386973
Energy: 0.7923027066967546
Energy: 0.7393001504391749
Energy: 0.7923027066962771
Energy: 0.7393001504386973
Energy: 0.7664636731251507
Energy: 0.7288088442027957
Energy: 0.7664636731261057
Energy: 0.7288088442027957
Energy: 0.7664636731241959
Energy: 0.7288088442032732
Energy: 0.8539148686831098
Energy: 0.6782733383921037
Energy: 0.8539148686811998
Energy: 0.6782733383921037
Energy: 0.8539148686811998
Energy: 0.6782733383921037
Energy: 0.7143126105811594
Energy: 0.7398363528144652
Energy: 0.7143126105811594
Energy: 0.7398363528139877
Energy: 0.7143126105811594
Energy: 0.7398363528116004
Energy: 0.85606412511484
Energy: 0.8175157107690333
Energy: 0.85606412511484
Energy: 0.8175157107690333
Energy: 0.856064125113885
Energy: 0.8175157107699882
Energy: 0.7049675111556749
Energy: 0.6684903071310828
Energy: 0.7049675111561524
Energy: 0.6684903071310828
Energy: 0.7049675111556749
Energy: 0.6684903071296504
Energy: 0.7697157301489909
Energy: 0.7654975540027971
Energy: 0.7697157301489909
Energy: 0.7654975540027971
Energy: 0.7697157301489909
Energy: 0.7654975540027971
Energy: 0.7171512317143456
Energy: 0.7620110722004907
Energy: 0.7171512317129131
Energy: 0.7620110722004907
Energy: 0.717151231714823
Energy: 0.7620110722000132
Energy: 0.7417963461914565
Energy: 0.8160825536180164
Energy: 0.7417963461957536
Energy: 0.8160825536180164
Energy: 0.7417963461928889
Energy: 0.8160825536180164
Energy: 0.7030420448795656
Energy: 0.8125025399563969
Energy: 0.7030420448790881
Energy: 0.8125025399559193
Energy: 0.7030420448795656
Energy: 0.8125025399563969
Energy: 0.7053132097851332
Energy: 0.7173854326149289
Energy: 0.7053132097856109
Energy: 0.7173854326154062
Energy: 0.7053132097856109
Energy: 0.7173854326149289
Energy: 0.8429241492186711
Energy: 0.680213843941591
Energy: 0.8429241492191486
Energy: 0.680213843941591
Energy: 0.8429241492186711
Energy: 0.680213843941591
Energy: 0.7314714305952739
Energy: 0.8083834267536908
Energy: 0.7314714305947962
Energy: 0.8083834267532134
Energy: 0.7314714305952739
Energy: 0.8083834267532134
Energy: 0.8314001553968894
Energy: 0.7363342572907038
Energy: 0.8314001553968894
Energy: 0.7363342572907038
Energy: 0.8314001553968894
Energy: 0.7363342572907038
Energy: 0.8535494509547055
Energy: 0.7805131058112763
Energy: 0.8535494509542281
Energy: 0.7805131058107988
Energy: 0.8535494509542281
Energy: 0.7805131058107988
Energy: 0.7825505085543893
Energy: 0.69916995352563
Energy: 0.7825505085548669
Energy: 0.6991699535251525
Energy: 0.7825505085548669
Energy: 0.6991699535251525
Energy: 0.7964053933421186
Energy: 0.8365703542538806
Energy: 0.7964053933416412
Energy: 0.8365703542534032
Energy: 0.796405393342596
Energy: 0.8365703542538806
Energy: 0.7934576680433364
Energy: 0.7855321183745929
Energy: 0.7934576680433364
Energy: 0.7855321183745929
Energy: 0.7934576680433364
Energy: 0.7855321183745929
Energy: 0.8049586454540333
Energy: 0.7383429451616842
Energy: 0.8049586454540333
Energy: 0.7383429451612067
Energy: 0.8049586454540333
Energy: 0.7383429451616842
Energy: 0.7635777383213926
Energy: 0.7814117555217113
Energy: 0.7635777383213926
Energy: 0.7814117555217113
Energy: 0.7635777383213926
Energy: 0.7814117555217113
Energy: 0.8159022097805863
Energy: 0.6911268184785058
Energy: 0.8159022097805863
Energy: 0.6911268184785058
Energy: 0.8159022097805863
Energy: 0.6911268184789832
Energy: 0.7007018503236154
Energy: 0.8125364499832632
Energy: 0.7007018503236154
Energy: 0.8125364499832632
Energy: 0.7007018503236154
Energy: 0.8125364499837406
Energy: 0.7739817721016372
Energy: 0.7073080429430723
Energy: 0.7739817721002048
Energy: 0.7073080429430723
Energy: 0.7739817721021147
Energy: 0.7073080429435498
Energy: 0.7061209375898411
Energy: 0.7165396908190326
Energy: 0.7061209375898411
Energy: 0.7165396908185552
Energy: 0.7061209375898411
Energy: 0.7165396908190326
Energy: 0.7013175937638475
Energy: 0.8107238355808671
Energy: 0.701317593764325
Energy: 0.8107238355808671
Energy: 0.701317593764325
Energy: 0.8107238355813448
Energy: 0.7063483176949084
Energy: 0.6882451203333003
Energy: 0.7063483176953859
Energy: 0.6882451203337777
Energy: 0.7063483176958634
Energy: 0.6882451203337777
Energy: 0.82055202355778
Energy: 0.8486572263342463
Energy: 0.8205520235573024
Energy: 0.8486572263337689
Energy: 0.8205520235573024
Energy: 0.8486572263337689
Energy: 0.806394964478832
Energy: 0.8991087061306448
Energy: 0.8063949644793095
Energy: 0.8991087061306448
Energy: 0.806394964478832
Energy: 0.8991087061311223
Energy: 0.7940371749476001
Energy: 0.6689457733677309
Energy: 0.7940371749476001
Energy: 0.6689457733677309
Energy: 0.7940371749476001
Energy: 0.6689457733682083
Energy: 0.8322290910338926
Energy: 0.8358263240535792
Energy: 0.8322290910338926
Energy: 0.8358263240535792
Energy: 0.8322290910334151
Energy: 0.8358263240535792
Energy: 0.7900360240169001
Energy: 0.7384755347634989
Energy: 0.7900360240169001
Energy: 0.7384755347649312
Energy: 0.7900360240169001
Energy: 0.7384755347639764
Energy: 0.8595126559888676
Energy: 0.7840352044272492
Energy: 0.8595126559888676
Energy: 0.7840352044272492
Energy: 0.8595126559888676
Energy: 0.7840352044272492
Energy: 0.7452847856438618
Energy: 0.7377769854094376
Energy: 0.7452847856438618
Energy: 0.7377769854094376
Energy: 0.7452847856443392
Energy: 0.7377769854099151
Energy: 0.7072108803109814
Energy: 0.7294891241724033
Energy: 0.7072108803105039
Energy: 0.7294891241724033
Energy: 0.7072108803109814
Energy: 0.7294891241728808
Energy: 0.8438748174175457
Energy: 0.6781036766953559
Energy: 0.843874817417068
Energy: 0.6781036766948783
Energy: 0.8438748174175457
Energy: 0.6781036766953559
Energy: 0.7115110288446985
Energy: 0.7485793575805173
Energy: 0.7115110288456534
Energy: 0.7485793575805173
Energy: 0.711511028845176
Energy: 0.7485793575809947

minimum gb energy = 0.6684903071296504 eV
minimum distance =  2.34371327089563 Angstroms
sigma value = 41


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

Energy: 0.8786122053479611
Energy: 0.7700095626016269
Energy: 0.8786122053479611
Energy: 0.7700095626016269
Energy: 0.8786122053479611
Energy: 0.7700095626016269
Energy: 0.881470038351528
Energy: 0.8107121645190211
Energy: 0.8814700383528317
Energy: 0.8107121645203246
Energy: 0.8814700383528317
Energy: 0.8107121645190211
Energy: 0.9833584787295118
Energy: 0.840357748686509
Energy: 0.9833584787295118
Energy: 0.840357748686509
Energy: 0.9833584787295118
Energy: 0.8403577486852053
Energy: 1.1449527210818997
Energy: 0.8830223079467375
Energy: 1.1449527210818997
Energy: 0.8830223079467375
Energy: 1.1449527210818997
Energy: 0.8830223079467375
Energy: 0.8514362149885782
Energy: 0.8111898054828544
Energy: 0.8514362149885782
Energy: 0.8111898054828544
Energy: 0.8514362149898818
Energy: 0.8111898054815508
Energy: 0.9814931957439058
Energy: 0.8716940474580562
Energy: 0.9814931957439058
Energy: 0.8716940474580562
Energy: 0.9814931957439058
Energy: 0.8716940474580562
Energy: 0.8436664730239993
Energy: 0.7894010820188719
Energy: 0.843666473025303
Energy: 0.7894010820188719
Energy: 0.843666473025303
Energy: 0.7894010820188719
Energy: 0.8670864045139247
Energy: 0.8557996980010613
Energy: 0.8670864045139247
Energy: 0.8557996980010613
Energy: 0.8670864045139247
Energy: 0.8557996980010613
Energy: 0.7824347200193671
Energy: 0.7905418533622143
Energy: 0.7824347200193671
Energy: 0.7905418533622143
Energy: 0.7824347200193671
Energy: 0.7905418533622143
Energy: 1.020648309829938
Energy: 0.7737994270074711
Energy: 1.0206483098312416
Energy: 0.7737994270074711
Energy: 1.0206483098312416
Energy: 0.7737994270074711
Energy: 0.8644734327536951
Energy: 0.8399599325223782
Energy: 0.8644734327536951
Energy: 0.839959932523682
Energy: 0.8644734327549988
Energy: 0.8399599325223782
Energy: 0.8549771395661327
Energy: 0.8252921053967357
Energy: 0.8549771395661327
Energy: 0.8252921053967357
Energy: 0.8549771395661327
Energy: 0.8252921053967357
Energy: 0.855850175451827
Energy: 0.8828010963469193
Energy: 0.855850175451827
Energy: 0.8828010963469193
Energy: 0.855850175451827
Energy: 0.8828010963469193
Energy: 0.8487248604618643
Energy: 0.811309841529665
Energy: 0.8487248604618643
Energy: 0.811309841529665
Energy: 0.8487248604605607
Energy: 0.8113098415309685

minimum gb energy = 0.7700095626016269 eV
minimum distance =  2.33283102486975 Angstroms
sigma value = 11


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

Energy: 0.9951312605128104
Energy: 0.9501002857675541
Energy: 0.9951312605128104
Energy: 0.9501002857681268
Energy: 0.9951312605128104
Energy: 0.9501002857681268
Energy: 0.8752009040907027
Energy: 0.9428079362577576
Energy: 0.8752009040901302
Energy: 0.9428079362577576
Energy: 0.8752009040889848
Energy: 0.9428079362577576
Energy: 0.9302844376114844
Energy: 0.9436438356484418
Energy: 0.9302844376114844
Energy: 0.9436438356478691
Energy: 0.9302844376120569
Energy: 0.9436438356484418
Energy: 1.0345258613496833
Energy: 0.8276509866988974
Energy: 1.0345258613496833
Energy: 0.8276509866988974
Energy: 1.034525861350256
Energy: 0.8276509866988974
Energy: 0.9307851534394049
Energy: 0.9503705272421952
Energy: 0.9307851534394049
Energy: 0.9503705272421952
Energy: 0.9307851534394049
Energy: 0.9503705272421952
Energy: 0.8771657623636311
Energy: 0.9223235514944146
Energy: 0.8771657623636311
Energy: 0.9223235514949872
Energy: 0.8771657623636311
Energy: 0.9223235514949872
Energy: 0.976827827463475
Energy: 0.8883339873523228
Energy: 0.9768278274629022
Energy: 0.8883339873523228
Energy: 0.9768278274629022
Energy: 0.8883339873523228
Energy: 0.9410177023657293
Energy: 0.9113028031005036
Energy: 0.9410177023663019
Energy: 0.9113028031005036
Energy: 0.9410177023657293
Energy: 0.9113028031005036
Energy: 0.9211325569251475
Energy: 0.9111626560804016
Energy: 0.9211325569251475
Energy: 0.9111626560804016
Energy: 0.9211325569251475
Energy: 0.9111626560798289
Energy: 0.9221359582175742
Energy: 0.8857169951769084
Energy: 0.9221359582175742
Energy: 0.8857169951769084
Energy: 0.9221359582175742
Energy: 0.8857169951769084
Energy: 0.8713505318733249
Energy: 0.9761665054781504
Energy: 0.8713505318738975
Energy: 0.9761665054781504
Energy: 0.8713505318738975
Energy: 0.9761665054775779
Energy: 0.9368707016325035
Energy: 0.939798170646717
Energy: 0.9368707016325035
Energy: 0.939798170646717
Energy: 0.9368707016325035
Energy: 0.9397981706472897
Energy: 1.0616456195295858
Energy: 0.903855302072973
Energy: 1.0616456195295858
Energy: 0.903855302072973
Energy: 1.0616456195301585
Energy: 0.903855302072973
Energy: 0.8994335359664271
Energy: 1.006633563210356
Energy: 0.8994335359664271
Energy: 1.006633563210356
Energy: 0.8994335359664271
Energy: 1.006633563210356
Energy: 0.9084602982740816
Energy: 0.8985247163043979
Energy: 0.9084602982740816
Energy: 0.8985247163043979
Energy: 0.9084602982740816
Energy: 0.8985247163043979
Energy: 0.9464012744033106
Energy: 0.8882745762916953
Energy: 0.9464012744033106
Energy: 0.8882745762911227
Energy: 0.9464012744033106
Energy: 0.8882745762916953
Energy: 0.8815747973196567
Energy: 1.0266780863036882
Energy: 0.8815747973196567
Energy: 1.0266780863031153
Energy: 0.8815747973196567
Energy: 1.0266780863031153
Energy: 0.9920891264927609
Energy: 0.9759674345750663
Energy: 0.9920891264927609
Energy: 0.9759674345744938
Energy: 0.9920891264927609
Energy: 0.9759674345750663
Energy: 0.9904976771794577
Energy: 0.8352270972285527
Energy: 0.9904976771794577
Energy: 0.8352270972291255
Energy: 0.9904976771794577
Energy: 0.8352270972291255
Energy: 0.8907645599062889
Energy: 0.9212544637414762
Energy: 0.8907645599062889
Energy: 0.9212544637414762
Energy: 0.8907645599062889
Energy: 0.921254463742049
Energy: 0.8560825165442393
Energy: 0.9085513705859076
Energy: 0.8560825165442393
Energy: 0.9085513705859076
Energy: 0.8560825165442393
Energy: 0.9085513705859076
Energy: 1.0291350783885447
Energy: 0.9485252354932109
Energy: 1.0291350783891173
Energy: 0.9485252354932109
Energy: 1.0291350783891173
Energy: 0.9485252354932109
Energy: 0.9220501366646344
Energy: 0.9626063999981989
Energy: 0.9220501366646344
Energy: 0.9626063999987716
Energy: 0.9220501366646344
Energy: 0.9626063999981989
Energy: 0.9567708025951713
Energy: 0.9500356460488453
Energy: 0.9567708025951713
Energy: 0.9500356460488453
Energy: 0.9567708025951713
Energy: 0.9500356460482725
Energy: 0.9089517210100024
Energy: 0.8787720817897452
Energy: 0.9089517210100024
Energy: 0.8787720817897452
Energy: 0.9089517210100024
Energy: 0.8787720817897452
Energy: 0.8468362667731677
Energy: 0.9691401601256514
Energy: 0.8468362667731677
Energy: 0.9691401601256514
Energy: 0.8468362667737402
Energy: 0.9691401601256514
Energy: 0.8985406858891757
Energy: 0.9491901712939801
Energy: 0.8985406858891757
Energy: 0.9491901712939801
Energy: 0.8985406858891757
Energy: 0.9491901712939801
Energy: 0.9639346845580737
Energy: 0.9366873553858637
Energy: 0.9639346845586463
Energy: 0.9366873553858637
Energy: 0.9639346845580737
Energy: 0.9366873553858637
Energy: 0.8813504609131522
Energy: 1.005917087106155
Energy: 0.8813504609131522
Energy: 1.005917087106155
Energy: 0.8813504609137247
Energy: 1.005917087106155
Energy: 0.8752226985295436
Energy: 0.8234741180925979
Energy: 0.8752226985289709
Energy: 0.8234741180931704
Energy: 0.8752226985301164
Energy: 0.8234741180931704
Energy: 0.9510182709748702
Energy: 0.9678326826948941
Energy: 0.9510182709748702
Energy: 0.9678326826948941
Energy: 0.9510182709748702
Energy: 0.9678326826948941

minimum gb energy = 0.8234741180925979 eV
minimum distance =  2.32909746833404 Angstroms
sigma value = 57


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

Energy: 0.8703122518949027
Energy: 0.7819300779521067
Energy: 0.8703122518959218
Energy: 0.7819300779521067
Energy: 0.8703122518959218
Energy: 0.7819300779521067
Energy: 0.92008931722203
Energy: 0.8863602663203375
Energy: 0.9200893172230492
Energy: 0.8863602663203375
Energy: 0.9200893172230492
Energy: 0.8863602663213567
Energy: 0.9361969552881231
Energy: 0.8837799442399709
Energy: 0.9361969552881231
Energy: 0.8837799442389518
Energy: 0.9361969552881231
Energy: 0.8837799442389518
Energy: 0.9075720584355702
Energy: 0.9067591366312414
Energy: 0.9075720584355702
Energy: 0.9067591366312414
Energy: 0.9075720584355702
Energy: 0.9067591366312414
Energy: 0.9362043403814847
Energy: 0.8837841865428611
Energy: 0.9362043403814847
Energy: 0.8837841865428611
Energy: 0.9362043403814847
Energy: 0.8837841865428611
Energy: 0.9201023332753976
Energy: 0.8161312568472909
Energy: 0.9201023332753976
Energy: 0.8161312568472909
Energy: 0.9201023332753976
Energy: 0.8161312568462716
Energy: 0.8703122518959218
Energy: 0.7819300779521067
Energy: 0.8703122518959218
Energy: 0.7819300779521067
Energy: 0.8703122518959218
Energy: 0.7819300779521067
Energy: 0.9200893172230492
Energy: 0.8863602663203375
Energy: 0.92008931722203
Energy: 0.8863602663203375
Energy: 0.9200893172230492
Energy: 0.8863602663203375
Energy: 0.9361969552881231
Energy: 0.8837799442399709
Energy: 0.9361969552881231
Energy: 0.8837799442399709
Energy: 0.9361969552881231
Energy: 0.8837799442389518
Energy: 0.9075720584355702
Energy: 0.8928719992029234
Energy: 0.9075720584355702
Energy: 0.8928719992029234
Energy: 0.9075720584355702
Energy: 0.8928719992029234
Energy: 0.9362043403814847
Energy: 0.8837841865428611
Energy: 0.9362043403814847
Energy: 0.8837841865428611
Energy: 0.9362043403814847
Energy: 0.8837841865428611
Energy: 0.9201023332753976
Energy: 0.8161312568462716
Energy: 0.9201023332753976
Energy: 0.8161312568462716
Energy: 0.9201023332753976
Energy: 0.8161312568462716
Energy: 0.8703122518949027
Energy: 0.7819300779521067
Energy: 0.8703122518949027
Energy: 0.7819300779521067
Energy: 0.8703122518949027
Energy: 0.7819300779521067
Energy: 0.9200893172230492
Energy: 0.8863602663203375
Energy: 0.9200893172230492
Energy: 0.8863602663203375
Energy: 0.92008931722203
Energy: 0.8863602663203375
Energy: 0.9361969552881231
Energy: 0.8837799442389518
Energy: 0.9361969552881231
Energy: 0.8837799442399709
Energy: 0.9361969552881231
Energy: 0.8837799442389518
Energy: 0.9075720584355702
Energy: 0.8928719992029234
Energy: 0.9075720584355702
Energy: 0.8928719992029234
Energy: 0.9075720584355702
Energy: 0.8928719992029234
Energy: 0.9362043403814847
Energy: 0.8837841865428611
Energy: 0.9362043403814847
Energy: 0.8837841865438802
Energy: 0.9362043403814847
Energy: 0.8837841865428611

minimum gb energy = 0.7819300779521067 eV
minimum distance =  2.35447882439106 Angstroms
sigma value = 9


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

Energy: 0.9181816987528368
Energy: 0.9350859892122187
Energy: 0.9181816987528368
Energy: 0.9350859892122187
Energy: 0.9181816987528368
Energy: 0.9350859892122187
Energy: 0.9323426109466768
Energy: 0.9946766952322759
Energy: 0.9323426109450126
Energy: 0.9946766952322759
Energy: 0.9323426109458446
Energy: 0.9946766952331081
Energy: 0.9011854038170338
Energy: 0.9289449976852111
Energy: 0.9011854038170338
Energy: 0.9289449976852111
Energy: 0.9011854038154073
Energy: 0.9289449976852111
Energy: 0.9267069547284823
Energy: 1.013304663620763
Energy: 0.9267069547284823
Energy: 1.013304663620763
Energy: 0.9267069547284823
Energy: 1.013304663620763
Energy: 1.0755348692116875
Energy: 0.9368482746543204
Energy: 1.0755348692108555
Energy: 0.9368482746543204
Energy: 1.0755348692108555
Energy: 0.9368482746543204
Energy: 1.0072940477381147
Energy: 0.9102453988300179
Energy: 1.0072940477389467
Energy: 0.9102453988308499
Energy: 1.0072940477381147
Energy: 0.9102453988300179
Energy: 0.9014319532660129
Energy: 0.9054101336885955
Energy: 0.9014319532651807
Energy: 0.9054101336885955
Energy: 0.9014319532660129
Energy: 0.9054101336894277
Energy: 1.0217227548108736
Energy: 0.8955866606547481
Energy: 1.0217227548117056
Energy: 0.8955866606547481
Energy: 1.0217227548108736
Energy: 0.8955866606555801
Energy: 1.0115433610394557
Energy: 0.9666841724893032
Energy: 1.0115433610394557
Energy: 0.9666841724893032
Energy: 1.011543361040288
Energy: 0.966684172488471
Energy: 0.9007311217531477
Energy: 0.8986940101354811
Energy: 0.9007311217531477
Energy: 0.898694010134649
Energy: 0.9007311217539797
Energy: 0.898694010134649
Energy: 0.8881247802517322
Energy: 0.9259325784720746
Energy: 0.8881247802517322
Energy: 0.9259325784720746
Energy: 0.8881247802525644
Energy: 0.9259325784720746
Energy: 0.9290126097078133
Energy: 0.9111469332531105
Energy: 0.9290126097078133
Energy: 0.9111469332531105
Energy: 0.9290126097078133
Energy: 0.9111469332531105
Energy: 0.9381168932636191
Energy: 1.0650838058824792
Energy: 0.9381168932636191
Energy: 1.0650838058833112
Energy: 0.9381168932636191
Energy: 1.0650838058824792
Energy: 0.8957109629925932
Energy: 0.8984950896818833
Energy: 0.8957109629934255
Energy: 0.8984950896827153
Energy: 0.8957109629925932
Energy: 0.8984950896827153
Energy: 0.9277966679615925
Energy: 0.9388858466361731
Energy: 0.9277966679615925
Energy: 0.9388858466361731
Energy: 0.9277966679615925
Energy: 0.9388858466361731
Energy: 0.9175225804639333
Energy: 0.9156297697336402
Energy: 0.9175225804631012
Energy: 0.9156297697328079
Energy: 0.9175225804639333
Energy: 0.9156297697319759
Energy: 0.9511025545220689
Energy: 0.915679490388169
Energy: 0.9511025545220689
Energy: 0.915679490388169
Energy: 0.9511025545212368
Energy: 0.915679490388169
Energy: 0.9976084937654852
Energy: 0.9372867568786817
Energy: 0.9976084937663172
Energy: 0.9372867568778497
Energy: 0.9976084937663172
Energy: 0.9372867568778497
Energy: 0.8730404825084372
Energy: 0.9018051967888823
Energy: 0.8730404825084372
Energy: 0.9018051967888823
Energy: 0.8730404825084372
Energy: 0.9018051967888823
Energy: 1.0301899087448876
Energy: 0.8911859752670834
Energy: 1.0301899087448876
Energy: 0.8911859752704119
Energy: 1.0301899087448876
Energy: 0.8911859752654193
Energy: 0.9237737698695088
Energy: 0.9097604120007179
Energy: 0.9237737698703408
Energy: 0.9097604120015499
Energy: 0.9237737698695088
Energy: 0.9097604120007179

minimum gb energy = 0.8730404825084372 eV
minimum distance =  2.34338908691761 Angstroms
sigma value = 27


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

Energy: 0.8942326293566437
Energy: 0.9080280031557708
Energy: 0.8942326293566437
Energy: 0.9080280031557708
Energy: 0.8942326293566437
Energy: 0.9080280031557708
Energy: 0.8634862402895893
Energy: 0.8749142080569867
Energy: 0.8634862402888878
Energy: 0.8749142080569867
Energy: 0.8634862402888878
Energy: 0.874914208057688
Energy: 0.9178292686274835
Energy: 0.8784025115346805
Energy: 0.9178292686274835
Energy: 0.8784025115346805
Energy: 0.9178292686281846
Energy: 0.8784025115346805
Energy: 0.8430036076411053
Energy: 0.8650950641282591
Energy: 0.8430036076404038
Energy: 0.8650950641282591
Energy: 0.8430036076411053
Energy: 0.8650950641282591
Energy: 0.8255399987753997
Energy: 0.9058237136423278
Energy: 0.8255399987753997
Energy: 0.9058237136423278
Energy: 0.8255399987753997
Energy: 0.9058237136423278
Energy: 0.796222568314115
Energy: 0.8469174564976611
Energy: 0.7962225683134138
Energy: 0.8469174564969599
Energy: 0.796222568314115
Energy: 0.8469174564969599
Energy: 0.8725601632761092
Energy: 0.8656403114005626
Energy: 0.8725601632761092
Energy: 0.8656403114005626
Energy: 0.8725601632761092
Energy: 0.8656403114005626
Energy: 0.8677358790205455
Energy: 0.9164542443000968
Energy: 0.8677358790212469
Energy: 0.9164542443000968
Energy: 0.8677358790205455
Energy: 0.9164542443000968
Energy: 0.8496974401073141
Energy: 0.8448183599161883
Energy: 0.8496974401073141
Energy: 0.8448183599161883
Energy: 0.8496974401073141
Energy: 0.8448183599161883
Energy: 0.8428674835895577
Energy: 0.88159974310771
Energy: 0.8428674835888563
Energy: 0.8815997431070088
Energy: 0.8428674835895577
Energy: 0.88159974310771
Energy: 0.8428715853497823
Energy: 0.9416759843753336
Energy: 0.8428715853497823
Energy: 0.9416759843753336
Energy: 0.8428715853497823
Energy: 0.9416759843746323
Energy: 0.8636183153374896
Energy: 0.8746180780106845
Energy: 0.8636183153374896
Energy: 0.8746180780106845
Energy: 0.8636183153374896
Energy: 0.8746180780106845
Energy: 0.8762671442822406
Energy: 0.8669708195575898
Energy: 0.8762671442822406
Energy: 0.8669708195575898
Energy: 0.8762671442822406
Energy: 0.8669708195575898
Energy: 0.8297785951361465
Energy: 0.8502765120089046
Energy: 0.8297785951354452
Energy: 0.8502765120089046
Energy: 0.8297785951347437
Energy: 0.8502765120089046
Energy: 0.796377001739132
Energy: 0.8468343435570854
Energy: 0.796377001739132
Energy: 0.8468343435570854
Energy: 0.796377001739132
Energy: 0.8468343435570854
Energy: 0.8737843889132743
Energy: 0.8502287494728191
Energy: 0.8737843889132743
Energy: 0.8502287494728191
Energy: 0.8737843889132743
Energy: 0.8502287494728191
Energy: 0.8731916094081027
Energy: 0.9149639558117961
Energy: 0.8731916094081027
Energy: 0.9149639558124976
Energy: 0.8731916094088039
Energy: 0.9149639558117961
Energy: 0.8656858968605272
Energy: 0.874061142485274
Energy: 0.8656858968612287
Energy: 0.874061142485274
Energy: 0.8656858968605272
Energy: 0.8740611424859754
Energy: 0.8011849583525122
Energy: 0.829102075106805
Energy: 0.8011849583938621
Energy: 0.8291020751082078
Energy: 0.8011849583903553
Energy: 0.8291020751075063
Energy: 0.8942326293566437
Energy: 0.9080280031557708
Energy: 0.8942326293566437
Energy: 0.9080280031550695
Energy: 0.8942326293566437
Energy: 0.9080280031557708
Energy: 0.8634862402888878
Energy: 0.874914208057688
Energy: 0.8634862402888878
Energy: 0.8749142080569867
Energy: 0.8634862402888878
Energy: 0.8749142080569867
Energy: 0.9178292686274835
Energy: 0.8784025115346805
Energy: 0.9178292686274835
Energy: 0.8784025115353817
Energy: 0.9178292686274835
Energy: 0.8784025115346805
Energy: 0.8430036076411053
Energy: 0.8650950641275575
Energy: 0.8430036076411053
Energy: 0.8650950641282591
Energy: 0.8430036076411053
Energy: 0.8650950641282591
Energy: 0.8255399987753997
Energy: 0.9058237136430293
Energy: 0.8255399987746984
Energy: 0.9058237136423278
Energy: 0.8255399987753997
Energy: 0.9058237136423278
Energy: 0.796222568314115
Energy: 0.8469174564962585
Energy: 0.796222568314115
Energy: 0.8469174564969599
Energy: 0.7962225683148165
Energy: 0.8469174564969599

minimum gb energy = 0.7962225683134138 eV
minimum distance =  2.36825986919265 Angstroms
sigma value = 19


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

Energy: 0.860102189520175
Energy: 0.9478745775982654
Energy: 0.8601021895207804
Energy: 0.9478745775982654
Energy: 0.8601021895207804
Energy: 0.9478745775982654
Energy: 0.8912890796211996
Energy: 0.8873207977265473
Energy: 0.891289079620594
Energy: 0.8873207977271527
Energy: 0.8912890796211996
Energy: 0.8873207977271527
Energy: 0.954001729958261
Energy: 0.834732402726662
Energy: 0.954001729958261
Energy: 0.8347324027260566
Energy: 0.954001729958261
Energy: 0.8347324027260566
Energy: 0.8273215831888996
Energy: 0.9501269535054343
Energy: 0.8273215831888996
Energy: 0.9501269535060397
Energy: 0.8273215831888996
Energy: 0.9501269535060397
Energy: 0.8746010143870637
Energy: 0.9057676602593444
Energy: 0.8746010143870637
Energy: 0.9057676602599498
Energy: 0.874601014387669
Energy: 0.9057676602599498
Energy: 0.8987768783689039
Energy: 0.8322674967555577
Energy: 0.8987768783695094
Energy: 0.832267496756163
Energy: 0.8987768783689039
Energy: 0.832267496756163
Energy: 0.830775791854219
Energy: 0.9814597648712775
Energy: 0.8307757918536135
Energy: 0.9814597648706722
Energy: 0.8307757918536135
Energy: 0.9814597648706722
Energy: 0.8510609815165213
Energy: 0.9791449602620449
Energy: 0.8510609815165213
Energy: 0.9791449602614395
Energy: 0.8510609815165213
Energy: 0.9791449602614395
Energy: 0.8898619776081341
Energy: 0.8137266159537173
Energy: 0.8898619776081341
Energy: 0.8137266159537173
Energy: 0.8898619776087395
Energy: 0.8137266159537173
Energy: 0.9197887065170934
Energy: 0.8859116226745593
Energy: 0.9197887065170934
Energy: 0.8859116226745593
Energy: 0.9197887065176988
Energy: 0.8859116226745593
Energy: 0.8203084760511958
Energy: 0.9848338181575649
Energy: 0.8203084760511958
Energy: 0.9848338181575649
Energy: 0.8203084760511958
Energy: 0.9848338181575649
Energy: 0.9462215659216723
Energy: 0.8317810101584361
Energy: 0.9462215659216723
Energy: 0.8317810101584361
Energy: 0.9462215659204615
Energy: 0.8317810101584361
Energy: 1.0125468046333652
Energy: 0.8735217118378857
Energy: 1.0125468046327595
Energy: 0.8735217118378857
Energy: 1.0125468046333652
Energy: 0.8735217118378857
Energy: 0.8312372735337215
Energy: 0.8825548057215857
Energy: 0.8312372735337215
Energy: 0.8825548057215857
Energy: 0.8312372735337215
Energy: 0.882554805722191
Energy: 0.9345202144817385
Energy: 0.8644620307450404
Energy: 0.9345202144817385
Energy: 0.8644620307450404
Energy: 0.9345202144811332
Energy: 0.8644620307450404
Energy: 0.9947546662722169
Energy: 0.8138507069450658
Energy: 0.9947546662722169
Energy: 0.8138507069450658
Energy: 0.9947546662722169
Energy: 0.8138507069450658
Energy: 0.837876468026168
Energy: 0.9462211912044755
Energy: 0.837876468026168
Energy: 0.9462211912044755
Energy: 0.837876468026168
Energy: 0.9462211912050809
Energy: 0.9368066034013629
Energy: 0.985835091622043
Energy: 0.9368066034013629
Energy: 0.9858350916214377
Energy: 0.9368066034013629
Energy: 0.9858350916214377
Energy: 0.9081000739360005
Energy: 0.8308040276111205
Energy: 0.908100073936606
Energy: 0.8308040276105151
Energy: 0.908100073936606
Energy: 0.8308040276111205
Energy: 0.838012198991938
Energy: 0.9096071613926695
Energy: 0.838012198991938
Energy: 0.9096071613926695
Energy: 0.838012198991938
Energy: 0.9096071613926695
Energy: 0.809884458259367
Energy: 1.0254194558383964
Energy: 0.809884458259367
Energy: 1.0254194558383964
Energy: 0.809884458259367
Energy: 1.0254194558383964
Energy: 0.9502744542327961
Energy: 0.8343066289880943
Energy: 0.9502744542334016
Energy: 0.8343066289880943
Energy: 0.9502744542327961
Energy: 0.8343066289886998
Energy: 0.9567957055563926
Energy: 0.9550482951899104
Energy: 0.956795705556998
Energy: 0.9550482951899104
Energy: 0.956795705556998
Energy: 0.9550482951899104
Energy: 0.8526477771293511
Energy: 0.9667503542990681
Energy: 0.8526477771293511
Energy: 0.9667503542984626
Energy: 0.8526477771293511
Energy: 0.9667503542990681
Energy: 0.9679441508275259
Energy: 0.8344014629471008
Energy: 0.9679441508275259
Energy: 0.8344014629471008
Energy: 0.9679441508281315
Energy: 0.8344014629471008
Energy: 0.9602868844867
Energy: 0.9152450257599554
Energy: 0.9602868844867
Energy: 0.9152450257605609
Energy: 0.9602868844867
Energy: 0.9152450257599554
Energy: 0.816501931932604
Energy: 0.8589394246663833
Energy: 0.816501931932604
Energy: 0.8589394246663833
Energy: 0.816501931932604
Energy: 0.8589394246663833
Energy: 0.9227523389145671
Energy: 0.8915180226568027
Energy: 0.9227523389145671
Energy: 0.8915180226568027
Energy: 0.9227523389139617
Energy: 0.8915180226561973
Energy: 1.0093894869640447
Energy: 0.8307654539924835
Energy: 1.0093894869640447
Energy: 0.8307654539924835
Energy: 1.0093894869640447
Energy: 0.8307654539924835

minimum gb energy = 0.809884458259367 eV
minimum distance =  2.33938912447653 Angstroms
sigma value = 101


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

Energy: 0.8112018199536818
Energy: 0.8935553729964276
Energy: 0.8112018199531494
Energy: 0.8935553729958954
Energy: 0.8112018199536818
Energy: 0.8935553729964276
Energy: 0.9521255850787745
Energy: 0.7956729354485327
Energy: 0.9521255850787745
Energy: 0.7956729354480007
Energy: 0.9521255850787745
Energy: 0.7956729354480007
Energy: 0.9098929545859016
Energy: 0.7980018394206377
Energy: 0.9098929545864338
Energy: 0.7980018394206377
Energy: 0.9098929545864338
Energy: 0.7980018394206377
Energy: 0.7736728099397904
Energy: 1.0080742410281551
Energy: 0.7736728099392582
Energy: 1.0080742410281551
Energy: 0.7736728099392582
Energy: 1.0080742410286876
Energy: 0.900129270346565
Energy: 0.8682650287323129
Energy: 0.900129270346565
Energy: 0.8682650287317809
Energy: 0.9001292703470971
Energy: 0.8682650287317809
Energy: 0.8700340934220199
Energy: 0.7857641109311687
Energy: 0.8700340934225521
Energy: 0.7857641109311687
Energy: 0.8700340934220199
Energy: 0.7857641109311687
Energy: 0.7957068201707233
Energy: 0.9846858527081224
Energy: 0.7957068201707233
Energy: 0.9846858527081224
Energy: 0.7957068201712553
Energy: 0.9846858527086546
Energy: 0.7853097647921471
Energy: 0.9216117965493059
Energy: 0.7853097647921471
Energy: 0.9216117965487737
Energy: 0.7853097647921471
Energy: 0.9216117965487737
Energy: 0.870894668693703
Energy: 0.7853774104680367
Energy: 0.870894668693703
Energy: 0.7853774104680367
Energy: 0.870894668694235
Energy: 0.7853774104680367
Energy: 0.8999605990264842
Energy: 0.960795725007089
Energy: 0.899960599025952
Energy: 0.9607957250065569
Energy: 0.8999605990264842
Energy: 0.9607957250065569
Energy: 0.772682746290153
Energy: 0.9081434044478556
Energy: 0.772682746290153
Energy: 0.9081434044478556
Energy: 0.772682746290153
Energy: 0.9081434044483877
Energy: 0.9687241060231043
Energy: 0.7956193632541992
Energy: 0.9687241060231043
Energy: 0.7956193632541992
Energy: 0.968724106024701
Energy: 0.7956193632541992
Energy: 0.9459773819363002
Energy: 0.7980673888829236
Energy: 0.9459773819363002
Energy: 0.7980673888823914
Energy: 0.9459773819363002
Energy: 0.7980673888829236
Energy: 0.8111255194246959
Energy: 0.9359005409322612
Energy: 0.8111255194252281
Energy: 0.935900540931729
Energy: 0.8111255194246959
Energy: 0.935900540931729
Energy: 0.9540500138166296
Energy: 0.8494657762136182
Energy: 0.9540500138166296
Energy: 0.8494657762141502
Energy: 0.9540500138166296
Energy: 0.8494657762141502
Energy: 0.9757307755405842
Energy: 0.8003020348706709
Energy: 0.975730775540052
Energy: 0.8003020348706709
Energy: 0.9757307755405842
Energy: 0.8003020348701387
Energy: 0.772854054705236
Energy: 1.0904750505345424
Energy: 0.772854054705236
Energy: 1.0904750505345424
Energy: 0.7728540547047038
Energy: 1.0904750505340102
Energy: 0.7728067721911792
Energy: 0.8683810696492051
Energy: 0.7728067721906471
Energy: 0.8683810696492051
Energy: 0.7728067721911792
Energy: 0.8683810696492051
Energy: 0.869840954527777
Energy: 0.786724856333448
Energy: 0.869840954527777
Energy: 0.7867248563339804
Energy: 0.869840954527777
Energy: 0.7867248563339804
Energy: 0.7957998561100672
Energy: 0.9896336331406725
Energy: 0.7957998561095351
Energy: 0.9896336331406725
Energy: 0.7957998561095351
Energy: 0.9896336331406725
Energy: 0.7864937533221193
Energy: 1.0014386777123792
Energy: 0.7864937533221193
Energy: 1.0014386777123792
Energy: 0.7864937533221193
Energy: 1.0014386777123792
Energy: 1.060225235499409
Energy: 0.785298458247415
Energy: 1.060225235499409
Energy: 0.785298458247415
Energy: 1.060225235499409
Energy: 0.785298458247415
Energy: 0.9338380519591978
Energy: 0.7852090239208568
Energy: 0.9338380519591978
Energy: 0.7852090239208568
Energy: 0.9338380519586654
Energy: 0.7852090239203247
Energy: 0.7737271763667734
Energy: 0.8500015699002818
Energy: 0.7737271763662411
Energy: 0.8500015699002818
Energy: 0.7737271763662411
Energy: 0.8500015699002818
Energy: 0.9716610009427903
Energy: 0.7959861872475076
Energy: 0.9716610009438545
Energy: 0.7959861872475076
Energy: 0.9716610009433225
Energy: 0.7959861872480398
Energy: 0.9441334264686932
Energy: 0.8002479281487649
Energy: 0.9441334264686932
Energy: 0.8002479281487649
Energy: 0.9441334264686932
Energy: 0.8002479281487649
Energy: 0.8111149994549625
Energy: 1.0242707451855497
Energy: 0.8111149994549625
Energy: 1.024270745186082
Energy: 0.8111149994554948
Energy: 1.0242707451855497
Energy: 0.8723631453483616
Energy: 0.9500392605564052
Energy: 0.8723631453483616
Energy: 0.9500392605564052
Energy: 0.8723631453483616
Energy: 0.9500392605564052
Energy: 0.8476301121041964
Energy: 0.7979806899316674
Energy: 0.8476301121041964
Energy: 0.7979806899316674
Energy: 0.8476301121041964
Energy: 0.7979806899316674
Energy: 0.7727934051815691
Energy: 1.0347354180814474
Energy: 0.7727934051821012
Energy: 1.0347354180809152
Energy: 0.7727934051821012
Energy: 1.0347354180809152
Energy: 0.7727682799178612
Energy: 0.9080414910151297
Energy: 0.7727682799178612
Energy: 0.9080414910151297
Energy: 0.7727682799178612
Energy: 0.9080414910151297
Energy: 0.9104377031042054
Energy: 0.7852287258423101
Energy: 0.9104377031031411
Energy: 0.7852287258428423
Energy: 0.9104377031042054
Energy: 0.7852287258423101
Energy: 1.065106177116492
Energy: 0.7851096700851657
Energy: 1.065106177116492
Energy: 0.7851096700851657
Energy: 1.065106177116492
Energy: 0.785109670085698

minimum gb energy = 0.772682746290153 eV
minimum distance =  2.35700774506571 Angstroms
sigma value = 33


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

Energy: 0.015439724083785246
Energy: 0.7354531921885125
Energy: 0.015439724083785246
Energy: 0.73545319218893
Energy: 0.015439724083785246
Energy: 0.73545319218893
Energy: 0.016887303415272014
Energy: 1.1580190997011466
Energy: 0.016887303415272014
Energy: 1.1580190997011466
Energy: 0.016887303415272014
Energy: 1.1580190997015887
Energy: 0.7351949516090448
Energy: 0.2582435855787126
Energy: 0.7351947407533126
Energy: 0.2582435855787126
Energy: 0.7351947990459415
Energy: 0.2582435855787126
Energy: 0.016887303415272014
Energy: 1.1580190997007045
Energy: 0.016887303415272014
Energy: 1.1580190997007045
Energy: 0.016887303415272014
Energy: 1.1580190997015887

minimum gb energy = 0.015439724083785246 eV
minimum distance =  2.52026770728858 Angstroms
sigma value = 1