Model name: model_name=EAM_Dynamo_OnatDurukanoglu_2014_CuNi__MO_592013496703_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.615001678466797
cohesive_energy=3.5402785184955947
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.5555645091870378e-19, 2.23171989879762e-19, 2.75048867112048e-19, 3.17384782488864e-19, 3.53021997358926e-19, 3.8357550576930596e-19, 4.10072302942398e-19, 4.3322055095042997e-19, 4.53532946316282e-19, 4.7139881796201595e-19, 4.871209772714579e-19, 5.009381485630739e-19, 5.130506039161139e-19, 5.23618560993978e-19, 5.327814091638239e-19, 5.40657709496568e-19, 5.47345194766884e-19, 5.52933586866276e-19, 5.574997902731759e-19, 5.61112698582846e-19, 5.63833194507378e-19, 5.65717354228962e-19, 5.66814845223252e-19, 5.67170528436e-19, 5.667892103971079e-19, 5.65561943095464e-19, 5.63342928457374e-19, 5.59960733583e-19, 5.552086776865559e-19, 5.488432299196739e-19, 5.405663854284299e-19, 5.30019256646808e-19, 5.168413538321579e-19, 5.01263390419776e-19, 4.828319504222399e-19, 4.60739536816014e-19, 4.339928000880179e-19, 4.0135806423007197e-19, 3.6133569191275195e-19, 3.12113621363004e-19, 2.5113638084959795e-19, 1.7505061467757201e-19, 8.05712198765724e-20, -3.6953723410219794e-20, -1.85552882513442e-19, -3.74619338385246e-19, -6.1928292563348395e-19, -9.397807373222098e-19, -1.367021965074552e-18, -1.94092483972662e-18, -2.72467760554674e-18, -3.8083097719526395e-18, -5.24243409881238e-18]
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: 0.013653314351430608
Energy: 0.014397830113541689
Energy: 0.7072593927924348
Energy: 0.0989784641572638
Energy: 0.014397830113541689
Energy: 0.8001912356218321
Energy: 0.0989784641572638
Energy: 0.8001912356653539
Energy: 0.7072593928065471
Energy: 0.09897846415789102
Energy: 0.013653314352057825
Energy: 0.014397830114168904
Energy: 0.0989784641603302
Energy: 0.8001912356138526
Energy: 0.014397830112322105
Energy: 0.8001912357395048

minimum gb energy = 0.013653314351430608 eV
minimum distance =  2.4931496984738 Angstroms
sigma value = 1


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

Energy: 1.2656159458844465
Energy: 0.7744363370015759
Energy: 0.8353857931121857
Energy: 0.8342504373429246
Energy: 0.8183347128269344
Energy: 0.8516361481238968
Energy: 0.7964894663781987
Energy: 0.8516361481238968
Energy: 0.8355984714182645
Energy: 0.8345484258593763
Energy: 0.7959013800462029
Energy: 0.8345484258578548
Energy: 0.7964050667163846
Energy: 0.7953852272359898
Energy: 0.7958412922830794
Energy: 0.7953852272367505
Energy: 0.8339761546737073
Energy: 0.7949738181859398
Energy: 0.7970165813207161
Energy: 0.7949738181836579
Energy: 0.7967731367247298
Energy: 0.8937905703022978
Energy: 0.7964669049390553
Energy: 0.8937905703030586
Energy: 0.8363924111821291
Energy: 0.8780059166852218
Energy: 0.8342902616567173
Energy: 0.878005916684461
Energy: 0.8354185782665391
Energy: 0.8472413469750978
Energy: 0.8164727139514256
Energy: 0.8472413469743371
Energy: 0.8431841913483265
Energy: 0.9306610823553967
Energy: 0.8444752642849244
Energy: 0.930661082352354
Energy: 0.8505779485870318
Energy: 0.8999885477608086
Energy: 0.8458677687265134
Energy: 0.8999885477615692
Energy: 0.842949484500911
Energy: 0.9306478188654846
Energy: 0.8439381342317229
Energy: 0.9306478188632027
Energy: 0.8351641417788566
Energy: 0.9285247414998973
Energy: 0.8557202004385969
Energy: 0.9285247415014186
Energy: 0.8386058561221003
Energy: 0.8779761787964445
Energy: 0.8192775058535366
Energy: 0.877976178797966
Energy: 0.7966209511374549
Energy: 0.8788974742815233
Energy: 0.834529903763178
Energy: 0.8788974742807626
Energy: 0.8190315244009085
Energy: 0.7945030267311688
Energy: 0.7942673677992725
Energy: 0.7945030267455871
Energy: 0.7718078219169768
Energy: 0.7956081650487382
Energy: 0.7960808339090415
Energy: 0.7956081650479774
Energy: 0.8341336228676416
Energy: 0.8335992855084154
Energy: 0.7713428018784698
Energy: 0.8335992855084154
Energy: 0.7966388382868653
Energy: 0.7956407047570947
Energy: 0.8187418571525324
Energy: 0.7956407047548127
Energy: 0.7952560694083486
Energy: 0.8351709485703482
Energy: 0.8353454249857998
Energy: 0.8351709485711087
Energy: 0.7969274462962167
Energy: 0.79596729623981
Energy: 0.796152296736543
Energy: 0.7959672962405707
Energy: 0.7996292896896442
Energy: 0.7973019240410859
Energy: 0.8334287903692926
Energy: 0.7973019240380432
Energy: 0.7962666700007831
Energy: 0.7964502777013011
Energy: 0.7967630809191215
Energy: 0.7964502776982584
Energy: 0.834337983878455
Energy: 0.8789710259832403
Energy: 0.8352492718784672
Energy: 0.8789710259824797
Energy: 0.8185795380317705
Energy: 0.878864752911314
Energy: 0.8370412267050764
Energy: 0.8788647529120749
Energy: 0.8453055674366868
Energy: 0.9323434164502871
Energy: 0.8432768813040915
Energy: 0.9323434164525691
Energy: 0.8490471396126297
Energy: 0.9285299991716223
Energy: 0.8520282203366748
Energy: 0.9285299991708614
Energy: 0.8447261988421576
Energy: 0.9301611887196248
Energy: 0.8429169717922093
Energy: 0.9301611887211462
Energy: 0.853442305407433
Energy: 0.930413949824782
Energy: 0.8477723024288024
Energy: 0.9304139498217394
Energy: 0.8196692143297
Energy: 0.8774404503168102
Energy: 0.8714589352097599
Energy: 0.8774404503160496
Energy: 0.8342831329466408
Energy: 0.8805868685777097
Energy: 0.7974744770368026
Energy: 0.880586868576949
Energy: 0.7937345509984185
Energy: 0.7944083085633397
Energy: 0.8182099322716985
Energy: 0.794408308564861
Energy: 0.7961395641104557
Energy: 0.7962257717800666
Energy: 0.7717781201762789
Energy: 0.7962257717777846
Energy: 0.7710317738582884
Energy: 0.7969476212590636
Energy: 0.8348656152871459
Energy: 0.7969476212590636

minimum gb energy = 0.7710317738582884 eV
minimum distance =  2.27297290057081 Angstroms
sigma value = 1


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

Energy: 1.4306446100819663
Energy: 0.8116399534387261
Energy: 0.8808619044010446
Energy: 0.8796248466278318
Energy: 0.8672530947616794
Energy: 0.8948162551538794
Energy: 0.838089662039921
Energy: 0.8948162551564813
Energy: 0.8791165347626105
Energy: 0.8805725714264714
Energy: 0.8381392210538083
Energy: 0.880572571428206
Energy: 0.8389663853530545
Energy: 0.8379420767013093
Energy: 0.8376341724851941
Energy: 0.8379420766952382
Energy: 0.8379022626775012
Energy: 0.8383541838564935
Energy: 0.8374125325723469
Energy: 0.8383541838599627
Energy: 0.8388498445289182
Energy: 0.9346668476540121
Energy: 0.8400615642229298
Energy: 0.934666847656614
Energy: 0.885418852945237
Energy: 0.9342327043630569
Energy: 0.8813651994409861
Energy: 0.9342327043673935
Energy: 0.8825483998727289
Energy: 0.9355811641267111
Energy: 0.8599976855500261
Energy: 0.9355811641258439
Energy: 0.8824393127422748
Energy: 0.9849810407250836
Energy: 0.888777941236995
Energy: 0.9849810407242163
Energy: 0.8588712856572339
Energy: 0.9881863688372887
Energy: 0.8845074062934403
Energy: 0.9881863688355542
Energy: 0.8671521843617669
Energy: 0.933945561764726
Energy: 0.8870523237351288
Energy: 0.9339455617690231
Energy: 0.8829035432124114
Energy: 0.9363748297022895
Energy: 0.8390022420949803
Energy: 0.9363748296996875
Energy: 0.8373444604660536
Energy: 0.8377164050071166
Energy: 0.8670521325432862
Energy: 0.8377164049993109
Energy: 0.8375567404829636
Energy: 0.8380651217304267
Energy: 0.807334547748693
Energy: 0.8380651217278249
Energy: 0.8077072328382257
Energy: 0.8788674816982263
Energy: 0.8797634265724926
Energy: 0.8788674816938895
Energy: 0.8674496147315196
Energy: 0.8382495851014532
Energy: 0.8375662153377376
Energy: 0.8382495851023205
Energy: 0.8800540493237576
Energy: 0.8801424941966827
Energy: 0.8381277567585023
Energy: 0.8801424941984174
Energy: 0.8388125187407127
Energy: 0.8380289631094155
Energy: 0.8375410054168976
Energy: 0.8380289631085484
Energy: 0.8375172443433017
Energy: 0.840049150985956
Energy: 0.8392820411462996
Energy: 0.8400491509894252
Energy: 0.8390490938421298
Energy: 0.8388729215025124
Energy: 0.8396357588291495
Energy: 0.838872921510318
Energy: 0.8838233942170202
Energy: 0.9359613102234413
Energy: 0.8812489528202408
Energy: 0.9359613102260431
Energy: 0.8813980754866054
Energy: 0.9348078672821916
Energy: 0.8570522636445356
Energy: 0.9348078672847935
Energy: 0.8828823444414112
Energy: 0.9859290357038525
Energy: 0.8896934482421807
Energy: 0.9859290356986485
Energy: 0.8578254135200178
Energy: 0.9843881426685493
Energy: 0.8961814670926901
Energy: 0.9843881426668146
Energy: 0.8663636039072128
Energy: 0.9338400987054956
Energy: 0.8883846986139837
Energy: 0.9338400987054956
Energy: 0.8831349726435574
Energy: 0.9340077332516544
Energy: 0.8407853891265915
Energy: 0.9340077332542565
Energy: 0.8367616711618469
Energy: 0.8372168159630627
Energy: 0.8657638786932934
Energy: 0.8372168159639302
Energy: 0.8386684147184074
Energy: 0.8382432283813197
Energy: 0.8074329824757671
Energy: 0.8382432283691774
Energy: 0.806560905662409
Energy: 0.8391776189630142
Energy: 0.8808089194996043
Energy: 0.8391776189630142

minimum gb energy = 0.806560905662409 eV
minimum distance =  2.28524044440489 Angstroms
sigma value = 25


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

Energy: 1.3593229875829314
Energy: 0.8514241549688633
Energy: 0.9291623031583223
Energy: 0.9294608999698069
Energy: 0.922837690964304
Energy: 0.9412270037238065
Energy: 0.8872465271259861
Energy: 0.9412270037238065
Energy: 0.928846670412697
Energy: 0.9295349450251366
Energy: 0.88532043128097
Energy: 0.9295349450271531
Energy: 0.8860221291310671
Energy: 0.941595299458515
Energy: 0.8870797593357075
Energy: 0.9415952994544822
Energy: 0.8870547061940193
Energy: 0.8867987440171217
Energy: 0.8859924514275187
Energy: 0.88679874401813
Energy: 0.8862660891723384
Energy: 0.8879432887773374
Energy: 0.8865970573753851
Energy: 0.8879432887763292
Energy: 0.9310804615649189
Energy: 1.0026617841090482
Energy: 0.9294037655577947
Energy: 1.0026617841100565
Energy: 0.9305533038730108
Energy: 1.0014126776638947
Energy: 0.8607961684422715
Energy: 1.0014126776628864
Energy: 0.9311741254122827
Energy: 1.0022460431597773
Energy: 0.922880345625165
Energy: 1.0022460431567528
Energy: 0.8865404038313802
Energy: 1.0029346793768747
Energy: 0.8868792799858727
Energy: 1.0029346793778828
Energy: 0.8456104353140722
Energy: 0.8872290721500922
Energy: 0.8868241646486444
Energy: 0.8872290721511004
Energy: 0.8451852293571294
Energy: 0.8869517951696742
Energy: 0.886808426725286
Energy: 0.8869517951696742
Energy: 0.9284038370294846
Energy: 0.9295546064218956
Energy: 0.846308376098868
Energy: 0.9295546064178627
Energy: 0.887236900394645
Energy: 0.8859651875428538
Energy: 0.9229896355026426
Energy: 0.8859651875428538
Energy: 0.8853476028433602
Energy: 0.9306827558430004
Energy: 0.9311301160230938
Energy: 0.9306827558430004
Energy: 0.8844643844375154
Energy: 0.8867483074219707
Energy: 0.88578957722919
Energy: 0.8867483074209626
Energy: 0.8882459790788872
Energy: 0.8874217102772618
Energy: 0.8854626878125237
Energy: 0.8874217102772618
Energy: 0.8890231256678385
Energy: 0.8870415325021973
Energy: 0.8864234758269881
Energy: 0.8870415325042138
Energy: 0.9295564937165252
Energy: 1.0041113566981117
Energy: 0.9314190391278686
Energy: 1.0041113566981117
Energy: 0.8612479544291465
Energy: 1.002146786974187
Energy: 0.9317538463799965
Energy: 1.002146786974187
Energy: 0.9226817619791294
Energy: 1.0022707045670924
Energy: 0.9315457846433675
Energy: 1.0022707045660844
Energy: 0.9226311171757156
Energy: 1.0023016906312836
Energy: 0.8867736401664803
Energy: 1.002301690632292
Energy: 0.8862444543522305
Energy: 0.8861913352181258
Energy: 0.8453828518018291
Energy: 0.8861913352181258
Energy: 0.886483516695237
Energy: 0.886909451936401
Energy: 0.8452852971510417
Energy: 0.886909451936401
Energy: 0.8445070635377736
Energy: 0.8859041404045866
Energy: 0.9312522544623774
Energy: 0.8859041404045866

minimum gb energy = 0.8445070635377736 eV
minimum distance =  2.29325460357019 Angstroms
sigma value = 9


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

Energy: 1.2536409296243334
Energy: 0.8924841938048037
Energy: 0.9840367941146454
Energy: 0.983499410700426
Energy: 0.981449654275861
Energy: 0.9886761967090469
Energy: 0.9415402459179516
Energy: 0.9886761967090469
Energy: 0.9834699653130836
Energy: 0.9831918708308979
Energy: 0.9824971328467803
Energy: 0.9831918708284924
Energy: 0.9339481063048508
Energy: 0.9898814783878886
Energy: 0.9412651628448835
Energy: 0.9898814783902941
Energy: 0.9381166191516187
Energy: 0.9452782057562888
Energy: 0.9402001723248609
Energy: 0.9452782057586945
Energy: 0.9330882900510791
Energy: 0.9428582697657599
Energy: 0.9417592373705337
Energy: 0.9428582697669627
Energy: 0.9802051935554087
Energy: 1.0715096465228788
Energy: 0.9421657922388313
Energy: 1.071509646521676
Energy: 0.9420360415792598
Energy: 1.0646706587065042
Energy: 0.9424890165243454
Energy: 1.0646706587089094
Energy: 0.9422737940295454
Energy: 0.9461905244008496
Energy: 0.8825890883011892
Energy: 0.946190524403255
Energy: 0.941278274510252
Energy: 0.9451693868790211
Energy: 0.8827421674251412
Energy: 0.9451693868802238
Energy: 0.881303320163124
Energy: 0.9841816721340758
Energy: 0.9825475863578021
Energy: 0.9841816721340758
Energy: 0.9825803952106782
Energy: 0.9336972230801739
Energy: 0.9416349849288324
Energy: 0.9336972230813766
Energy: 0.9831197984526736
Energy: 0.9847481702926878
Energy: 0.9979813850106545
Energy: 0.9847481702950931
Energy: 0.9332911699823613
Energy: 0.9435565396210166
Energy: 0.9287972467331582
Energy: 0.9435565396210166
Energy: 0.9381246154321108
Energy: 0.9325717684365742
Energy: 0.941114377859936
Energy: 0.9325717684365742
Energy: 0.9326484167954554
Energy: 0.9459671170179969
Energy: 0.9406807817760855
Energy: 0.9459671170288216
Energy: 0.9794637138406691
Energy: 1.0723472607700124
Energy: 0.9419021998028951
Energy: 1.072347260772418
Energy: 0.9795553713600704
Energy: 1.0713790033385509
Energy: 0.9415883196447707
Energy: 1.071379003337348
Energy: 0.9427819445553042
Energy: 0.9460336090943732
Energy: 0.8827483663647826
Energy: 0.9460336090967787
Energy: 0.9410925590276777
Energy: 0.9455814689262366
Energy: 0.8829422294670884
Energy: 0.9455814689262366
Energy: 0.8816369008967279
Energy: 0.9329711597287403
Energy: 0.9840312906503563
Energy: 0.932971159729943

minimum gb energy = 0.881303320163124 eV
minimum distance =  2.31296474696107 Angstroms
sigma value = 25


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

Energy: 1.0997079208730833
Energy: 0.9318345461179075
Energy: 1.0442321658307903
Energy: 1.0436089565029483
Energy: 1.0403298503435094
Energy: 0.9986705432341901
Energy: 0.9486080632284962
Energy: 0.9986705432327028
Energy: 1.0430751371201148
Energy: 1.0432505255178395
Energy: 1.0418097480697572
Energy: 1.0432505255148985
Energy: 1.0445223122118859
Energy: 0.9991479495896337
Energy: 0.9484458865087365
Energy: 0.9991479495911212
Energy: 0.9462102846858943
Energy: 0.9493119765636601
Energy: 0.9486997957709629
Energy: 0.9493119765755256
Energy: 0.9245167834361888
Energy: 0.950452173769498
Energy: 0.9468715761694811
Energy: 0.9504521737709852
Energy: 0.9199057970717844
Energy: 0.9486371309681857
Energy: 0.9493962862914632
Energy: 0.9486371309666982
Energy: 0.9206465966228418
Energy: 1.0000754178231248
Energy: 0.9521206186862275
Energy: 1.0000754178260995
Energy: 1.0422382037932456
Energy: 1.0433439546531473
Energy: 1.1590266190228735
Energy: 1.0433439546531473
Energy: 1.0451168055740259
Energy: 0.9265004374178297
Energy: 1.039629047487296
Energy: 0.9265004374178297
Energy: 1.055601260389378
Energy: 1.0429600854265415
Energy: 1.0477718297403782
Energy: 1.0429600854191043
Energy: 0.921674236436577
Energy: 1.0001965733151674
Energy: 1.0432394192967036
Energy: 1.0001965733136802
Energy: 0.9477647823538679
Energy: 0.9286051502315257
Energy: 0.9460916145050365
Energy: 0.9286051502345004
Energy: 0.9488237006667791
Energy: 0.9489202856033058
Energy: 0.9267094584938587
Energy: 0.9489202856018184
Energy: 0.950257357374619
Energy: 1.017237637149032
Energy: 0.9201670984679293
Energy: 1.0172376371549814
Energy: 0.9480848650719815
Energy: 0.9486444419951218
Energy: 0.9204492206889292
Energy: 0.9486444419966092
Energy: 1.1532270149799937
Energy: 0.9257009820017569
Energy: 1.0425967234841775
Energy: 0.9257009820017569

minimum gb energy = 0.9199057970717844 eV
minimum distance =  2.34107100023047 Angstroms
sigma value = 17


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

Energy: 1.5227891817573265
Energy: 1.0703971767477336
Energy: 1.142591575743915
Energy: 1.142699849199515
Energy: 0.9452862743500411
Energy: 1.0173377134865056
Energy: 1.084351886022907
Energy: 1.017337713473027
Energy: 1.0052639806460997
Energy: 1.0049059904570277
Energy: 1.068666549962545
Energy: 1.0049059904561852
Energy: 1.0047731399631201
Energy: 1.007888069005384
Energy: 1.00401805154873
Energy: 1.007888069007911
Energy: 1.0051704452927397
Energy: 1.0565899114237807
Energy: 0.9472450248955058
Energy: 1.0565899114287969
Energy: 1.0047597126377519
Energy: 1.0062798333208578
Energy: 1.0049906183439414
Energy: 1.0062798333537113
Energy: 1.0568401304508226
Energy: 1.003638537040553
Energy: 1.0056819290118582
Energy: 1.0036385370422376
Energy: 1.2155531004671025
Energy: 1.0045691057920398
Energy: 0.9705537722244484
Energy: 1.004569105798779
Energy: 1.1482687229352069
Energy: 1.1404302618737334
Energy: 1.1435396910913465
Energy: 1.1404302618720488
Energy: 1.1394390928009048
Energy: 1.0722826761889044
Energy: 1.01270642473059
Energy: 1.072282676186377
Energy: 1.002928994576005
Energy: 0.97007863273483
Energy: 0.9645594914519027
Energy: 0.9700786327297756
Energy: 1.074456342585815
Energy: 0.9666546284880154
Energy: 0.9674245273323736
Energy: 0.9666546272157209
Energy: 1.058132305705954
Energy: 0.9979536211393469
Energy: 0.9964439061416687
Energy: 0.9979536211393469
Energy: 1.057815715602216
Energy: 0.9656013510711077
Energy: 0.9653799938805537
Energy: 0.9656013510896405
Energy: 1.1408114279165058
Energy: 1.0605967262519311
Energy: 1.215929450675494
Energy: 1.0605967262519311
Energy: 1.146023077527252
Energy: 1.1403454959279815
Energy: 1.2155453223363806
Energy: 1.140345495928824
Energy: 1.1419780599231784
Energy: 1.003921017415438
Energy: 1.0046040326059962
Energy: 1.003921017415438
Energy: 1.1403026639819827
Energy: 1.0041620984780073
Energy: 1.0016915096482009
Energy: 1.0041620984763227
Energy: 1.0045603685372575
Energy: 1.055997441612751
Energy: 1.004781768090278
Energy: 1.055997441614436
Energy: 1.0448543637389736
Energy: 1.0586860437458456
Energy: 1.0046684839628195
Energy: 1.0586860437424763
Energy: 1.004845298523928
Energy: 1.0145686271242955
Energy: 1.1583305615698927
Energy: 1.014568627125138
Energy: 1.004981675617547
Energy: 1.006435699202431
Energy: 1.0583409573680145
Energy: 1.006435699204116
Energy: 1.0837797558660855
Energy: 1.0783482022245046
Energy: 1.085224769310385
Energy: 1.0783482022228197
Energy: 1.1385639013517979
Energy: 1.1404475270173011
Energy: 1.1392904830027772
Energy: 1.1404475270164587
Energy: 0.9660192505176043
Energy: 0.9678075858853675
Energy: 1.1413796187770855
Energy: 0.9678075858845251
Energy: 0.9678940028511985
Energy: 0.9666632928383689
Energy: 1.0025100574045076
Energy: 0.9666632928358417
Energy: 0.9640331503581445
Energy: 0.9672549003338339
Energy: 1.0587648466132198
Energy: 0.967254900332149
Energy: 0.9708453903990782
Energy: 0.9681847108891111
Energy: 1.057818883813043
Energy: 0.9681847108882687
Energy: 0.9662744564092759
Energy: 0.9673533169637794
Energy: 1.0589533135642062
Energy: 0.9673533169620946
Energy: 1.0785397601039661
Energy: 1.140223748442234
Energy: 1.1405192529779624
Energy: 1.1402237484413915

minimum gb energy = 0.9452862743500411 eV
minimum distance =  2.29170434391909 Angstroms
sigma value = 53


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

Energy: 1.376874280088773
Energy: 0.9174613865287912
Energy: 1.0753224169954652
Energy: 1.0745749921751029
Energy: 1.2120222664394045
Energy: 0.9724715459544611
Energy: 1.0649327491622627
Energy: 0.9724715459525218
Energy: 1.0721482651064822
Energy: 1.0675972788162773
Energy: 1.0715940947481446
Energy: 1.0675972788162773
Energy: 1.066208051567255
Energy: 0.9735233991150569
Energy: 1.0630387107007429
Energy: 0.9735233991169963
Energy: 1.0763600867472398
Energy: 0.9727677688309756
Energy: 0.9075201816317628
Energy: 0.972767768832915
Energy: 1.0633084805991315
Energy: 0.9768554432022994
Energy: 0.9194858040407627
Energy: 0.9768554432003602
Energy: 1.2133721783537226
Energy: 1.0647525133630007
Energy: 1.0645207324220913
Energy: 1.0647525133610614
Energy: 1.212805101848627
Energy: 0.9756320716777634
Energy: 1.0620653559771929
Energy: 0.9756320716797029
Energy: 1.0690817885065484
Energy: 1.065755631022538
Energy: 1.0718383549761685
Energy: 1.065755631022538
Energy: 1.062058430894018
Energy: 0.9756515442830004
Energy: 1.0669963025820361
Energy: 0.9756515442849399
Energy: 1.0763979123828324
Energy: 0.9784852458342439
Energy: 0.9222552687683765
Energy: 0.9784852458361831
Energy: 1.0672980556077085
Energy: 0.972461263683932
Energy: 0.9059700674488306
Energy: 0.9724612636819928
Energy: 1.213288520405457
Energy: 1.0647369646655738
Energy: 1.061305049281533
Energy: 1.0647369646675133

minimum gb energy = 0.9059700674488306 eV
minimum distance =  2.3226541786871 Angstroms
sigma value = 9


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

Energy: 1.3294455426788487
Energy: 1.0910305911549893
Energy: 1.1831204863283142
Energy: 1.1830049909898173
Energy: 1.0324154068387041
Energy: 0.9797007050261625
Energy: 1.1754504048472483
Energy: 0.979700705027598
Energy: 0.9860116117933219
Energy: 0.9822766589125272
Energy: 1.1591156863649075
Energy: 0.982276658913245
Energy: 0.9834066536219739
Energy: 0.9810713807596323
Energy: 1.241419852602331
Energy: 0.9810713807567611
Energy: 0.9794602867211429
Energy: 0.978340317970459
Energy: 1.23956748750729
Energy: 0.9783403179726124
Energy: 0.978064512444457
Energy: 0.9784517871078735
Energy: 1.2391703387043544
Energy: 0.9784517871078735
Energy: 1.1777299171169187
Energy: 1.1612701119745228
Energy: 1.1741505103179515
Energy: 1.1612701119759583
Energy: 1.1750094797659003
Energy: 1.160612898899292
Energy: 1.1596926972468187
Energy: 1.1606128989035986
Energy: 1.028628509547909
Energy: 1.0811407647856457
Energy: 1.0418933107267105
Energy: 1.081140764784928
Energy: 0.9809363643643039
Energy: 1.045356872517128
Energy: 1.1630366232858964
Energy: 1.0453568725221527
Energy: 1.02562217990602
Energy: 1.0264079363988035
Energy: 1.0796687011256536
Energy: 1.0264079364023926
Energy: 1.0398648580503267
Energy: 1.0285869227406723
Energy: 1.2410347544376519
Energy: 1.028586922751439
Energy: 1.1740915144781652
Energy: 1.0264854335276539
Energy: 1.0449994647949081
Energy: 1.0264854335290892
Energy: 1.1779782495048707
Energy: 1.02678004309598
Energy: 1.0294808034427325
Energy: 1.0267800430952618
Energy: 1.1611454762738262
Energy: 1.0427411974878282
Energy: 1.036964696821391
Energy: 1.042741197488546
Energy: 1.0783466772608996
Energy: 1.108530077354348
Energy: 1.0379242042340422
Energy: 1.1085300773536304
Energy: 1.1627849379228246
Energy: 1.082400389176549
Energy: 1.0286727366825803
Energy: 1.082400389176549
Energy: 1.1617408122044772
Energy: 1.1626698645319014
Energy: 1.3256380771672118
Energy: 1.1626698645297477
Energy: 1.175620049521663
Energy: 0.9783838409555887
Energy: 1.0330567056691973
Energy: 0.9783838409570244
Energy: 1.2348003937891323
Energy: 0.9836480938604559
Energy: 0.9858885020750793
Energy: 0.9836480938590203
Energy: 1.1759543214593309
Energy: 0.9799418932702959
Energy: 0.981527849214383
Energy: 0.9799418932710138
Energy: 1.2392369110363357
Energy: 0.9779804688791592
Energy: 0.978299497586027
Energy: 0.9779804688791592
Energy: 1.239447796103426
Energy: 0.9790550156948556
Energy: 0.9780592167954041
Energy: 0.9790550156955733
Energy: 1.1755791680132106
Energy: 1.1604149091321363
Energy: 1.178411211580148
Energy: 1.160414909129265
Energy: 1.1604244315664143
Energy: 1.1607368321466434
Energy: 1.1782345617866656
Energy: 1.1607368321452078
Energy: 1.0399094209672382
Energy: 1.0812035563546245
Energy: 1.0273514406673976
Energy: 1.081203556353189
Energy: 1.1630328129997833
Energy: 1.0660843375810947
Energy: 0.9804975159321381
Energy: 1.066084337579659
Energy: 1.0791508860950734
Energy: 1.026663990025445
Energy: 1.0259037817521595
Energy: 1.026663990026163
Energy: 1.2423109059363502
Energy: 1.0367374037261685
Energy: 1.0385046192860734
Energy: 1.0367374037240153
Energy: 1.0464644648441341
Energy: 1.026416099872279
Energy: 1.1747676866973396
Energy: 1.0264160998694076
Energy: 1.0317688505085059
Energy: 1.0276095906094165
Energy: 1.1600008369115613
Energy: 1.0276095906101343
Energy: 1.0326688005590896
Energy: 1.030600797743249
Energy: 1.1613111179515239
Energy: 1.0306007977324823
Energy: 1.0392617974327363
Energy: 1.113971573574325
Energy: 1.0789325987491458
Energy: 1.1139715735714537
Energy: 1.0270967130051405
Energy: 1.083303038869764
Energy: 1.0859890205673077
Energy: 1.0833030388683285
Energy: 1.2423309314077877
Energy: 1.1618311442317273
Energy: 1.1666395709855317
Energy: 1.1618311442302918

minimum gb energy = 0.9779804688791592 eV
minimum distance =  2.2870032343493 Angstroms
sigma value = 73


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

Energy: 1.41443147616326
Energy: 1.040748933370032
Energy: 1.139487880306421
Energy: 1.1389831457462183
Energy: 1.0390705580603417
Energy: 0.9922471937514759
Energy: 1.1109288577536391
Energy: 0.9922471937526147
Energy: 0.9967848680300095
Energy: 0.996418083532496
Energy: 1.144597589779123
Energy: 0.996418083532496
Energy: 0.9942841343571156
Energy: 0.994722765302691
Energy: 1.2221035382062215
Energy: 0.9947227653049686
Energy: 0.9955907584919649
Energy: 0.9961367234980731
Energy: 1.2177737691059076
Energy: 0.9961367234969344
Energy: 1.0545372333753198
Energy: 0.9961756738499162
Energy: 1.2197193216055766
Energy: 0.9961756738476385
Energy: 1.1079617093297602
Energy: 1.1417915639458893
Energy: 1.1581624384402256
Energy: 1.1417915639470282
Energy: 1.0529324629262728
Energy: 1.141288249524894
Energy: 1.1408477704786681
Energy: 1.1412882495260328
Energy: 1.0424699157030046
Energy: 1.100232980394958
Energy: 1.1426159085383554
Energy: 1.1002329803960968
Energy: 1.0524593012376613
Energy: 1.0325480398177709
Energy: 1.1414102832442325
Energy: 1.0325480398052436
Energy: 1.0333093217830758
Energy: 0.9696335674538196
Energy: 0.9856663043530373
Energy: 0.9696335674560972
Energy: 1.0321788987332354
Energy: 0.9732506490823021
Energy: 1.2050680352402363
Energy: 0.9732506490845798
Energy: 1.144612096068805
Energy: 1.0461329011966305
Energy: 1.0298110390882107
Energy: 1.0461329011954916
Energy: 1.1440708007004818
Energy: 1.032093776854485
Energy: 1.0293594734801315
Energy: 1.0320937768567626
Energy: 1.1588286377590074
Energy: 1.0297316075843843
Energy: 1.0290852611545598
Energy: 1.0297316075843843
Energy: 1.2178903208668854
Energy: 1.0301443620141846
Energy: 1.0295389686005667
Energy: 1.0301443620164623
Energy: 1.2180203264997365
Energy: 1.0306475311521914
Energy: 1.0295674683394829
Energy: 1.0306475311521914
Energy: 1.1235171556211774
Energy: 1.1177578941323778
Energy: 1.0480082945214138
Energy: 1.1177578941301
Energy: 1.1084899069489036
Energy: 1.0698814925930245
Energy: 1.106397718754314
Energy: 1.0698814925918856
Energy: 1.1078698867188992
Energy: 1.0702637659312113
Energy: 1.1036845749375475
Energy: 1.0702637659300724
Energy: 1.1084032484497994
Energy: 1.0735635569527584
Energy: 1.0392148325378947
Energy: 1.0735635569527584
Energy: 1.21911500397927
Energy: 1.1027437513581937
Energy: 1.102419554573968
Energy: 1.1027437513593068

minimum gb energy = 0.9696335674538196 eV
minimum distance =  2.27412968835035 Angstroms
sigma value = 7


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

Energy: 1.636476698563436
Energy: 1.0062268156267364
Energy: 1.1399263413453944
Energy: 1.1392557858614953
Energy: 1.0824316779617333
Energy: 1.0926713364913758
Energy: 1.1016845982770374
Energy: 1.0926713364825178
Energy: 0.9911675783824799
Energy: 0.9924013262879046
Energy: 1.096599444656444
Energy: 0.9924013262862939
Energy: 0.9923589977240009
Energy: 0.9934697165982083
Energy: 1.2021354253862986
Energy: 0.9934697165957924
Energy: 0.9909173672425466
Energy: 0.9909640899095306
Energy: 1.179538561852733
Energy: 0.9909640899055042
Energy: 0.9959294669974212
Energy: 0.991625135846876
Energy: 1.1780727224202574
Energy: 0.9916251358525129
Energy: 1.2039492135536782
Energy: 0.990943963678459
Energy: 0.9955892739969125
Energy: 0.9909439636816803
Energy: 1.0972568876010942
Energy: 0.9923090450452766
Energy: 0.9917847110261769
Energy: 0.9923090450501082
Energy: 1.0958879723010566
Energy: 0.9947704488931253
Energy: 0.9945678820661279
Energy: 0.9947704488874883
Energy: 1.202261533850333
Energy: 0.9913648640475813
Energy: 0.9908602427527561
Energy: 0.9913648640427497
Energy: 1.101532333961157
Energy: 1.0937006070061936
Energy: 0.9975538931123323
Energy: 1.0937006070061936
Energy: 1.0922149267101493
Energy: 1.091618097755656
Energy: 1.0979940640662509
Energy: 1.0916180977516297
Energy: 1.091417941760172
Energy: 1.0603303058772515
Energy: 1.0953064827586634
Energy: 1.0603303058836937
Energy: 1.0928372867030776
Energy: 1.0581871754019472
Energy: 1.004655275463526
Energy: 1.0581871754059733
Energy: 1.0943130486295323
Energy: 1.0595385034950515
Energy: 1.001618950221876
Energy: 1.059538503492636
Energy: 1.2234745650295702
Energy: 1.091665284930527
Energy: 1.0921938214884603
Energy: 1.0916652849217057
Energy: 1.0050692150453253
Energy: 1.0925294298221206
Energy: 1.100050581358324
Energy: 1.0925294298237311
Energy: 0.9909280898748632
Energy: 0.9916134401344632
Energy: 1.1042629147894858
Energy: 0.9916134401392949
Energy: 0.9947591153314768
Energy: 0.9951022649042568
Energy: 1.1002291165434925
Energy: 0.9951022649002303
Energy: 0.9916782405828829
Energy: 0.9922536044122205
Energy: 1.0086626005007353
Energy: 0.9922536044130258
Energy: 0.9958469136177894
Energy: 0.9911539337289009
Energy: 1.181791567845773
Energy: 0.9911539337329274
Energy: 1.099621703313391
Energy: 0.9917166543982296
Energy: 0.9959535871324257
Energy: 0.9917166543893716
Energy: 1.1008798501097385
Energy: 0.9908601022104637
Energy: 0.9908385027835522
Energy: 0.9908601022016056
Energy: 1.2012579931543952
Energy: 0.9933861335569576
Energy: 0.9926868840739437
Energy: 0.9933861335609839
Energy: 1.17884653589198
Energy: 0.9923413116756572
Energy: 0.9910288306847281
Energy: 0.9923413116659938
Energy: 1.1778764325574218
Energy: 1.098182104193422
Energy: 0.992368384604665
Energy: 1.09818210418698
Energy: 1.1387376398655766
Energy: 1.097115157425071
Energy: 1.4194774429300938
Energy: 1.0971151574274869
Energy: 1.0904438179795883
Energy: 1.09397470473251
Energy: 1.09237827164131
Energy: 1.0939747047373416
Energy: 1.0984492944316817
Energy: 1.058359657186885
Energy: 1.092422124456024
Energy: 1.05835965719168
Energy: 1.0928448263203039
Energy: 1.0971064534444321
Energy: 1.0043289152124957
Energy: 1.0971064534508745
Energy: 1.117177040023003
Energy: 1.0904193524359955
Energy: 1.0937701564932483
Energy: 1.0904193524400216

minimum gb energy = 0.9908385027835522 eV
minimum distance =  2.25847307054422 Angstroms
sigma value = 29


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

Energy: 0.934139737203526
Energy: 0.9354672139425761
Energy: 0.955344067246249
Energy: 1.1166335970037413
Energy: 0.9460571281905806
Energy: 1.0233536678595447
Energy: 0.9500330129973192
Energy: 1.0233536678581734
Energy: 0.945577421791936
Energy: 1.0097453202293958
Energy: 0.9338945278766492
Energy: 1.0097453202280242
Energy: 0.9381606244744536
Energy: 0.9469593977917344
Energy: 0.9467387330684222
Energy: 0.9469593977911733
Energy: 0.9440969626438799
Energy: 0.9480552350853284
Energy: 0.9368504963394663
Energy: 0.94805523508617
Energy: 0.9453749797663173
Energy: 1.0154543627988202
Energy: 0.9378440067082322
Energy: 1.0154543627990693
Energy: 0.9341803573721458
Energy: 1.009075096311811
Energy: 0.9462312722884383
Energy: 1.009075096313182
Energy: 0.9488435086554188
Energy: 0.9523878158933893
Energy: 0.9413460911187287
Energy: 0.9523878158925788
Energy: 0.9531982670697822
Energy: 0.9485702320090937
Energy: 0.9509398896745432
Energy: 0.9485702320145791

minimum gb energy = 0.9338945278766492 eV
minimum distance =  2.29876194693502 Angstroms
sigma value = 5


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

Energy: 1.2722743751550483
Energy: 0.900633088612445
Energy: 1.0747294597137975
Energy: 0.929071878106958
Energy: 0.9457797136177111
Energy: 0.9274812029784633
Energy: 1.0685772460163074
Energy: 0.9274812029792239
Energy: 1.067672067301269
Energy: 1.000383338175476
Energy: 1.0709303512795294
Energy: 1.000383338175476
Energy: 0.9455115904997528
Energy: 0.9234393423324294
Energy: 1.0586260216390915
Energy: 0.9234393423301475
Energy: 1.058077735131642
Energy: 0.923696388504902
Energy: 1.0836818861814281
Energy: 0.9236963885071839
Energy: 0.9251971445399941
Energy: 0.9242100213826799
Energy: 1.0828622853125127
Energy: 0.9242100213811585
Energy: 0.9236900857341763
Energy: 0.923327288677351
Energy: 1.060092202013525
Energy: 0.9233272886781118
Energy: 0.9316949524825364
Energy: 0.9277176132353879
Energy: 1.1682614916921152
Energy: 0.9277176132331059
Energy: 0.949347637985041
Energy: 0.9552384411621488
Energy: 1.177059448269284
Energy: 0.9552384411636702
Energy: 1.1071412829945915
Energy: 0.9045766980593883
Energy: 0.9084612743376406
Energy: 0.9045766980609097
Energy: 0.9497629285969921
Energy: 0.902540449300874
Energy: 0.905002060258548
Energy: 0.9025404493016347
Energy: 1.21501755168153
Energy: 0.9017410129377048
Energy: 0.9022147097102647
Energy: 0.9017410129361835
Energy: 1.181077358889029
Energy: 0.9022673430508141
Energy: 0.9024528077181555
Energy: 0.9022673430492928
Energy: 0.9247021310673382
Energy: 0.9518396633512334
Energy: 1.0843349874782566
Energy: 0.9518396633504727
Energy: 0.9262048678958739
Energy: 0.9241325093729473
Energy: 1.0832635055585362
Energy: 0.9241325093729473
Energy: 0.9266376930634375
Energy: 0.926016798558162
Energy: 1.058807158266241
Energy: 0.9260167985589228
Energy: 0.9255460400055562
Energy: 0.9242631105399755
Energy: 0.9442797372947773
Energy: 0.924263110540736
Energy: 1.0635443575564787
Energy: 0.9292835523784765
Energy: 0.9460957200368866
Energy: 0.9292835523777159
Energy: 1.072854365601562
Energy: 1.0021326938765625
Energy: 1.0687171855651614
Energy: 1.0021326938765625
Energy: 1.0597297489404254
Energy: 0.9233871474196802
Energy: 0.9438989073574566
Energy: 0.9233871474212015
Energy: 1.064737351284449
Energy: 0.9245936771824473
Energy: 1.0583788509112713
Energy: 0.9245936771839687
Energy: 1.0835694394589155
Energy: 0.9236100568656983
Energy: 0.9246950857679535
Energy: 0.9236100568656983
Energy: 1.0594248150948116
Energy: 0.923495518013928
Energy: 0.9247470494887967
Energy: 0.9234955180169707
Energy: 1.1685823198658658
Energy: 0.9264276103104926
Energy: 0.9314955743702275
Energy: 0.9264276103112533
Energy: 1.179496217821249
Energy: 0.9526472773503785
Energy: 0.9483066063322384
Energy: 0.9526472773496177
Energy: 0.9026531913134581
Energy: 0.9028531972602564
Energy: 1.1072230730544947
Energy: 0.9028531972617777
Energy: 0.9076695352118248
Energy: 0.9046147537101062
Energy: 0.9503777711250312
Energy: 0.9046147537123884
Energy: 0.9029353063457157
Energy: 0.9027713606812681
Energy: 0.9737588862410973
Energy: 0.9027713606797467
Energy: 0.9018950653062351
Energy: 0.9030630098561859
Energy: 1.1762921208621129
Energy: 0.9030630098561859
Energy: 1.083448230982653
Energy: 0.951243260720529
Energy: 0.9476357439816859
Energy: 0.9512432607212895
Energy: 1.0833155603513367
Energy: 0.9248475963867123
Energy: 0.9281303211044267
Energy: 0.924847596387473
Energy: 1.0584398537427255
Energy: 0.9246569543470983
Energy: 0.927836739035918
Energy: 0.9246569543456115
Energy: 0.9460076404839153
Energy: 0.9234472352074912
Energy: 0.9250005558180041
Energy: 0.9234472352067306

minimum gb energy = 0.900633088612445 eV
minimum distance =  2.28059380565324 Angstroms
sigma value = 1


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

Energy: 1.3568084756183763
Energy: 0.8546532296945601
Energy: 1.0420962316292544
Energy: 0.881123819150393
Energy: 0.9052997051890298
Energy: 0.8825442652626251
Energy: 1.075694694313263
Energy: 0.8825442652626251
Energy: 1.0761298166425985
Energy: 0.9783821134879761
Energy: 1.079374176354855
Energy: 0.9783821134890279
Energy: 0.9020080629663618
Energy: 0.9789214569240794
Energy: 1.0652829514848763
Energy: 0.9789214569177689
Energy: 0.8811916529663874
Energy: 0.8790978718697519
Energy: 1.073615598862342
Energy: 0.8790978718676484
Energy: 0.8789426387341374
Energy: 0.8798710358161121
Energy: 1.060571157040425
Energy: 0.8798710358119051
Energy: 0.8774607346498107
Energy: 0.8783538270263267
Energy: 1.0666710366885992
Energy: 0.8783538270242233
Energy: 0.8865839847611746
Energy: 0.8846857078733119
Energy: 1.2232555388146553
Energy: 0.8846857078785707
Energy: 1.068831943482155
Energy: 0.928223062086419
Energy: 1.2229191684632665
Energy: 0.928223062086419
Energy: 1.0729195931467752
Energy: 0.8856941303940151
Energy: 0.8834078442467512
Energy: 0.8856941303950668
Energy: 1.067445618935734
Energy: 0.8785892115942462
Energy: 0.8778360451656572
Energy: 0.8785892115931945
Energy: 1.2193906559205319
Energy: 0.8814730613537396
Energy: 0.8794963566789671
Energy: 0.8814730613547913
Energy: 1.2197238009338165
Energy: 0.8793661247308977
Energy: 0.8802730423162949
Energy: 0.8793661247298459
Energy: 1.0649774712815772
Energy: 0.9781551016957719
Energy: 1.0785486287963257
Energy: 0.9781551016936683
Energy: 0.9058951324067096
Energy: 0.977223658540517
Energy: 1.07654204011278
Energy: 0.9772236585394652
Energy: 0.9082324922812672
Energy: 0.8810733088870547
Energy: 1.0656327786879731
Energy: 0.8810733088849514
Energy: 0.8794566718608133
Energy: 0.880340822312261
Energy: 1.0743852595627097
Energy: 0.880340822312261
Energy: 0.8835612872225744
Energy: 0.88449101772897
Energy: 1.0629322622573791
Energy: 0.8844910177237112
Energy: 0.8777061021020527
Energy: 0.8789144578000527
Energy: 1.2230086014458834
Energy: 0.8789144578053116
Energy: 0.88089563121281
Energy: 0.8867192276445216
Energy: 1.223217262264752
Energy: 0.8867192276445216
Energy: 1.0732937755593663
Energy: 0.9252434776556208
Energy: 1.0648364357216231
Energy: 0.9252434776556208
Energy: 1.0752622092553898
Energy: 0.8809915852547959
Energy: 0.8838577916007291
Energy: 0.8809915852558478
Energy: 1.0660735796430312
Energy: 0.8789356594686277
Energy: 0.8793196161990193
Energy: 0.8789356594665242
Energy: 1.2198036943613573
Energy: 0.8795515842812216
Energy: 0.8791637162423609
Energy: 0.8795515842833251

minimum gb energy = 0.8546532296945601 eV
minimum distance =  2.28005344956682 Angstroms
sigma value = 17


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

Energy: 1.4495154704211295
Energy: 0.8534111411461165
Energy: 1.0456506589181622
Energy: 0.872262893637502
Energy: 0.886110853394782
Energy: 0.8719996214358932
Energy: 0.9945778432888757
Energy: 0.8719996214358932
Energy: 1.0945261449041688
Energy: 0.8673874093702842
Energy: 1.0156906442774474
Energy: 0.8673874093767849
Energy: 1.14730148160947
Energy: 0.916618807432651
Energy: 0.9867857799864284
Energy: 0.9166188074365516
Energy: 0.9727294220690786
Energy: 0.852248901862372
Energy: 1.1352169779891397
Energy: 0.8522489018604219
Energy: 0.8531968973585438
Energy: 0.8519065026387115
Energy: 1.135801034243273
Energy: 0.8519065026413118
Energy: 0.8529511790754938
Energy: 0.8518514711971726
Energy: 0.9875410415991853
Energy: 0.851851471199773
Energy: 0.859702402867593
Energy: 0.8540739109091229
Energy: 1.1504121918250225
Energy: 0.8540739109071727
Energy: 1.1277590810502756
Energy: 0.8549541470915745
Energy: 1.0947581368316195
Energy: 0.8549541470922245
Energy: 1.0187770273508538
Energy: 0.9201651173358657
Energy: 0.9888030417147371
Energy: 0.9201651173404161
Energy: 1.1244092322719172
Energy: 0.8676787453709613
Energy: 0.8808449758473893
Energy: 0.8676787453709613
Energy: 1.1322836343089526
Energy: 0.8697798270833862
Energy: 0.9887335945307356
Energy: 0.8697798270859864
Energy: 1.1188413782852087
Energy: 0.8672146132650697
Energy: 0.8683158553487554
Energy: 0.8672146132650697
Energy: 1.0183081186843315
Energy: 0.8676423202959722
Energy: 0.869269377978892
Energy: 0.8676423202979224
Energy: 1.1411356270561246
Energy: 0.8701666998946356
Energy: 0.876170821869273
Energy: 0.8701666998920353
Energy: 1.1492120423775478
Energy: 0.869407109467982
Energy: 0.8714342818202007
Energy: 0.8694071094621314
Energy: 0.8685830385028032
Energy: 0.9765458275940022
Energy: 1.1224403660244842
Energy: 0.9765458275966026
Energy: 0.8674833210291676
Energy: 0.8671087351548304
Energy: 1.1290769672188636
Energy: 0.8671087351561307
Energy: 0.8703221033564358
Energy: 0.873556998293713
Energy: 1.0914309222202796
Energy: 0.8735569982911129
Energy: 0.870157256911468
Energy: 0.8675825179746726
Energy: 1.1485879766730647
Energy: 0.8675825179701221
Energy: 0.9947598301178897
Energy: 0.8699921007877163
Energy: 0.9736589520536914
Energy: 0.8699921007916168
Energy: 1.0153669780452286
Energy: 0.8683789825942899
Energy: 1.0983148684557467
Energy: 0.8683789825968902
Energy: 0.9877057138284773
Energy: 0.9148016931004365
Energy: 1.1428844319946272
Energy: 0.9148016931017368
Energy: 1.15963854859368
Energy: 0.8539503244641604
Energy: 0.9721075628066557
Energy: 0.8539503244719611
Energy: 1.1321711206178109
Energy: 0.851796381941683
Energy: 0.8525061010182332
Energy: 0.8517963819325819
Energy: 0.9887504162189532
Energy: 0.8528550806191845
Energy: 0.855646323370602
Energy: 0.8528550806198345
Energy: 1.1482152177698075
Energy: 0.8524028126842417
Energy: 0.8531022239529477
Energy: 0.8524028126842417
Energy: 0.9897726837251396
Energy: 0.8543365750431012
Energy: 1.130681599253614
Energy: 0.8543365750431012
Energy: 1.0036723475581086
Energy: 0.9187666639475153
Energy: 1.0163385979415231
Energy: 0.9187666639520659
Energy: 0.8817086736969991
Energy: 0.8674810631932778
Energy: 1.122559302431528
Energy: 0.867481063195228
Energy: 0.9873578446376253
Energy: 0.867375785761939
Energy: 1.1328400702067363
Energy: 0.8673757857658394
Energy: 0.8676500306523338
Energy: 0.8674139805865101
Energy: 1.1354290333490036
Energy: 0.8674139805832597
Energy: 0.8676489533935368
Energy: 0.8668833836291652
Energy: 1.0194911927139916
Energy: 0.8668833836298153
Energy: 0.8756900519713137
Energy: 0.8721404093101297
Energy: 1.1456503276480952
Energy: 0.8721404093088296
Energy: 1.023987873886997
Energy: 0.8957326595048652
Energy: 1.1681639193374787
Energy: 0.8957326595022649
Energy: 1.303219928978389
Energy: 0.8732801232000917
Energy: 0.8688442541835567
Energy: 0.873280123202692
Energy: 1.1260349167686063
Energy: 0.8670138424521747
Energy: 0.8675166645287385
Energy: 0.8670138424560753
Energy: 1.0956095551471716
Energy: 0.8735975005080011
Energy: 0.8701456398529631
Energy: 0.8735975005080011

minimum gb energy = 0.8517963819325819 eV
minimum distance =  2.28565152474483 Angstroms
sigma value = 89


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

Energy: 1.5348217869774186
Energy: 0.7880094384169459
Energy: 0.7947371945404664
Energy: 0.7920822971719933
Energy: 0.7935870662491449
Energy: 0.872383261233421
Energy: 0.7932093221492731
Energy: 0.8723832612351219
Energy: 0.7953342657370154
Energy: 0.8734730046396368
Energy: 0.810724145934232
Energy: 0.8734730046379359
Energy: 0.7869585277328387
Energy: 0.8741425903998119
Energy: 0.7919644818864204
Energy: 0.8741425903998119
Energy: 0.7910090851719419
Energy: 0.7915341833964475
Energy: 0.8044965049966774
Energy: 0.7915341833981485
Energy: 0.7921740342506317
Energy: 0.7902616030859838
Energy: 0.8031889008165435
Energy: 0.7902616030876848
Energy: 0.7909421258733786
Energy: 0.7894917150963292
Energy: 0.793533623596577
Energy: 0.7894917150980301
Energy: 0.7917798423366553
Energy: 0.7953060973093473
Energy: 0.7853969548341632
Energy: 0.7953060973110483
Energy: 0.7953470521238364
Energy: 0.790718948492753
Energy: 0.7853721789769851
Energy: 0.790718948494454
Energy: 0.807740560847012
Energy: 0.8751844612470043
Energy: 0.7958682125854857
Energy: 0.8751844612453035
Energy: 0.7935079136994011
Energy: 0.8656566160902603
Energy: 0.784629154765126
Energy: 0.8656566160902603
Energy: 0.8028032219669485
Energy: 0.7902962566940436
Energy: 0.793951796785943
Energy: 0.7902962566957445
Energy: 0.8053192618755726
Energy: 0.7928865206574915
Energy: 0.7912388444759235
Energy: 0.7928865206574915
Energy: 0.7929629164123265
Energy: 0.7890405946960003
Energy: 0.789241886143072
Energy: 0.7890405946977012
Energy: 0.7847400145062097
Energy: 0.7918697407669663
Energy: 0.7948289717363397
Energy: 0.7918697407652653

minimum gb energy = 0.784629154765126 eV
minimum distance =  2.30315684254798 Angstroms
sigma value = 13


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

Energy: 1.3552453796211605
Energy: 0.7446822025264771
Energy: 0.9622882639518484
Energy: 0.749601519944192
Energy: 0.7513873457327438
Energy: 0.7497465472227238
Energy: 0.8817680681935195
Energy: 0.749746547221298
Energy: 0.7496655327808052
Energy: 0.7470223234331549
Energy: 0.8985558077895174
Energy: 0.7470223234367196
Energy: 1.0412385131409065
Energy: 0.7503693788023101
Energy: 0.8832310120356252
Energy: 0.7503693787809227
Energy: 0.8877290939340442
Energy: 0.7497051001914853
Energy: 0.8962893644410883
Energy: 0.749705100185069
Energy: 0.8847283893967894
Energy: 0.7489067985251985
Energy: 1.047206793653732
Energy: 0.7489067985316148
Energy: 0.8848531992174778
Energy: 0.7474721119202761
Energy: 0.8803247120481162
Energy: 0.7474721119202761
Energy: 0.8828817031810137
Energy: 0.7468619244245068
Energy: 0.8851434814235128
Energy: 0.7468619244266456
Energy: 0.7458467312242877
Energy: 0.7504361120594459
Energy: 0.8825928636341124
Energy: 0.7504361120565942
Energy: 0.7463931894213898
Energy: 0.7469448667210683
Energy: 0.8840126396211193
Energy: 0.7469448667110873
Energy: 0.7494528190022636
Energy: 0.7467928712192353
Energy: 1.355801410678235
Energy: 0.7467928712085415
Energy: 0.8920099884949766
Energy: 0.7473581620338983
Energy: 0.8849301115903381
Energy: 0.7473581620324725
Energy: 0.8977195870755266
Energy: 0.7926237801432324
Energy: 0.8792451727125661
Energy: 0.7926237801303999
Energy: 0.883193547022957
Energy: 0.7900608983594118
Energy: 1.0414439074059647
Energy: 0.7900608983644022
Energy: 0.8895514491206536
Energy: 0.750142917569691
Energy: 0.8842336758456282
Energy: 0.7501429175739684
Energy: 0.8889092083324546
Energy: 0.7484644926690777
Energy: 0.7524497483742133
Energy: 0.7484644926676518
Energy: 1.0430494728715134
Energy: 0.7469102594733794
Energy: 0.7499892368305427
Energy: 0.7469102594761663
Energy: 0.7495080737770257
Energy: 0.7467020589313268
Energy: 0.7492828157928658
Energy: 0.7467020589420207
Energy: 1.0044887570901269
Energy: 0.7461151895902352
Energy: 0.8797612521311875
Energy: 0.7461151896016418
Energy: 0.8834603548248824
Energy: 0.7460229375979256
Energy: 0.8967922924773104
Energy: 0.74602293758438
Energy: 1.0418576435207239
Energy: 0.7473496814433612
Energy: 0.8799365451812401
Energy: 0.7473496814462129
Energy: 0.8831907029686119
Energy: 0.803044052996548
Energy: 0.8900196400389273
Energy: 0.8030440529958353
Energy: 0.880518180058969
Energy: 0.7509300757955432
Energy: 0.8956461514547466
Energy: 0.7509300757955432
Energy: 0.7514205459226208
Energy: 0.7459754456719078
Energy: 0.8832284850103023
Energy: 0.7459754456818887
Energy: 0.8811104601148213
Energy: 0.7477748397330994
Energy: 0.885470234648528
Energy: 0.7477748397338123
Energy: 0.7485349384364716
Energy: 0.7462287137795319
Energy: 0.8938944501911729
Energy: 0.746228713788087
Energy: 0.7464971471251987
Energy: 0.7455997909089267
Energy: 1.0448516925868878
Energy: 0.7455997909082138
Energy: 0.7466990682130294
Energy: 0.7517993078869962
Energy: 0.750634428793654
Energy: 0.7517993078955512
Energy: 1.043913700207555
Energy: 0.7467631946096994
Energy: 1.0052573628567956
Energy: 0.746763194624606
Energy: 0.8961021357869385
Energy: 0.7903683485817689
Energy: 1.0409592368325926
Energy: 0.7903683485789174
Energy: 0.8844235266663297
Energy: 0.7917212295439419
Energy: 1.0425032931436844
Energy: 0.7917212295475063
Energy: 0.887669697912891
Energy: 0.7480201300694872
Energy: 0.8786908974136389
Energy: 0.7480201300666356
Energy: 0.8910551705107881
Energy: 0.7499430719034667
Energy: 0.7467516225955483
Energy: 0.7499430718984762
Energy: 1.0420138049240184
Energy: 0.7456839672608767
Energy: 0.746694356027234
Energy: 0.7456839672601638
Energy: 1.0043757453380808
Energy: 0.7478321185788178
Energy: 0.7514370196447272
Energy: 0.7478321185759661

minimum gb energy = 0.7446822025264771 eV
minimum distance =  2.29928768144392 Angstroms
sigma value = 37


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

Energy: 1.182401470673505
Energy: 0.6802155071824044
Energy: 0.683201435432331
Energy: 0.6811091785027703
Energy: 1.1272790787931402
Energy: 0.6795688617976154
Energy: 0.9077171817047495
Energy: 0.6795688617976154
Energy: 1.1295489082902304
Energy: 0.6778754173095655
Energy: 0.9116947034177816
Energy: 0.6778754173095655
Energy: 1.1287037433043052
Energy: 0.7614123742289722
Energy: 0.9093169136866321
Energy: 0.7614123742301988
Energy: 1.1338942343634135
Energy: 0.769269175705853
Energy: 0.9089298054305761
Energy: 0.769269175705853
Energy: 0.9119936783722891
Energy: 0.679522316419799
Energy: 0.9232599206699288
Energy: 0.6795223164185724
Energy: 0.6796548529623315
Energy: 0.6776942603167239
Energy: 1.1345868998773765
Energy: 0.6776942603167239
Energy: 0.6873477886996396
Energy: 0.6794172465111733
Energy: 1.1293572036209851
Energy: 0.6794172465111733
Energy: 0.6794322425862261
Energy: 0.6828571918296317
Energy: 1.1290278903717976
Energy: 0.6828571918284051
Energy: 0.6781829717050827
Energy: 0.6794003852090206
Energy: 1.1379799887778772
Energy: 0.679400385207794
Energy: 0.6832014354102531
Energy: 0.68110917829066
Energy: 1.1824014706722785
Energy: 0.6802155071824044
Energy: 0.907717181705976
Energy: 0.6795688617976154
Energy: 1.1272790787931402
Energy: 0.6795688617976154
Energy: 0.9116947034190082
Energy: 0.6778754173107919
Energy: 1.1295489082877772
Energy: 0.6778754173071123
Energy: 0.9093169136878587
Energy: 0.7614123742301988
Energy: 1.1287037433043052
Energy: 0.7614123742301988
Energy: 0.908929805428123
Energy: 0.7692691757046265
Energy: 1.1338942343646399
Energy: 0.7692691757070795
Energy: 0.9232599206711554
Energy: 0.6795223164185724
Energy: 0.9119936783710625
Energy: 0.6795223164185724
Energy: 1.134586899878603
Energy: 0.6776942603154974
Energy: 0.6796548529635581
Energy: 0.6776942603179504
Energy: 1.129357203632024
Energy: 0.6794172465123999
Energy: 0.6873477887008661
Energy: 0.6794172465111733
Energy: 1.1290278903705988
Energy: 0.6828571918296317
Energy: 0.6794322425886793
Energy: 0.6828571918271785
Energy: 1.1379799887741975
Energy: 0.6794003852090206
Energy: 0.6781829717026295
Energy: 0.679400385207794

minimum gb energy = 0.6776942603154974 eV
minimum distance =  2.30628893570047 Angstroms
sigma value = 25


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

Energy: 1.419761740329698
Energy: 0.608421484570974
Energy: 0.8452228428989023
Energy: 0.6027690618426965
Energy: 0.977884329074259
Energy: 0.6024906201658716
Energy: 0.7879254371497288
Energy: 0.6024906201658716
Energy: 1.2769776663819927
Energy: 0.601860843862081
Energy: 0.7913714170744375
Energy: 0.6018608438639966
Energy: 0.983280659933142
Energy: 0.6039706512936089
Energy: 0.7880179200935008
Energy: 0.6039706512926513
Energy: 0.9823146724851203
Energy: 0.6714826802076621
Energy: 1.1258378208192175
Energy: 0.6714826802057465
Energy: 0.9744578171963861
Energy: 0.6697599665562289
Energy: 1.1285689334676892
Energy: 0.6697599665562289
Energy: 0.9779667622110143
Energy: 0.671482860731993
Energy: 0.982250981418655
Energy: 0.671482860731993
Energy: 0.787761423513529
Energy: 0.6040820931501478
Energy: 1.1232989674477476
Energy: 0.6040820931472747
Energy: 0.791223529321544
Energy: 0.6015936473965986
Energy: 1.1261428743719493
Energy: 0.6015936473965986
Energy: 0.7949187555873153
Energy: 0.6024698962769507
Energy: 1.1265508363639554
Energy: 0.6024698962788663
Energy: 0.6035943934495055
Energy: 0.6032355285031094
Energy: 1.2018763163337334
Energy: 0.6032355285040671
Energy: 0.6080218275574486
Energy: 0.6024043577066219
Energy: 1.1261661684432114
Energy: 0.6024043577056641
Energy: 0.6031772123069867
Energy: 0.6017273959606945
Energy: 0.9747293236706589
Energy: 0.6017273959587788
Energy: 0.6093658693316012
Energy: 0.6043182690143668
Energy: 1.2716706019899693
Energy: 0.6043182690172402
Energy: 0.791260939327561
Energy: 0.6011725027125524
Energy: 1.1279976466228212
Energy: 0.6011725027115946
Energy: 0.787970240283502
Energy: 0.6035490108870536
Energy: 1.2810974828934412
Energy: 0.6035490108889691
Energy: 0.9822370627734532
Energy: 0.6021371467085436
Energy: 1.2727101918327621
Energy: 0.6021371467113733
Energy: 0.7933556021888071
Energy: 0.6747625911738049
Energy: 0.9823988927540659
Energy: 0.6747625911718893
Energy: 1.1273282480727786
Energy: 0.6707378795707819
Energy: 0.9768792449657774
Energy: 0.6707378795717397
Energy: 0.9832869767239366
Energy: 0.6704868151549165
Energy: 0.9751411453332524
Energy: 0.6704868151539587
Energy: 1.2024590999099352
Energy: 0.6065252870008677
Energy: 0.794551372341192
Energy: 0.6065252870056567
Energy: 1.1267647317272746
Energy: 0.6007164592471004
Energy: 0.6022112130323121
Energy: 0.6007164592471004
Energy: 1.1239464359936158
Energy: 0.6053893798678669
Energy: 0.7875314103489024
Energy: 0.6053893798669091
Energy: 1.134053036763897
Energy: 0.604755336585459
Energy: 0.6097671270146268
Energy: 0.6047553365845012
Energy: 1.1276249896795372
Energy: 0.6011660475040834
Energy: 0.6017806189179005
Energy: 0.601166047502168
Energy: 1.2708670226690344
Energy: 0.6033989266452074
Energy: 0.6070833054130298
Energy: 0.6033989266452074

minimum gb energy = 0.6007164592471004 eV
minimum distance =  2.30457340957448 Angstroms
sigma value = 41


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

Energy: 1.5681120596233606
Energy: 0.55421574805285
Energy: 0.79920192265375
Energy: 0.548502096027085
Energy: 1.1225983499286005
Energy: 0.5470628024770257
Energy: 0.7008089804475449
Energy: 0.5470628024605361
Energy: 1.3757385675830602
Energy: 0.5460209250847022
Energy: 0.7058418214480009
Energy: 0.546020925083917
Energy: 1.131591862567066
Energy: 0.5491465920896063
Energy: 0.8682086936809058
Energy: 0.5491465920872506
Energy: 1.1295147778986658
Energy: 0.5435414979958498
Energy: 0.9956545598248434
Energy: 0.5435414979989907
Energy: 1.1244418797809026
Energy: 0.545416904081901
Energy: 0.9911839913180776
Energy: 0.545416904081901
Energy: 1.1285318066341563
Energy: 0.6030849355625356
Energy: 1.1288252578566302
Energy: 0.6030849355617505
Energy: 0.9993609141965144
Energy: 0.6086226996663004
Energy: 0.9960253854319276
Energy: 0.6086226996655153
Energy: 0.8567931441233468
Energy: 0.5446004302490285
Energy: 1.2492296616984442
Energy: 0.5446004302560955
Energy: 0.8564074545928876
Energy: 0.5437601547674104
Energy: 1.1290840114238883
Energy: 0.5437601547689809
Energy: 0.7107883648056127
Energy: 0.5466701477724484
Energy: 1.2447513439858073
Energy: 0.5466701477740189
Energy: 0.7014647434450896
Energy: 0.5445357479495789
Energy: 1.2476501680929177
Energy: 0.5445357479464381
Energy: 0.7015455465594083
Energy: 0.545025727520819
Energy: 1.2481159907110555
Energy: 0.5450257275192485
Energy: 0.5554826577362126
Energy: 0.5452966764501479
Energy: 1.2441129070774768
Energy: 0.545296676450933
Energy: 0.5465637007892507
Energy: 0.5457606783130414
Energy: 1.24778533385131
Energy: 0.5457606783146118
Energy: 0.5472839678510036
Energy: 0.5470252042617123
Energy: 1.3768897008830678
Energy: 0.5470252042656384
Energy: 0.7080200786347846
Energy: 0.5459072192302681
Energy: 1.3664374065309888
Energy: 0.5459072192294828
Energy: 0.699735115768222
Energy: 0.5437029227634486
Energy: 1.37061533388227
Energy: 0.5437029227658042
Energy: 0.7028419080218056
Energy: 0.5461068720454683
Energy: 1.1266972227106493
Energy: 0.5461068720478239
Energy: 0.9916666545331848
Energy: 0.5471905246451515
Energy: 1.1244158869321985
Energy: 0.5471905246451515
Energy: 0.9991967307541871
Energy: 0.54469440193733
Energy: 1.1264149459451158
Energy: 0.5446944019726649
Energy: 0.9925311914303624
Energy: 0.6020999652720991
Energy: 1.1313959104148474
Energy: 0.6020999652713138
Energy: 1.2498522470879054
Energy: 0.5999693317902168
Energy: 1.1219560842208276
Energy: 0.5999693317917872
Energy: 0.9952864564449989
Energy: 0.6032431694258145
Energy: 0.9917405581798733
Energy: 0.6032431694273851
Energy: 1.2472522917319282
Energy: 0.544326698061931
Energy: 0.8541485619633689
Energy: 0.5443266980329134
Energy: 1.25021581890271
Energy: 0.5463002535261064
Energy: 0.9919799893285128
Energy: 0.5463002535284622
Energy: 1.2551477938104143
Energy: 0.5464182853100318
Energy: 0.7032019996879494
Energy: 0.5464182853045353
Energy: 1.127554149076126
Energy: 0.5443989316150242
Energy: 0.6988446225418914
Energy: 0.5443989316126686
Energy: 1.2535272107534066
Energy: 0.5455348776840099
Energy: 0.7071262880298677
Energy: 0.5455348776832246
Energy: 1.2510556686281749
Energy: 0.5452394040244051
Energy: 0.5468857161480507
Energy: 0.5452394040251903
Energy: 1.1288931313452568
Energy: 0.545442886305593
Energy: 0.5460668749710595
Energy: 0.545442886305593
Energy: 1.368836254306531
Energy: 0.5449945808940418
Energy: 0.5478326754820333
Energy: 0.544994580901894

minimum gb energy = 0.5435414979958498 eV
minimum distance =  2.30515093743901 Angstroms
sigma value = 15


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

Energy: 1.3526399516100112
Energy: 0.5107859850856119
Energy: 0.763074836993309
Energy: 0.5075376471795235
Energy: 1.2232455373465951
Energy: 0.5035053081576656
Energy: 0.6337184634853259
Energy: 0.5035053081550048
Energy: 1.4429913415323072
Energy: 0.5028406951901069
Energy: 0.6383374945209701
Energy: 0.5028406951914374
Energy: 1.235362949930828
Energy: 0.5030905628787727
Energy: 0.8952660035056204
Energy: 0.5030905628807683
Energy: 1.229211806254858
Energy: 0.5000786405670208
Energy: 0.8870075971385896
Energy: 0.5000786405716771
Energy: 1.2281152701305216
Energy: 0.5007201007827667
Energy: 0.8853461039005608
Energy: 0.5007201007887535
Energy: 1.0050652892667902
Energy: 0.5018086321435653
Energy: 1.114554563397823
Energy: 0.5018086321295961
Energy: 1.1185795991931589
Energy: 0.5524553597319666
Energy: 0.8852628470972113
Energy: 0.5524553597279754
Energy: 1.0037430662088402
Energy: 0.5478627466098773
Energy: 1.1132086920895716
Energy: 0.5478627466237859
Energy: 1.0022875799003619
Energy: 0.5485623933060002
Energy: 1.2318638750163882
Energy: 0.5485623933060002
Energy: 0.8924238726608451
Energy: 0.5027626406803868
Energy: 1.1262504673948472
Energy: 0.502762640677726
Energy: 0.762951065358511
Energy: 0.4995801502572722
Energy: 1.331067079257486
Energy: 0.4995801502579374
Energy: 0.8863693817819265
Energy: 0.5011893615645824
Energy: 1.3338441755809154
Energy: 0.5011893615652476
Energy: 0.6431519906698825
Energy: 0.5024257238360451
Energy: 1.1238104836194234
Energy: 0.5024257238180848
Energy: 0.6317173182458663
Energy: 0.5004904297678129
Energy: 1.2283824285036535
Energy: 0.5004904297664824
Energy: 0.6393410548253876
Energy: 0.5049612107146834
Energy: 1.3362850473355365
Energy: 0.5049612107126876
Energy: 0.5082939222334146
Energy: 0.5036465871655597
Energy: 1.3401158998221057
Energy: 0.5036465871635639
Energy: 0.5008768937486766
Energy: 0.5008778045614716
Energy: 1.227992343605527
Energy: 0.5008778045621368
Energy: 0.5081627042296869
Energy: 0.5025625343802708
Energy: 1.230560784960836
Energy: 0.5025625343822663
Energy: 0.6411535152134887
Energy: 0.5066654828387755
Energy: 1.4450566528918771
Energy: 0.5066654828354495
Energy: 0.6299286267277034
Energy: 0.5006120314356814
Energy: 1.2273409363324574
Energy: 0.5006120314336858
Energy: 0.6439179454775654
Energy: 0.5058837404949607
Energy: 1.2342466929097466
Energy: 0.5058837404956259
Energy: 0.8857921951785236
Energy: 0.5018933328352566
Energy: 1.2258682822669456
Energy: 0.5018933328325959
Energy: 0.887479668101292
Energy: 0.49988526399790856
Energy: 1.3330794599378928
Energy: 0.4998852639945826
Energy: 0.8934008868447587
Energy: 0.5023752864619955
Energy: 1.0124361760408052
Energy: 0.50237528646
Energy: 1.1157944287260728
Energy: 0.5484105790835027
Energy: 1.2344372964513617
Energy: 0.5484105790828375
Energy: 0.8863520871558891
Energy: 0.5483781393662274
Energy: 1.1138095071451357
Energy: 0.5483781393635667
Energy: 1.1194066467551067
Energy: 0.5530494699543399
Energy: 1.01142313726862
Energy: 0.5530494699723
Energy: 1.1191374893735886
Energy: 0.5082043652132426
Energy: 1.1152880874503768
Energy: 0.5082043652105819
Energy: 1.115745744825441
Energy: 0.5010970220472254
Energy: 0.8862465836379195
Energy: 0.501097022041904
Energy: 1.2272872096435063
Energy: 0.5004407507135926
Energy: 0.7631553799758176
Energy: 0.5004407507135926
Energy: 1.1222571761514135
Energy: 0.5057563296343682
Energy: 0.8932325609932638
Energy: 0.5057563296356987
Energy: 1.3347299013795952
Energy: 0.5026642859443577
Energy: 0.6398864625141045
Energy: 0.5026642859456881
Energy: 1.3301912157981712
Energy: 0.502255409457006
Energy: 0.6384344853263731
Energy: 0.5022554094596668
Energy: 1.3289054245122647
Energy: 0.504731202739601
Energy: 0.5055024742276303
Energy: 0.5047312027369403
Energy: 1.3305999835054763
Energy: 0.504637426656831
Energy: 0.5022176659257903
Energy: 0.5046374266541702
Energy: 1.4401102843562443
Energy: 0.5029124319129585
Energy: 0.5039932670580776
Energy: 0.5029124319096325

minimum gb energy = 0.4995801502572722 eV
minimum distance =  2.30197851000523 Angstroms
sigma value = 85


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

Energy: 1.4520555153263022
Energy: 0.45089273302860167
Energy: 0.4536914932737592
Energy: 0.45259072292574637
Energy: 1.2851581138452988
Energy: 0.45184972379915206
Energy: 0.5675168845387192
Energy: 0.451849723799729
Energy: 1.286973065491787
Energy: 0.45143283575734205
Energy: 0.5717652598501919
Energy: 0.4514328357567651
Energy: 1.0873770369978237
Energy: 0.45296909159547327
Energy: 0.7897958238269196
Energy: 0.45296909160124244
Energy: 1.2898257429945477
Energy: 0.44932738427579766
Energy: 0.7896053163671537
Energy: 0.4493273842763746
Energy: 1.0915390996565766
Energy: 0.4505321511576436
Energy: 0.7904843468358262
Energy: 0.4505321511582205
Energy: 1.0888512010826272
Energy: 0.45143733521064805
Energy: 0.9968155511302023
Energy: 0.4514373351385588
Energy: 1.1941760496210345
Energy: 0.4496059581140068
Energy: 0.7860357871710412
Energy: 0.4496059581370837
Energy: 1.0906998231827465
Energy: 0.4501682491766507
Energy: 0.9921732628195744
Energy: 0.45016824917895837
Energy: 1.0942465765508507
Energy: 0.5336368342423362
Energy: 1.1877417339372602
Energy: 0.5336368342394516
Energy: 0.992609604308982
Energy: 0.5338926836037291
Energy: 0.9909940890812181
Energy: 0.5338926835322432
Energy: 0.8953905692192627
Energy: 0.45071238653735396
Energy: 1.1881679400980028
Energy: 0.45071238653216167
Energy: 0.991967436932782
Energy: 0.4496161422200527
Energy: 1.1892393874242992
Energy: 0.4496161422194758
Energy: 0.7894743992265848
Energy: 0.4507266199896821
Energy: 0.9889834376830964
Energy: 0.4507266199891052
Energy: 0.6744776282200514
Energy: 0.44955982471780154
Energy: 1.3778806919519233
Energy: 0.44955982472010925
Energy: 0.7933106399500253
Energy: 0.45361647662681154
Energy: 1.1905082306104564
Energy: 0.45361647662681154
Energy: 0.5751004213877788
Energy: 0.4540759760764653
Energy: 1.1868695873525026
Energy: 0.4540759760758884
Energy: 0.5632423388936301
Energy: 0.44990066134026796
Energy: 1.2889522410437093
Energy: 0.4499006613414218
Energy: 0.5685732713530153
Energy: 0.4504527534920747
Energy: 1.376534590448936
Energy: 0.4504527534920747
Energy: 0.45572853923655277
Energy: 0.45213802361494926
Energy: 1.376340298878544
Energy: 0.4521380236126415
Energy: 0.45094872241666095
Energy: 0.449812439945101
Energy: 1.289497304628462
Energy: 0.449812439945101
Energy: 0.45461862010325527
Energy: 0.4525763987002564
Energy: 1.2830951157640262
Energy: 0.45257639869910266
Energy: 0.5719732101793149
Energy: 0.4527617552045129
Energy: 1.2859159584400643
Energy: 0.45276175520682055
Energy: 0.5651666582950355
Energy: 0.449688431273737
Energy: 1.3789565308372784
Energy: 0.44968843127546776
Energy: 0.5698144382871665
Energy: 0.4551117017087717
Energy: 1.0876969803679088
Energy: 0.4551117017116563
Energy: 0.7898911816229942
Energy: 0.45032854346764617
Energy: 1.2882565388457106
Energy: 0.45032854346937695
Energy: 0.7893949912565397
Energy: 0.4495534992502274
Energy: 1.2859214037755502
Energy: 0.4495534992502274
Energy: 0.7904778135934301
Energy: 0.4513816397376963
Energy: 1.0892830032600547
Energy: 0.4513816397405809
Energy: 0.9964985340053698
Energy: 0.4494261692486887
Energy: 1.2890378875205009
Energy: 0.44942616925215023
Energy: 0.9932909217342752
Energy: 0.44965791582825004
Energy: 1.091177661537282
Energy: 0.4496579158276731
Energy: 1.0987714527875585
Energy: 0.5339639862483775
Energy: 0.8935581525591675
Energy: 0.5339639862495312
Energy: 0.9908556977449633
Energy: 0.5341066986961863
Energy: 1.0974653335168594
Energy: 0.5341066986950326
Energy: 1.190022783518329
Energy: 0.4499780210808898
Energy: 0.8917917875188509
Energy: 0.44997802108550516
Energy: 1.2910842363343502
Energy: 0.44942129912249035
Energy: 0.892887745381421
Energy: 0.44942129912479806
Energy: 0.9888136750151162
Energy: 0.4524546436440203
Energy: 0.7895927455426053
Energy: 0.452454643479099
Energy: 1.3802923067498567
Energy: 0.4495027560548871
Energy: 0.7886441028154841
Energy: 0.4495027560566178
Energy: 1.3805560163184571
Energy: 0.450598555422254
Energy: 0.7894952976170698
Energy: 0.45059855541994637
Energy: 1.1867028568075442
Energy: 0.4539274378228383
Energy: 0.568456742736883
Energy: 0.4539274378228383
Energy: 1.2891140295999557
Energy: 0.4494594288770206
Energy: 0.564713003528937
Energy: 0.4494594288770206
Energy: 1.2859365420204663
Energy: 0.45350230719505386
Energy: 0.5729570469681258
Energy: 0.45350230719678464
Energy: 1.1852722147540824
Energy: 0.4518883204163367
Energy: 0.45217539313727717
Energy: 0.45188832041460586
Energy: 1.2891696071473835
Energy: 0.4496894517776442
Energy: 0.45016703199411984
Energy: 0.4496894517776442
Energy: 1.2830113365020477
Energy: 0.4505483402156998
Energy: 0.45074368076928395
Energy: 0.4505483402156998

minimum gb energy = 0.44932738427579766 eV
minimum distance =  2.30573921239805 Angstroms
sigma value = 113


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

Energy: 0.015446961857929433
Energy: 0.016026513872708346
Energy: 1.110413511990552
Energy: 0.3805141145254205
Energy: 0.01613148927353574
Energy: 0.10719042837863221
Energy: 0.8334150435686479
Energy: 0.10719042837949458
Energy: 0.01605277990372667
Energy: 0.10560353187840626
Energy: 0.831769185607539
Energy: 0.10560353187968752
Energy: 0.017141278135960232
Energy: 0.107657470754668
Energy: 0.8331946103056346
Energy: 0.10765747075639276
Energy: 0.8326265527814267
Energy: 0.10719914528996434
Energy: 0.8336754148656603
Energy: 0.10719914528779607
Energy: 0.015893606333141814
Energy: 0.10532333146585422
Energy: 0.8315951822203943
Energy: 0.1053233314667166

minimum gb energy = 0.015446961857929433 eV
minimum distance =  2.52267109213049 Angstroms
sigma value = 1