Model name: model_name=EAM_Dynamo_FischerSchmitzEich_2019_CuNi__MO_266134052596_000
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=3.615000084042549
cohesive_energy=3.540278406876014
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=[1.450064382191406e-19, 2.2218985560312e-19, 2.8001080814754597e-19, 3.2501434761997194e-19, 3.61112989360626e-19, 3.9086540945400596e-19, 4.1578886917250993e-19, 4.367950070208839e-19, 4.54813085446848e-19, 4.70746732071978e-19, 4.85161515248076e-19, 4.98281739703902e-19, 5.10166685974914e-19, 5.208371823573539e-19, 5.303140571474639e-19, 5.38624547348022e-19, 5.457974921384399e-19, 5.5185371981495995e-19, 5.5682367173362795e-19, 5.60747402310294e-19, 5.63672976843978e-19, 5.65669288929942e-19, 5.6680843651671595e-19, 5.67170528436e-19, 5.667908125737419e-19, 5.6557636268517e-19, 5.63387789403126e-19, 5.6004885329787e-19, 5.553384539939099e-19, 5.48984221463466e-19, 5.40624063787254e-19, 5.29801360624584e-19, 5.1592490879751e-19, 4.9826892229082995e-19, 4.75963419192282e-19, 4.47983006456106e-19, 4.13066771071344e-19, 3.69530825395662e-19, 3.14976711007962e-19, 2.4603985697684397e-19, 1.5817056231473818e-19, 4.535649898489619e-20, -1.002983401180242e-19, -2.89780881261678e-19, -5.394961314369179e-19, -8.7268157989029e-19, -1.321846992702288e-18, -1.9412773185861e-18, -2.8278257372436595e-18, -4.15178439874956e-18, -6.214458640893839e-18, -9.63174118355244e-18, -1.5870328604554318e-17]
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: 0.013654756235649528
Energy: 0.01441150748507855
Energy: 0.6375965232670301
Energy: 0.09843038709032917
Energy: 0.014411507487517726
Energy: 0.7505634215452067
Energy: 0.014411507487517726
Energy: 0.7505634215494928
Energy: 0.6375965232768216
Energy: 0.014411507487517726
Energy: 0.013654756235649528
Energy: 0.014411507487517726
Energy: 0.09843038709032917
Energy: 0.7505634215494928
Energy: 0.014411507486925355
Energy: 0.7505634215457991

minimum gb energy = 0.013654756235649528 eV
minimum distance =  2.49302441040393 Angstroms
sigma value = 1


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

Energy: 1.2214025398870405
Energy: 0.7831317716965998
Energy: 0.8397816486789157
Energy: 0.8386512864945694
Energy: 0.822723766260814
Energy: 0.8581469379903433
Energy: 0.8024869898860283
Energy: 0.858146937991104
Energy: 0.839762343025144
Energy: 0.8388905470621818
Energy: 1.3236109979990327
Energy: 0.8388905470621818
Energy: 0.8031763977677369
Energy: 0.8010862303655476
Energy: 0.802092793946327
Energy: 0.8010862303655476
Energy: 1.1366782298313693
Energy: 0.801494301923357
Energy: 0.8037490123431683
Energy: 0.8014943019241177
Energy: 0.8074253074301294
Energy: 0.9067438771345279
Energy: 0.8017748161764348
Energy: 0.9067438771330064
Energy: 0.847150627341706
Energy: 0.871246796113611
Energy: 0.845741749178678
Energy: 0.8712467961120898
Energy: 0.848579050141549
Energy: 0.8684645273774488
Energy: 0.8746114792209447
Energy: 0.8684645273789703
Energy: 0.8630818196924503
Energy: 0.9110333101542779
Energy: 0.8637928758830842
Energy: 0.9110333101535172
Energy: 0.8717509937901761
Energy: 0.8990185493067552
Energy: 0.8639341703213784
Energy: 0.8990185493090372
Energy: 0.8614516168135384
Energy: 0.9105778982713499
Energy: 0.8633374263709014
Energy: 0.9105778982721106
Energy: 0.8471722708822172
Energy: 0.9095044823925658
Energy: 0.8774501091283213
Energy: 0.9095044823918051
Energy: 0.8662981321255808
Energy: 0.8707956263098474
Energy: 0.8229787005761017
Energy: 0.8707956263113688
Energy: 0.8067536297474582
Energy: 0.8719266088862444
Energy: 0.848176435775505
Energy: 0.8719266088862444
Energy: 0.8238610954072167
Energy: 0.8009406867290072
Energy: 0.8007833004912368
Energy: 0.8009406867282467
Energy: 0.8282151222119752
Energy: 0.8025548681096486
Energy: 0.8019699050002618
Energy: 0.8025548681096486
Energy: 0.8388778895099727
Energy: 0.8380910584739246
Energy: 0.7791098611766657
Energy: 0.8380910584731639
Energy: 0.8024044532503619
Energy: 0.8018392209024936
Energy: 0.8224702090571321
Energy: 0.8018392209024936
Energy: 0.8028089745505563
Energy: 0.8392631222647354
Energy: 0.8397818878348058
Energy: 0.8392631222647354
Energy: 0.8035516913211023
Energy: 0.8016141318158698
Energy: 0.8032355539331564
Energy: 0.8016141318173912
Energy: 0.8023224100291502
Energy: 0.8038483939607824
Energy: 0.8462072224558654
Energy: 0.8038483939607824
Energy: 0.8022774028789238
Energy: 0.8026952043419991
Energy: 0.8040164815145452
Energy: 0.8026952043419991
Energy: 0.846102071717809
Energy: 0.8723769086820184
Energy: 0.8460122746438674
Energy: 0.8723769086820184
Energy: 0.8752718321024834
Energy: 0.8722956358261993
Energy: 0.8507191243032437
Energy: 0.8722956358254387
Energy: 0.8647238832501747
Energy: 0.9110967472096912
Energy: 0.8631995952907455
Energy: 0.9110967472112127
Energy: 0.8646981934226594
Energy: 0.9083557009386592
Energy: 0.873517408957991
Energy: 0.9083557009401808
Energy: 0.8631653719796
Energy: 0.9100065465078376
Energy: 0.8614815779895523
Energy: 0.9100065465070768
Energy: 0.8751804833075495
Energy: 0.9092253215505104
Energy: 0.8674563947021369
Energy: 0.9092253215489889
Energy: 0.8241557468434523
Energy: 0.8714951355990699
Energy: 0.8684644303055634
Energy: 0.8714951355990699
Energy: 0.848056181586474
Energy: 0.8726998601214242
Energy: 0.8561528045818169
Energy: 0.8726998601214242
Energy: 0.8001722553320474
Energy: 0.800614254003112
Energy: 0.82288351328723
Energy: 0.8006142540046335
Energy: 0.8021013353408358
Energy: 0.8023960237999966
Energy: 0.8281006749653694
Energy: 0.8023960237999966
Energy: 0.7793093191082183
Energy: 0.8036860825693006
Energy: 0.8401859205980131
Energy: 0.8036860825685398

minimum gb energy = 0.7791098611766657 eV
minimum distance =  2.27850037737291 Angstroms
sigma value = 1


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

Energy: 1.3845131228570648
Energy: 0.8210168666019507
Energy: 0.8843676299729503
Energy: 0.8839631833920357
Energy: 0.8711171482619586
Energy: 0.9015896505472488
Energy: 0.8441442020335437
Energy: 0.9015896505463816
Energy: 0.8838748281561709
Energy: 0.8846119238919147
Energy: 1.2750372230475933
Energy: 0.8846119238893129
Energy: 0.8471858754064021
Energy: 0.8444428701646304
Energy: 0.8440430793725383
Energy: 0.8444428701611612
Energy: 0.8455031401647904
Energy: 0.8453000353531122
Energy: 0.8445084222375225
Energy: 0.8453000353522448
Energy: 0.8477048592033593
Energy: 0.9445625985017155
Energy: 0.8456212992293511
Energy: 0.9445625985017155
Energy: 0.899668670014988
Energy: 0.9261703094280643
Energy: 0.8958917788162648
Energy: 0.9261703094263298
Energy: 0.8974875937666669
Energy: 0.9295428577016008
Energy: 0.8742563508334144
Energy: 0.9295428577007335
Energy: 0.8973126458543687
Energy: 0.9643955241609364
Energy: 0.909198243865017
Energy: 0.9643955241574672
Energy: 0.9253328245196181
Energy: 0.9658483484457279
Energy: 0.899785676096357
Energy: 0.9658483484431261
Energy: 0.871264507770282
Energy: 0.9258940705446136
Energy: 0.90052683602773
Energy: 0.9258940705472156
Energy: 0.8985229694034268
Energy: 0.9277313508097158
Energy: 0.8478564924465236
Energy: 0.9277313508114504
Energy: 0.8443691987840556
Energy: 0.8442856220219961
Energy: 0.8720020972642208
Energy: 0.8442856220211288
Energy: 0.8432581808824645
Energy: 0.8441347127482893
Energy: 0.8163247001875237
Energy: 0.8441347127491565
Energy: 0.8156540652009406
Energy: 0.8835668497755215
Energy: 0.88495406663711
Energy: 0.8835668497833273
Energy: 0.8725680323013928
Energy: 0.844473070169934
Energy: 0.8437851332034845
Energy: 0.8444730701681994
Energy: 0.8840024812736875
Energy: 0.8842838297471932
Energy: 0.8449592475810096
Energy: 0.8842838297471932
Energy: 0.8469826875407154
Energy: 0.8442037843344847
Energy: 0.8467581754361226
Energy: 0.8442037843362195
Energy: 0.8445260488143728
Energy: 0.8474764578975758
Energy: 0.846651268942577
Energy: 0.8474764578941064
Energy: 0.8476006102541358
Energy: 0.8453016134074205
Energy: 0.8453922344730543
Energy: 0.845301613409155
Energy: 0.8968270155029451
Energy: 0.928068099380619
Energy: 0.8960615507912649
Energy: 0.9280680993771496
Energy: 0.8960810476172347
Energy: 0.9275456810373294
Energy: 0.8753250479273198
Energy: 0.9275456810373294
Energy: 0.8969161593528303
Energy: 0.9647557516400237
Energy: 0.9101920488534028
Energy: 0.9647557516391564
Energy: 0.9250496354663617
Energy: 0.963513895993255
Energy: 0.9181966439912305
Energy: 0.9635138959949896
Energy: 0.8724976069863346
Energy: 0.9263829831902423
Energy: 0.9301671214928204
Energy: 0.9263829831893751
Energy: 0.8984948054564726
Energy: 0.9265674454331196
Energy: 0.8489064871840595
Energy: 0.9265674454331196
Energy: 0.843701825410678
Energy: 0.8438483989941824
Energy: 0.8726359369071363
Energy: 0.843848398989846
Energy: 0.8431828938492584
Energy: 0.8443126247911327
Energy: 0.8161223747975616
Energy: 0.8443126247911327
Energy: 0.8156826814788455
Energy: 0.8469200519454807
Energy: 0.8866016891920316
Energy: 0.8469200519446134

minimum gb energy = 0.8156540652009406 eV
minimum distance =  2.27564898918321 Angstroms
sigma value = 25


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

Energy: 1.3247224745646722
Energy: 0.8606574076370915
Energy: 0.9335587995192468
Energy: 0.93346934072427
Energy: 0.9317239253168924
Energy: 0.94813422257886
Energy: 0.8950373911321408
Energy: 0.94813422257886
Energy: 0.933049218975737
Energy: 0.9335507008211288
Energy: 0.8924704391134579
Energy: 0.9335507008201206
Energy: 0.8966272773110193
Energy: 0.8934002368417083
Energy: 0.894906525021989
Energy: 0.8934002368417083
Energy: 0.8946822914820524
Energy: 0.893745460914643
Energy: 0.8940478369726044
Energy: 0.893745460914643
Energy: 0.8971554948314686
Energy: 0.8948038924799868
Energy: 0.8930949122138467
Energy: 0.894803892480995
Energy: 0.9458908878391598
Energy: 0.9933640276223448
Energy: 0.9438693274363783
Energy: 0.993364027623353
Energy: 0.944687062364321
Energy: 0.9952736862815077
Energy: 0.8698537134031096
Energy: 0.9952736862815077
Energy: 0.9453122717427022
Energy: 0.992948508342478
Energy: 0.9311498528914951
Energy: 0.9929485083404618
Energy: 0.8976873778362883
Energy: 0.9936923186733252
Energy: 0.8933390561706929
Energy: 0.9936923186733252
Energy: 0.8546936432945732
Energy: 0.8940438076006859
Energy: 0.8939431341370779
Energy: 0.8940438075996776
Energy: 0.8552238341706364
Energy: 0.8932752521167696
Energy: 0.8941018032141149
Energy: 0.8932752521177778
Energy: 0.9328101220425848
Energy: 0.9337841691050045
Energy: 0.8544304696715109
Energy: 0.9337841691050045
Energy: 0.8947148462360545
Energy: 0.8944034613871454
Energy: 0.9326217878771518
Energy: 0.8944034613861371
Energy: 0.892498499592187
Energy: 0.9346894148094171
Energy: 0.9349705249223875
Energy: 0.9346894148094171
Energy: 0.8952851756475592
Energy: 0.893030755361914
Energy: 0.8961543041656045
Energy: 0.8930307553629223
Energy: 0.8968588931068648
Energy: 0.8971702035648046
Energy: 0.8945965931179322
Energy: 0.8971702035668211
Energy: 0.8931162018556575
Energy: 0.8936962025107923
Energy: 0.8959978217992866
Energy: 0.8936962025118005
Energy: 0.9438504330382433
Energy: 0.9953947217103176
Energy: 0.9492423936117147
Energy: 0.9953947217103176
Energy: 0.8699778099754387
Energy: 0.994374839718097
Energy: 0.9464544030203701
Energy: 0.994374839718097
Energy: 0.9318893265383119
Energy: 0.9928041549733497
Energy: 0.9455924408522781
Energy: 0.9928041549743578
Energy: 0.9322788635681942
Energy: 0.9928599129370493
Energy: 0.8975229740023204
Energy: 0.9928599129380576
Energy: 0.8931150250096562
Energy: 0.8929864549407092
Energy: 0.8547780645701929
Energy: 0.8929864549407092
Energy: 0.8934221919136678
Energy: 0.8931665350965117
Energy: 0.8550240571189739
Energy: 0.8931665350955034
Energy: 0.8542606457857497
Energy: 0.8960405768530566
Energy: 0.9346877604259247
Energy: 0.8960405768530566

minimum gb energy = 0.8542606457857497 eV
minimum distance =  2.28597528076647 Angstroms
sigma value = 9


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

Energy: 1.3358229594264082
Energy: 0.9513529922788686
Energy: 1.0044579949755479
Energy: 1.0040635358737378
Energy: 0.9840187764757246
Energy: 1.0134886140295671
Energy: 0.9906874267176431
Energy: 1.0134886140295671
Energy: 1.0059317183716936
Energy: 1.0054376086580945
Energy: 0.999283383434307
Energy: 1.0054376086580945
Energy: 0.96590734703177
Energy: 1.0147523982501991
Energy: 0.9653730480267552
Energy: 1.014752398248996
Energy: 0.9270141099803332
Energy: 0.9689235447012571
Energy: 0.9663755528915147
Energy: 0.9689235447024598
Energy: 0.9674284985116675
Energy: 0.9660728670371377
Energy: 0.967168433680724
Energy: 0.9660728670383404
Energy: 0.9844893914035378
Energy: 1.076778099183337
Energy: 0.9658135953143262
Energy: 1.0767780991857425
Energy: 1.012078038993084
Energy: 1.0717590951914395
Energy: 0.9739235894547685
Energy: 1.0717590951914395
Energy: 1.022093806133914
Energy: 1.023179225926925
Energy: 0.9448196674753226
Energy: 1.023179225926925
Energy: 1.0217303564112863
Energy: 1.006502156698021
Energy: 0.927779009392778
Energy: 1.006502156698021
Energy: 0.892417081754271
Energy: 0.9107662803307933
Energy: 0.9097067464932346
Energy: 0.9107662803271852
Energy: 0.999020676829305
Energy: 0.8932065980414187
Energy: 0.9105508292707182
Energy: 0.8932065980414187
Energy: 1.0552126959678547
Energy: 1.0552158953693673
Energy: 1.0353266584588066
Energy: 1.0552158953693673
Energy: 1.055077023801457
Energy: 1.0064367857151943
Energy: 1.020695226516566
Energy: 1.0064367857151943
Energy: 0.9267855112024725
Energy: 0.9868702561185209
Energy: 0.9633330181901886
Energy: 0.9868702561185209
Energy: 0.9742587619500729
Energy: 0.9871437458424928
Energy: 0.9628828055970786
Energy: 0.9871437458424928
Energy: 0.9847142167048596
Energy: 1.0866519836185982
Energy: 0.9631371257511465
Energy: 1.0866519836161925
Energy: 0.9847916682778888
Energy: 1.0862551254137554
Energy: 0.9627612239129043
Energy: 1.0862551254137554
Energy: 0.9682247540149459
Energy: 0.9688910964346826
Energy: 0.9449699910733314
Energy: 0.9688910964358854
Energy: 0.9702487969123673
Energy: 0.9695152325214458
Energy: 0.9451776016442468
Energy: 0.9695152325226485
Energy: 0.9457460127591053
Energy: 0.9915154769371847
Energy: 1.0059343441345818
Energy: 0.991515476935982

minimum gb energy = 0.892417081754271 eV
minimum distance =  2.27152756027789 Angstroms
sigma value = 25


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

Energy: 1.1079697092605425
Energy: 0.9445078424624103
Energy: 1.0491581682367832
Energy: 1.048506509962302
Energy: 1.0441648468852343
Energy: 1.0098561258220677
Energy: 0.9612785421358351
Energy: 1.0098561258220677
Energy: 1.0477159443568358
Energy: 1.0480868201539417
Energy: 1.0466475412343401
Energy: 1.048086820152454
Energy: 1.0483840682628633
Energy: 1.0104233783330838
Energy: 0.9617825497124066
Energy: 1.0104233783330838
Energy: 0.9588856910136574
Energy: 1.0282721205981435
Energy: 0.9620887897845435
Energy: 1.0282721205981435
Energy: 0.9370077817850078
Energy: 0.9631130496861123
Energy: 0.9597355155936589
Energy: 0.9631130496861123
Energy: 0.9327633578941859
Energy: 0.9606016545805499
Energy: 0.962654801081768
Energy: 0.9606016545820374
Energy: 0.9329904628707624
Energy: 1.0110757589978954
Energy: 0.9647671604079386
Energy: 1.0110757589978954
Energy: 1.0466712878390576
Energy: 1.0477527525787576
Energy: 1.1582177243388738
Energy: 1.04775275257727
Energy: 1.0694627304535587
Energy: 0.9389795243848641
Energy: 1.0437146914113289
Energy: 0.9389795243848641
Energy: 1.0472286169667107
Energy: 1.0482012859374772
Energy: 1.0514790958989841
Energy: 1.0482012859359897
Energy: 1.045968086705473
Energy: 1.0122296798844472
Energy: 1.0482500155543821
Energy: 1.01222967988296
Energy: 0.9607255193599613
Energy: 1.0763621663788747
Energy: 0.9587372039119069
Energy: 1.0763621663788747
Energy: 0.9618408184431912
Energy: 1.0276423695392936
Energy: 0.9390364456090947
Energy: 1.0276423695288817
Energy: 1.0209988474950227
Energy: 1.0269584850668734
Energy: 0.9327764158738755
Energy: 1.0269584850668734
Energy: 0.9607181475821079
Energy: 1.0732424265919518
Energy: 0.9327896358640657
Energy: 1.0732424265919518
Energy: 1.1519335928594576
Energy: 0.938104007249446
Energy: 1.0519476686669558
Energy: 0.938104007249446

minimum gb energy = 0.9327633578941859 eV
minimum distance =  2.34110440205718 Angstroms
sigma value = 17


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

Energy: 1.5111055656912693
Energy: 1.0807904429423618
Energy: 1.1449322727916944
Energy: 1.1456930140300774
Energy: 0.9607061314239502
Energy: 1.0344250194634168
Energy: 1.0894266108498467
Energy: 1.0344250194651015
Energy: 1.018928124664378
Energy: 1.0188726876305831
Energy: 1.1572885694150468
Energy: 1.018872687632268
Energy: 1.0190043162766091
Energy: 1.1217236926047605
Energy: 1.0305691042960565
Energy: 1.1217236926039178
Energy: 1.018758602885129
Energy: 1.1066793685799083
Energy: 0.9616645309619924
Energy: 1.1066793685799083
Energy: 1.01896354803561
Energy: 1.0721532897567063
Energy: 1.0186625844514416
Energy: 1.0721532897575488
Energy: 1.0707721879874368
Energy: 1.0175009998212716
Energy: 1.019411631141824
Energy: 1.0175009998212716
Energy: 1.211828426777744
Energy: 1.01796175920316
Energy: 0.9824292999976835
Energy: 1.0179617592023174
Energy: 1.1502192297852976
Energy: 1.1447363117839024
Energy: 1.1510174512743745
Energy: 1.1447363117839024
Energy: 1.1508357470874864
Energy: 1.0935418233555572
Energy: 1.1066722695145645
Energy: 1.0935418233555572
Energy: 1.016198544943527
Energy: 0.9823710203231066
Energy: 0.9795997656047567
Energy: 0.9823710203222643
Energy: 1.087901881896291
Energy: 1.0122376177045742
Energy: 0.9829600110517255
Energy: 1.0122376177045742
Energy: 1.0708562141305031
Energy: 1.0123169992976846
Energy: 1.010794785472133
Energy: 1.0123169992993692
Energy: 1.0708128570419826
Energy: 1.0123404015991864
Energy: 0.9802502118747617
Energy: 1.012340401701921
Energy: 1.1498499438943734
Energy: 1.075113852926977
Energy: 1.2228190885669608
Energy: 1.075113852926977
Energy: 1.1485818994549206
Energy: 1.1452676559263066
Energy: 1.2267264783919714
Energy: 1.145267655927149
Energy: 1.1464621422476133
Energy: 1.0182294785671313
Energy: 1.0189527111895607
Energy: 1.0182294785671313
Energy: 1.1438950765037128
Energy: 1.0182061473016741
Energy: 1.015998321034936
Energy: 1.0182061473025164
Energy: 1.0193813666244622
Energy: 1.106731925763623
Energy: 1.0183055725815269
Energy: 1.106731925763623
Energy: 1.0580280960245174
Energy: 1.074802925056277
Energy: 1.0188504196727741
Energy: 1.0748029250571194
Energy: 1.018274020269212
Energy: 1.0312965810213424
Energy: 1.1757062062731038
Energy: 1.0312965810230275
Energy: 1.0190866682673008
Energy: 1.0193265431843823
Energy: 1.072544405218028
Energy: 1.0193265431835399
Energy: 1.0892648906615068
Energy: 1.0923150114945301
Energy: 1.0973446316091267
Energy: 1.0923150114928453
Energy: 1.1535875254376138
Energy: 1.1447654392025324
Energy: 1.1451428512942246
Energy: 1.1447654392025324
Energy: 0.9864517750284402
Energy: 1.0136394308322108
Energy: 1.1448116001328852
Energy: 1.013639430833053
Energy: 0.9832284154133949
Energy: 1.0125622197084851
Energy: 1.016202643730739
Energy: 1.0125622197068005
Energy: 0.9792917918931442
Energy: 0.9821560462772737
Energy: 1.072996519321952
Energy: 0.982156046278116
Energy: 0.987641459405091
Energy: 1.0104698588991048
Energy: 1.0706748835501265
Energy: 1.0104698588982621
Energy: 0.9811875882701936
Energy: 1.0112257058531577
Energy: 1.0712255488658344
Energy: 1.0112257058523153
Energy: 1.241573437786386
Energy: 1.1445598009161333
Energy: 1.1456483491442555
Energy: 1.1445598009152909

minimum gb energy = 0.9607061314239502 eV
minimum distance =  2.2972666739332 Angstroms
sigma value = 53


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

Energy: 1.379055903823406
Energy: 0.9377461691744668
Energy: 1.0829714175273073
Energy: 1.0813250669741357
Energy: 1.2199506560195983
Energy: 0.988608076553422
Energy: 1.0761496233464054
Energy: 0.988608076553422
Energy: 1.0807529846526063
Energy: 1.079478109353662
Energy: 1.0789857290619191
Energy: 1.079478109353662
Energy: 1.0784079208631048
Energy: 0.989809993911765
Energy: 1.079058611064699
Energy: 0.989809993911765
Energy: 1.0828375170895803
Energy: 0.9890789398463568
Energy: 0.9243020100813658
Energy: 0.9890789398444174
Energy: 1.0783124389538898
Energy: 0.9927282580556428
Energy: 0.9407615844713627
Energy: 0.992728258051764
Energy: 1.217567791829448
Energy: 1.0766992061321214
Energy: 1.0761097193917648
Energy: 1.0766992061340608
Energy: 1.2191951943867778
Energy: 0.9913422512571226
Energy: 1.077074380288773
Energy: 0.9913422512551832
Energy: 1.0791593205327847
Energy: 1.0780699759179135
Energy: 1.0946167201920411
Energy: 1.0780699759179135
Energy: 1.077782466572975
Energy: 0.9914478541630946
Energy: 1.077565831119807
Energy: 0.9914478541669732
Energy: 1.0816599176606438
Energy: 0.9940812892125006
Energy: 0.9439951819505118
Energy: 0.9940812892105612
Energy: 1.0781020720430587
Energy: 0.9889581780877158
Energy: 0.9243813834285187
Energy: 0.9889581780857765
Energy: 1.218463088503647
Energy: 1.0820370878740169
Energy: 1.076842924764061
Energy: 1.0820370878740169

minimum gb energy = 0.9243020100813658 eV
minimum distance =  2.32338451558232 Angstroms
sigma value = 9


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

Energy: 1.3415609251381784
Energy: 1.1157648934903923
Energy: 1.2022668443426756
Energy: 1.1985490033639952
Energy: 1.0562282631884956
Energy: 1.003236394317367
Energy: 1.1994227675472098
Energy: 1.0032363943180849
Energy: 1.012806405181038
Energy: 1.0071617051884674
Energy: 1.1822909691135175
Energy: 1.0071617051877497
Energy: 1.0096268661055765
Energy: 1.0059270057764955
Energy: 1.1998414870472847
Energy: 1.0059270057772132
Energy: 1.0043415836640093
Energy: 1.0029153037459337
Energy: 1.2616384795933084
Energy: 1.0029153037466516
Energy: 1.002984639476386
Energy: 1.003230206817107
Energy: 1.2606464109716147
Energy: 1.0032302068163892
Energy: 1.1975142752927603
Energy: 1.1832757235166087
Energy: 1.1962379477226937
Energy: 1.1832757235173263
Energy: 1.1950484973428153
Energy: 1.1845964594972296
Energy: 1.183554527375171
Energy: 1.1845964594979475
Energy: 1.0523142021060141
Energy: 1.125954575933697
Energy: 1.078233652240712
Energy: 1.1259545759358502
Energy: 1.0047005024174345
Energy: 1.0856110586889194
Energy: 1.185919900813094
Energy: 1.0856110586874839
Energy: 1.051196860551724
Energy: 1.0518745562280007
Energy: 1.1020664164530767
Energy: 1.0518745562280007
Energy: 1.0631746902948616
Energy: 1.118464117328598
Energy: 1.2607324373066968
Energy: 1.118464117328598
Energy: 1.195406080270956
Energy: 1.0518874139453016
Energy: 1.0685214153350682
Energy: 1.0518874139453016
Energy: 1.1955255712793453
Energy: 1.0518638603357273
Energy: 1.054376048746764
Energy: 1.0518638603357273
Energy: 1.1832739361975335
Energy: 1.0716334739284432
Energy: 1.0621310143230265
Energy: 1.0716334739291609
Energy: 1.1032381748793998
Energy: 1.1296367267504348
Energy: 1.0626506029731118
Energy: 1.1296367267511525
Energy: 1.187634359620445
Energy: 1.1067768135524605
Energy: 1.0542835794677496
Energy: 1.106776813551025
Energy: 1.1986772057376063
Energy: 1.185453169282128
Energy: 1.3381920594371854
Energy: 1.185453169282128
Energy: 1.199085199787817
Energy: 1.0031857779054867
Energy: 1.0062977375927178
Energy: 1.003185777904769
Energy: 1.2511421498633084
Energy: 1.0087730571447955
Energy: 1.0140335626200547
Energy: 1.0087730571455131
Energy: 1.1998649216781685
Energy: 1.0048824818357138
Energy: 1.006910640730804
Energy: 1.0048824818342783
Energy: 1.260918946544328
Energy: 1.0027124752090744
Energy: 1.0033635102668323
Energy: 1.0027124752105099
Energy: 1.2612856996381714
Energy: 1.0036951738696602
Energy: 1.0029103791320948
Energy: 1.0036951738703779
Energy: 1.1979789875180904
Energy: 1.183144761703384
Energy: 1.1962285885208994
Energy: 1.183144761703384
Energy: 1.1828411300279413
Energy: 1.1827812369862998
Energy: 1.1953370709965618
Energy: 1.1827812369870176
Energy: 1.0651608180809502
Energy: 1.103877867075139
Energy: 1.052461891030429
Energy: 1.1038778670744214
Energy: 1.1867085618601494
Energy: 1.0870772569857015
Energy: 1.0042618978979077
Energy: 1.087077256987137
Energy: 1.102628631664707
Energy: 1.0519586913232015
Energy: 1.051786673214328
Energy: 1.0519586913232015
Energy: 1.261245885368266
Energy: 1.06124469924818
Energy: 1.06260435628224
Energy: 1.06124469924818
Energy: 1.070217587894634
Energy: 1.0515859749805805
Energy: 1.1970984234908273
Energy: 1.0515859749812981
Energy: 1.0563698058917175
Energy: 1.0525425062332259
Energy: 1.1816631232831265
Energy: 1.0525425062317904
Energy: 1.0584260360967985
Energy: 1.0582311679703353
Energy: 1.183226093017952
Energy: 1.0582311679696177
Energy: 1.0635605923394031
Energy: 1.1366617131386236
Energy: 1.1042435303675797
Energy: 1.1366617131386236
Energy: 1.0534720454842033
Energy: 1.1065967778036374
Energy: 1.1072402219030724
Energy: 1.1065967778029195
Energy: 1.261025443312587
Energy: 1.1842125594342523
Energy: 1.1885142036017422
Energy: 1.1842125594356878

minimum gb energy = 1.0027124752090744 eV
minimum distance =  2.29666680395612 Angstroms
sigma value = 73


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

Energy: 1.4309403176727211
Energy: 1.0689302068947513
Energy: 1.1605032776295046
Energy: 1.1605681258660183
Energy: 1.0667252426728029
Energy: 1.0208486978839966
Energy: 1.1377226626981798
Energy: 1.0208486978851354
Energy: 1.0267872525148871
Energy: 1.0241751287880507
Energy: 1.1707303080735991
Energy: 1.0241751287903285
Energy: 1.0232668535270506
Energy: 1.0231089190622795
Energy: 1.2472903197902256
Energy: 1.0231089190611407
Energy: 1.024327853652867
Energy: 1.0246749836505467
Energy: 1.190029762940078
Energy: 1.0246749836505467
Energy: 1.0839004871101676
Energy: 1.0244434500136461
Energy: 1.1906423547460154
Energy: 1.0244434500159239
Energy: 1.1339267658062961
Energy: 1.1671924589670397
Energy: 1.1841364676455641
Energy: 1.1671924589659008
Energy: 1.0785837298173528
Energy: 1.1677321161814302
Energy: 1.1662183094872307
Energy: 1.1677321161837078
Energy: 1.0600285564706826
Energy: 1.1420783939409458
Energy: 1.1685668723422271
Energy: 1.1420783939409458
Energy: 1.0770109508261243
Energy: 1.0531833605055263
Energy: 1.166774634975179
Energy: 1.0531833604725258
Energy: 1.0616560360492537
Energy: 0.9995537177848615
Energy: 1.0120247811701697
Energy: 0.9995537177848615
Energy: 1.058568613419211
Energy: 1.0030606433348475
Energy: 1.2298530538554096
Energy: 1.0030606433359863
Energy: 1.1751183105885021
Energy: 1.0739982742923946
Energy: 1.0571207960374587
Energy: 1.0739982742946723
Energy: 1.1697085956841196
Energy: 1.0608116009995028
Energy: 1.0576920578238618
Energy: 1.0608116009995028
Energy: 1.1830269521088126
Energy: 1.0593279756508622
Energy: 1.0566964804133925
Energy: 1.059327975652001
Energy: 1.2434298442432468
Energy: 1.056948799103684
Energy: 1.0570706966073173
Energy: 1.056948799103684
Energy: 1.1897696708517382
Energy: 1.057195700335015
Energy: 1.058123397380672
Energy: 1.057195700335015
Energy: 1.1404784642239487
Energy: 1.1399900669354386
Energy: 1.0761418091653974
Energy: 1.1399900669354386
Energy: 1.1343928640573504
Energy: 1.0953436420451783
Energy: 1.0791107169349488
Energy: 1.0953436420417617
Energy: 1.1342133511709884
Energy: 1.0953253644964207
Energy: 1.132039298073793
Energy: 1.0953253644964207
Energy: 1.134313836704392
Energy: 1.09727057494087
Energy: 1.0686012596496708
Energy: 1.09727057494087
Energy: 1.1893955869680883
Energy: 1.1302045132650298
Energy: 1.1306449235489426
Energy: 1.130204513263891

minimum gb energy = 0.9995537177848615 eV
minimum distance =  2.28417609305143 Angstroms
sigma value = 7


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

Energy: 1.6630927339258124
Energy: 1.035759040436876
Energy: 1.1641568495170251
Energy: 1.164576001224342
Energy: 1.114924126166163
Energy: 1.0900810811455623
Energy: 1.1322897977980284
Energy: 1.0900810811463675
Energy: 1.024496867692444
Energy: 1.0263758607754279
Energy: 1.1271291239743884
Energy: 1.0263758607778435
Energy: 1.0244996673054114
Energy: 1.025430185196617
Energy: 1.2292009758446745
Energy: 1.025430185202254
Energy: 1.0249383576405513
Energy: 1.0246487046298633
Energy: 1.206360347130686
Energy: 1.0246487046330843
Energy: 1.026821580959221
Energy: 1.025167401932084
Energy: 1.2050056524746933
Energy: 1.0251674019304735
Energy: 1.1334284766177232
Energy: 1.0249803850099262
Energy: 1.0252033182711198
Energy: 1.0249803850067052
Energy: 1.1273100353066365
Energy: 1.0253586223538504
Energy: 1.0247165756647238
Energy: 1.0253586223546558
Energy: 1.2292673971239512
Energy: 1.0259606928971998
Energy: 1.0251881675991328
Energy: 1.0259606928988103
Energy: 1.224230202381132
Energy: 1.0263335239729114
Energy: 1.0233065206791088
Energy: 1.0263335239769378
Energy: 1.1308914901890625
Energy: 1.1241364657187978
Energy: 1.026219865448811
Energy: 1.1241364657284612
Energy: 1.1297371446982323
Energy: 1.1281252055971285
Energy: 1.1253689862888934
Energy: 1.128125205596323
Energy: 1.1223653392575539
Energy: 1.0891970426589344
Energy: 1.127080870185423
Energy: 1.0891970426532975
Energy: 1.1236756402973325
Energy: 1.086242635630212
Energy: 1.0347152934222004
Energy: 1.0862426356277965
Energy: 1.1264967271181243
Energy: 1.0879864031678816
Energy: 1.0351730502437861
Energy: 1.087986403171908
Energy: 1.0344767834843387
Energy: 1.122928768122557
Energy: 1.1301362340172028
Energy: 1.1229287681273887
Energy: 1.0344510587524802
Energy: 1.1235215102734757
Energy: 1.1328017386663425
Energy: 1.1235215102815284
Energy: 1.0246369045183246
Energy: 1.0259811299958261
Energy: 1.1299045081235226
Energy: 1.0259811299974366
Energy: 1.0256568194981073
Energy: 1.0264627477898904
Energy: 1.1307552375094514
Energy: 1.0264627477930752
Energy: 1.024245218624974
Energy: 1.0250602639977398
Energy: 1.0369493567684023
Energy: 1.0250602640033766
Energy: 1.0252281032463748
Energy: 1.0250188235942401
Energy: 1.2105945769394955
Energy: 1.025018823599877
Energy: 1.1251046564095337
Energy: 1.0250900216731023
Energy: 1.0265606863896257
Energy: 1.025090021671492
Energy: 1.1253172265166294
Energy: 1.0249386566355145
Energy: 1.024918208200464
Energy: 1.0249386566387357
Energy: 1.2294831490488305
Energy: 1.0252251253218945
Energy: 1.0243008981336368
Energy: 1.0252251253146472
Energy: 1.2141184224589485
Energy: 1.026234589453523
Energy: 1.024533985607217
Energy: 1.0262345894519125
Energy: 1.206778474750679
Energy: 1.0291682828417745
Energy: 1.0272330173632946
Energy: 1.0291682828353326
Energy: 1.1643112638807775
Energy: 1.1354527700344401
Energy: 1.4438713498677482
Energy: 1.1354527700288033
Energy: 1.1219145216229485
Energy: 1.090292865697049
Energy: 1.1308024090381525
Energy: 1.0902928656994648
Energy: 1.1252772296598699
Energy: 1.0870619626389948
Energy: 1.1235173603821125
Energy: 1.087061962635774
Energy: 1.1244197923743602
Energy: 1.0906868456202148
Energy: 1.03401839555565
Energy: 1.0906868456073304
Energy: 1.0339892100055894
Energy: 1.1244857664092014
Energy: 1.1260303059607801
Energy: 1.1244857664156438

minimum gb energy = 1.0233065206791088 eV
minimum distance =  2.28532813412784 Angstroms
sigma value = 29


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

Energy: 0.9676033594708929
Energy: 0.9695822545384759
Energy: 0.9892129978446988
Energy: 1.1474390037327946
Energy: 0.9811997754698745
Energy: 1.054748728042559
Energy: 0.9896134290836959
Energy: 1.054748728042559
Energy: 0.9802135069798603
Energy: 1.0391026969660933
Energy: 0.9676781619148435
Energy: 1.0391026969655321
Energy: 0.9716904311886924
Energy: 0.9807016478414995
Energy: 0.9800784035661686
Energy: 0.9807016478420293
Energy: 0.9790305592268591
Energy: 0.9827289825148533
Energy: 0.9705350130088901
Energy: 0.9827289825146039
Energy: 0.9792751179767941
Energy: 1.0446580841461266
Energy: 0.9717156873238039
Energy: 1.0446580841461266
Energy: 0.9678441237838473
Energy: 1.0384938022486165
Energy: 0.9800787191145717
Energy: 1.0384938022486165
Energy: 0.9870603729941928
Energy: 0.9882569345642805
Energy: 0.9760233339408911
Energy: 0.9882569345645299
Energy: 0.9716266101308294
Energy: 0.9834009842731911
Energy: 0.989795146112655
Energy: 0.9834009842729107

minimum gb energy = 0.9676033594708929 eV
minimum distance =  2.3062760803724 Angstroms
sigma value = 5


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

Energy: 1.3187220014724457
Energy: 0.9262467161034076
Energy: 1.10049705464436
Energy: 0.9555222893922748
Energy: 0.9742500218089798
Energy: 0.9539909471517293
Energy: 1.1199400181645154
Energy: 0.9539909471517293
Energy: 1.0972346156883406
Energy: 1.0274320443075298
Energy: 1.1223030848702822
Energy: 1.0274320443075298
Energy: 0.9742119144451267
Energy: 0.9527124120650047
Energy: 1.09024566800642
Energy: 0.9527124120642442
Energy: 1.089798076345863
Energy: 0.9506217321942064
Energy: 1.1219250513399943
Energy: 0.9506217321934456
Energy: 0.9511705245683053
Energy: 0.9528545196180358
Energy: 1.1183656219086762
Energy: 0.9528545196165145
Energy: 0.9503486893665224
Energy: 0.9499881126547489
Energy: 1.0899828348663112
Energy: 0.9499881126555096
Energy: 0.9578877347694322
Energy: 0.9538734187720274
Energy: 1.2049485072191795
Energy: 0.953873418770506
Energy: 0.9783384909597697
Energy: 0.9805538816013899
Energy: 1.2553105369119584
Energy: 0.9805538816006293
Energy: 1.1441667289267068
Energy: 0.9296904530431954
Energy: 0.9368749301410858
Energy: 0.9296904530409134
Energy: 0.9785123753411183
Energy: 0.9272642982987589
Energy: 0.9285844211591449
Energy: 0.9272642982964769
Energy: 1.2647765482731668
Energy: 0.9265128523436692
Energy: 0.926327002477913
Energy: 0.926512852342148
Energy: 1.250362762036657
Energy: 0.9266916534222374
Energy: 0.9262316596169015
Energy: 0.9266916534222374
Energy: 0.97699053298462
Energy: 0.9757437111723941
Energy: 1.1193496416379627
Energy: 0.9757437111716335
Energy: 0.9527331607625301
Energy: 0.9506238460421137
Energy: 1.1180199253480785
Energy: 0.9506238460421137
Energy: 0.9533448912939986
Energy: 0.9525358627083762
Energy: 1.0899505109351262
Energy: 0.9525358627076155
Energy: 0.9525495676362147
Energy: 0.9507057766911385
Energy: 0.9735125905547132
Energy: 0.9507057766911385
Energy: 1.109454630616788
Energy: 0.9535813972080285
Energy: 0.9736230313176911
Energy: 0.9535813972087892
Energy: 1.1239255032918636
Energy: 1.0288540646307136
Energy: 1.0992441714745484
Energy: 1.0288540646322348
Energy: 1.0914175746348935
Energy: 1.0292744776056784
Energy: 0.9724375585098107
Energy: 1.0292744776033964
Energy: 1.1186531069106733
Energy: 0.9601858979005056
Energy: 1.0903932617865038
Energy: 0.9601858978997448
Energy: 1.122970661504877
Energy: 0.9505738917354951
Energy: 0.9508403094512771
Energy: 0.9505738917347344
Energy: 1.0893051239738378
Energy: 0.950265784233459
Energy: 0.9511969689468556
Energy: 0.9502657842319376
Energy: 1.202674840249023
Energy: 0.9525936259014999
Energy: 0.9547157724737431
Energy: 0.9525936259014999
Energy: 1.256626336681939
Energy: 0.9767461311228951
Energy: 0.9785238308926371
Energy: 0.9767461311228951
Energy: 0.9279803318119935
Energy: 0.9289977684499114
Energy: 1.1442911461088676
Energy: 0.9289977684506722
Energy: 0.9284645616110806
Energy: 0.9287524404123197
Energy: 0.9785633855551308
Energy: 0.9287524404130804
Energy: 0.927573784681738
Energy: 0.9289151459185868
Energy: 1.0099226712760714
Energy: 0.9289151459193475
Energy: 0.9257952574632845
Energy: 0.9278212603126428
Energy: 1.250779345493097
Energy: 0.9278212603118821
Energy: 1.1182773041688117
Energy: 0.9752333259445953
Energy: 0.9763934063594365
Energy: 0.9752333259445953
Energy: 1.1183199319557415
Energy: 0.9513417141652697
Energy: 0.9552599665598616
Energy: 0.9513417141652697
Energy: 1.0896832732842991
Energy: 0.9512840131451958
Energy: 0.9533223982092922
Energy: 0.9512840131451958
Energy: 0.9746201747137715
Energy: 0.9504463775701971
Energy: 0.9518430739834232
Energy: 0.9504463775686758

minimum gb energy = 0.9257952574632845 eV
minimum distance =  2.28548409452076 Angstroms
sigma value = 1


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

Energy: 1.5494353594749795
Energy: 0.8904137110659796
Energy: 0.9152478616146382
Energy: 0.9142873486665023
Energy: 0.9206008099965686
Energy: 0.9150503580154009
Energy: 1.1162195167500255
Energy: 0.9150503580164527
Energy: 1.0556207327599847
Energy: 1.0121205802901365
Energy: 1.1200498170396598
Energy: 1.0121205802922402
Energy: 1.0405295973962438
Energy: 1.0118693289027456
Energy: 1.1076517253418479
Energy: 1.0118693289027456
Energy: 0.9222847776252162
Energy: 0.9210689376485466
Energy: 1.0359226338998846
Energy: 0.921068937646443
Energy: 0.9215132956894442
Energy: 0.9228411123045143
Energy: 1.0366633039388196
Energy: 0.9228411123055661
Energy: 0.9204997521697231
Energy: 0.9204189927513438
Energy: 1.1078304609737148
Energy: 0.9204189927502919
Energy: 0.9221452747007042
Energy: 0.9252031563693566
Energy: 1.1823931109736423
Energy: 0.9252031563704084
Energy: 0.9626599934729885
Energy: 0.9700317501419989
Energy: 1.182902282593271
Energy: 0.9700317501430505
Energy: 1.2064312406690265
Energy: 0.8767957951917239
Energy: 0.978568704447445
Energy: 0.8767957951927757
Energy: 0.9315558918253429
Energy: 0.8776238632112714
Energy: 0.9789563404046411
Energy: 0.8776238632102198
Energy: 1.2608166071639657
Energy: 0.8731553649815502
Energy: 0.9714801108092427
Energy: 0.8731553649815502
Energy: 1.2554335508148387
Energy: 0.874321590090033
Energy: 0.9740576914372502
Energy: 0.8743215900910847
Energy: 0.9278736064822489
Energy: 0.9721102513362897
Energy: 1.166200921080706
Energy: 0.9721102513362897
Energy: 1.0404694832917025
Energy: 0.9705072099021961
Energy: 1.1651310142721722
Energy: 0.9705072099011443
Energy: 1.0424663256634756
Energy: 1.071716309336686
Energy: 1.1086847160947741
Energy: 1.0717163093356343
Energy: 0.922832132228423
Energy: 0.922399553661248
Energy: 1.0378698287228607
Energy: 0.9223995536633516
Energy: 0.943576328746506
Energy: 0.9247899347920723
Energy: 1.037209579192678
Energy: 0.9247899347931241
Energy: 0.9252449038894229
Energy: 0.9219008681210104
Energy: 1.1849770353508984
Energy: 0.9219008681210104
Energy: 0.9241256688686874
Energy: 0.9251504242692438
Energy: 1.1970099183109049
Energy: 0.9251504242702956
Energy: 1.2086823163624574
Energy: 0.9125916631202632
Energy: 1.105862497630219
Energy: 0.9125916631223666
Energy: 1.2094541665663519
Energy: 0.9145362446976089
Energy: 0.9171715439585142
Energy: 0.9145362446955053
Energy: 1.0388769871004166
Energy: 0.9124281190143677
Energy: 0.9142656939187677
Energy: 0.9124281190164713
Energy: 1.1976305588711083
Energy: 0.913426368253359
Energy: 0.9147436604808244
Energy: 0.9134263682544107

minimum gb energy = 0.8731553649815502 eV
minimum distance =  2.27967530387709 Angstroms
sigma value = 17


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

Energy: 1.5030013117297305
Energy: 0.8751076437334286
Energy: 1.0640322044178034
Energy: 0.8944649754650977
Energy: 0.9171270148711673
Energy: 0.8941596521804702
Energy: 1.0211099605907654
Energy: 0.8941596521798201
Energy: 1.1234493430668808
Energy: 0.8951650197605254
Energy: 1.044281216386533
Energy: 0.8951650197598753
Energy: 1.1796740521270155
Energy: 0.9384139480609609
Energy: 1.0135400283644047
Energy: 0.9384139480609609
Energy: 0.9976637307826525
Energy: 0.8732455261667434
Energy: 1.1809803255443052
Energy: 0.8732455261654433
Energy: 0.8738735917915854
Energy: 0.8726237920852663
Energy: 1.1597385067437689
Energy: 0.8726237920859163
Energy: 0.8736643111171214
Energy: 0.87246703970424
Energy: 0.9089268067197804
Energy: 0.8724670397029398
Energy: 0.8818340817951831
Energy: 0.8756678128302965
Energy: 1.1643237496836347
Energy: 0.8756678128302965
Energy: 1.14990317924296
Energy: 0.8757438324246895
Energy: 1.1221871572770563
Energy: 0.8757438324246895
Energy: 1.049393244048503
Energy: 0.9420813186220467
Energy: 1.0331237041973826
Energy: 0.9420813186233468
Energy: 1.1463820025127454
Energy: 0.890262801879699
Energy: 0.9046501119725645
Energy: 0.8902628018816492
Energy: 1.1563606769307513
Energy: 0.896180664475993
Energy: 1.0145966730671467
Energy: 0.8961806644746928
Energy: 1.1415538537330732
Energy: 0.8900858511241844
Energy: 0.8912993856576272
Energy: 0.8900858511235342
Energy: 0.8910635238862549
Energy: 0.8899435316533073
Energy: 0.8918958498056416
Energy: 0.8899435316526572
Energy: 1.1740336116663614
Energy: 0.892397699553402
Energy: 0.8987342619489989
Energy: 0.8923976995540521
Energy: 1.1624860107904387
Energy: 0.8911680190868686
Energy: 0.8949599567781235
Energy: 0.8911680190855685
Energy: 0.8905695064824758
Energy: 0.9976314814701724
Energy: 1.0300808753975557
Energy: 0.9976314814701724
Energy: 0.8899696667410287
Energy: 0.8903632888971088
Energy: 1.1515833813245313
Energy: 0.8903632888971088
Energy: 0.906903584797195
Energy: 0.8953539290377339
Energy: 1.0160601139558476
Energy: 0.8953539290403341
Energy: 0.8917722722531716
Energy: 0.8902951487678157
Energy: 1.1629283212251833
Energy: 0.8902951487652152
Energy: 1.0303365105531193
Energy: 0.8924262488984782
Energy: 0.8917098567245312
Energy: 0.8924262488978281
Energy: 1.0444750390026571
Energy: 0.8934206037669733
Energy: 1.1728626092160035
Energy: 0.8934206037643729
Energy: 1.0139849566541252
Energy: 0.9364666094242091
Energy: 1.1752609178986817
Energy: 0.9364666094242091
Energy: 1.1842307438612354
Energy: 0.8746267370502775
Energy: 0.9970097419324502
Energy: 0.8746267370509274
Energy: 1.1565633123380947
Energy: 0.8727064434263715
Energy: 0.8727794753737156
Energy: 0.8727064434244212
Energy: 1.0144237707145363
Energy: 0.8736674297563094
Energy: 0.876941192233695
Energy: 0.8736674297576095
Energy: 0.8790590699500309
Energy: 0.8754724481652026
Energy: 0.8797351294461387
Energy: 0.8754724481626025
Energy: 1.01617887070815
Energy: 0.8759731881009568
Energy: 1.1530650969769762
Energy: 0.8759731881016068
Energy: 1.0215380989643157
Energy: 0.9394860026158338
Energy: 1.0441813637221304
Energy: 0.9394860026151837
Energy: 0.9059116748973053
Energy: 0.890047373246856
Energy: 1.145522931711584
Energy: 0.8900473732442558
Energy: 1.0136766098145684
Energy: 0.8902884405355689
Energy: 1.1601981823314145
Energy: 0.890288440536219
Energy: 0.890358020194031
Energy: 0.8902077784820279
Energy: 1.1610538582515768
Energy: 0.890207778482678
Energy: 0.8897625917967904
Energy: 0.8892414430874432
Energy: 1.038851612965648
Energy: 0.8892414430861432
Energy: 0.8978407246006607
Energy: 0.8941668378084037
Energy: 1.178094674562225
Energy: 0.8941668378090537
Energy: 1.0433635169401008
Energy: 0.9169002409214428
Energy: 1.162839770170731
Energy: 0.9169002409194926
Energy: 1.348140672330341
Energy: 0.895067628589186
Energy: 0.8925313068921726
Energy: 0.8950676285872357
Energy: 1.1468959221228499
Energy: 0.889821162222709
Energy: 0.8911773499631239
Energy: 0.8898211622240091
Energy: 1.1225388907717035
Energy: 0.8960109167964467
Energy: 0.8921746826084818
Energy: 0.8960109167951467

minimum gb energy = 0.8724670397029398 eV
minimum distance =  2.28909776341727 Angstroms
sigma value = 89


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

Energy: 1.5922697963397066
Energy: 0.8376042065439757
Energy: 0.8149844731976361
Energy: 0.8143628164480835
Energy: 0.8128544963546365
Energy: 0.8893154382274674
Energy: 0.8136661890035017
Energy: 0.8893154382274674
Energy: 0.805900747364151
Energy: 0.8913299147835521
Energy: 0.8314735377611757
Energy: 0.8913299147835521
Energy: 0.8069026936543926
Energy: 0.8912643143075489
Energy: 0.8123358505431498
Energy: 0.8912643143075489
Energy: 0.8113413939688403
Energy: 0.8119634289830016
Energy: 0.825187244838535
Energy: 0.8119634289830016
Energy: 0.8128991354558379
Energy: 0.8106817790707785
Energy: 0.8238844836213772
Energy: 0.8106817790707785
Energy: 0.8113538325454596
Energy: 0.8096580522587953
Energy: 0.8141389839828235
Energy: 0.8096580522587953
Energy: 0.8135984002693598
Energy: 0.8152640048506021
Energy: 0.8050499821397438
Energy: 0.8152640048472004
Energy: 0.8155562753017461
Energy: 0.811280754346534
Energy: 0.8052553305394045
Energy: 0.811280754346534
Energy: 0.8284189558212474
Energy: 0.8922695239974844
Energy: 0.8158799448225391
Energy: 0.8922695239974844
Energy: 0.8131990250485176
Energy: 0.8936691155812256
Energy: 0.8043701182761962
Energy: 0.8936691155812256
Energy: 0.8233587790771606
Energy: 0.8175263780961415
Energy: 0.8144443871774137
Energy: 0.8175263780978423
Energy: 0.8257566727332072
Energy: 0.8130795965743564
Energy: 0.8114958917449238
Energy: 0.8130795965743564
Energy: 0.8135123558367598
Energy: 0.8092783396003203
Energy: 0.8097036385121882
Energy: 0.8092783396003203
Energy: 0.8048834522439089
Energy: 0.8121717117785485
Energy: 0.8153604753620659
Energy: 0.8121717117785485

minimum gb energy = 0.8043701182761962 eV
minimum distance =  2.30592258656604 Angstroms
sigma value = 13


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

Energy: 1.4035200141918518
Energy: 0.7621015007526553
Energy: 0.979769045048763
Energy: 0.7667660000030323
Energy: 0.769448249675078
Energy: 0.7669699844654261
Energy: 0.9136017760555122
Energy: 0.7669699844632873
Energy: 0.7686285623646852
Energy: 0.7642465991836608
Energy: 0.921140088424898
Energy: 0.7642465991865124
Energy: 1.0714224171710078
Energy: 0.7680462611295507
Energy: 0.9043266958727025
Energy: 0.7680462611224216
Energy: 0.9084463801084011
Energy: 0.7667681527668462
Energy: 1.0862533581282723
Energy: 0.7667681527611431
Energy: 0.9055437512808049
Energy: 0.7654852518409153
Energy: 0.8990234804949121
Energy: 0.7654852518430542
Energy: 0.9054464744700664
Energy: 0.7643671146420912
Energy: 0.9009927196123434
Energy: 0.7643671146442298
Energy: 0.9040766507592513
Energy: 0.7634526038032039
Energy: 0.9241552360230575
Energy: 0.7634526038046296
Energy: 0.7628007397228673
Energy: 0.7670124761201969
Energy: 0.9064468294456182
Energy: 0.7670124761194839
Energy: 0.7634257550353879
Energy: 0.7639557643056231
Energy: 0.9056315699148842
Energy: 0.7639557643077619
Energy: 0.766327493691949
Energy: 0.7770503507978893
Energy: 1.4041738829334396
Energy: 0.7770503507943248
Energy: 0.9004877042184993
Energy: 0.763199547111522
Energy: 0.9061276068898416
Energy: 0.7631995471093832
Energy: 0.9016389253193979
Energy: 0.8077682025020056
Energy: 0.9000989197915014
Energy: 0.8077682025012927
Energy: 0.9034687084056487
Energy: 0.8103259701215472
Energy: 1.070553523781685
Energy: 0.8103259701208341
Energy: 0.9120205457423748
Energy: 0.7661454578264278
Energy: 0.9044767083526375
Energy: 0.766145457832844
Energy: 0.91052405383587
Energy: 0.7656209937506657
Energy: 0.768978080547379
Energy: 0.7656209937506657
Energy: 1.0599062107475798
Energy: 0.764100741226877
Energy: 0.7665678879974286
Energy: 0.7641007412283027
Energy: 0.7698920410429184
Energy: 0.7673915315386742
Energy: 0.7658085865864372
Energy: 0.7673915315336839
Energy: 1.0280761865990928
Energy: 0.7666009860796403
Energy: 0.9004003402477455
Energy: 0.7666009860860565
Energy: 0.9048145586483773
Energy: 0.7636453525359466
Energy: 0.9209529261236905
Energy: 0.7636453525345207
Energy: 1.0752897908907673
Energy: 0.7643983662472955
Energy: 0.9008476993055414
Energy: 0.7643983662423051
Energy: 0.904543009892037
Energy: 0.8201005996371021
Energy: 0.9002410034430626
Energy: 0.8201005996342504
Energy: 0.9072182051964829
Energy: 0.7675523059002181
Energy: 1.0870531089266295
Energy: 0.7675523058995051
Energy: 0.7689636096431542
Energy: 0.7629989430872817
Energy: 1.0597215104101845
Energy: 0.7629989430915592
Energy: 0.9020038772415471
Energy: 0.764696196446639
Energy: 0.9094687956928414
Energy: 0.7646961964494907
Energy: 0.7651724337539921
Energy: 0.7630633926804646
Energy: 0.9090446148288773
Energy: 0.7630633926804646
Energy: 0.7632862224059169
Energy: 0.7627523494223312
Energy: 1.0621290582672296
Energy: 0.7627523494251829
Energy: 0.7783261316183165
Energy: 0.7673480832289242
Energy: 0.7702493615906633
Energy: 0.7673480832324888
Energy: 0.8995942191039369
Energy: 0.7663695838244295
Energy: 1.0292684597711952
Energy: 0.76636958382942
Energy: 0.9209128451961688
Energy: 0.8108084779041013
Energy: 0.8997680705364473
Energy: 0.8108084779005367
Energy: 0.9018513070172558
Energy: 0.8079254243220083
Energy: 1.075862663076038
Energy: 0.8079254243262858
Energy: 0.9096095410372913
Energy: 0.7649744989518866
Energy: 0.8998380359804504
Energy: 0.764974498948322
Energy: 0.9111983113702352
Energy: 0.765933442013472
Energy: 0.7810207076057784
Energy: 0.7659334420091943
Energy: 1.061739385333803
Energy: 0.7626243492612258
Energy: 0.7634607890628146
Energy: 0.7626243492605129
Energy: 1.0281406854859987
Energy: 0.7647692304302601
Energy: 0.7683886723847697
Energy: 0.764769230429547

minimum gb energy = 0.7621015007526553 eV
minimum distance =  2.29565706260012 Angstroms
sigma value = 37


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

Energy: 1.3707207810013862
Energy: 0.703950462889892
Energy: 0.712778369484351
Energy: 0.7131887034203428
Energy: 1.0549579274142276
Energy: 0.7122385031413838
Energy: 0.9552491003404497
Energy: 0.7122385031413838
Energy: 1.055424520339938
Energy: 0.7109944311932674
Energy: 0.9504407615263591
Energy: 0.7109944311932674
Energy: 1.056484258978741
Energy: 0.7974248398121311
Energy: 0.9315319903669758
Energy: 0.7974248398158108
Energy: 1.1593059953681781
Energy: 0.7036596418627679
Energy: 1.0624856283952606
Energy: 0.7036596418652209
Energy: 0.8313177793092799
Energy: 0.7011532977108809
Energy: 1.050799440599848
Energy: 0.701153297713334
Energy: 0.8275882876106544
Energy: 0.7002457181782952
Energy: 1.1572933951610826
Energy: 0.7002457181795217
Energy: 0.8270016665043666
Energy: 0.6937192706561714
Energy: 1.080192487455804
Energy: 0.6937192706549449
Energy: 0.8158994080576325
Energy: 0.6961537827982687
Energy: 1.0613594937228201
Energy: 0.6961537827982687
Energy: 0.8153734212444955
Energy: 0.6905761616162978
Energy: 1.1559793295639234
Energy: 0.6905761616162978
Energy: 0.8525454763460563
Energy: 0.8523128826160568
Energy: 1.2237032198176678
Energy: 0.8523128826148303
Energy: 1.0500551123194013
Energy: 0.6905042153593813
Energy: 1.155889929154381
Energy: 0.6905042153593813
Energy: 1.0482913219092946
Energy: 0.6900057459528461
Energy: 1.0553552609788115
Energy: 0.6900057459540727
Energy: 1.052481455636228
Energy: 0.7762888878561333
Energy: 1.0571015806005348
Energy: 0.7762888878573598
Energy: 1.0624856283952606
Energy: 0.7865821208543251
Energy: 1.1567746357738835
Energy: 0.7865821208567783
Energy: 1.0507994406378711
Energy: 0.7849429152299141
Energy: 0.8175610298865532
Energy: 0.7849429152311407
Energy: 1.1598721296988128
Energy: 0.7846564185348013
Energy: 0.8276031118991318
Energy: 0.7846564185360277
Energy: 1.0801924871088557
Energy: 0.7110672602755914
Energy: 0.6919890096471593
Energy: 0.7110672602731383
Energy: 1.0613594937411905
Energy: 0.7145835648526526
Energy: 0.711353867321591
Energy: 0.7145835648526526
Energy: 1.0515173142036263
Energy: 0.7124193499266561
Energy: 0.719745802647242
Energy: 0.7124193499266561

minimum gb energy = 0.6900057459528461 eV
minimum distance =  2.29025707886293 Angstroms
sigma value = 25


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

Energy: 1.4572650516229988
Energy: 0.621572160893039
Energy: 0.8660254331670847
Energy: 0.6175150942057821
Energy: 1.3021775210496236
Energy: 0.6152906648584086
Energy: 0.8068973953319164
Energy: 0.6152906648574508
Energy: 1.3060936068137534
Energy: 0.6144223738496378
Energy: 0.8105011983549264
Energy: 0.6144223738505956
Energy: 1.0143323728489684
Energy: 0.6160182978987392
Energy: 0.806623560243125
Energy: 0.6160182978977814
Energy: 1.1537918727845866
Energy: 0.6818311550738457
Energy: 1.160167284024013
Energy: 0.6818311550738457
Energy: 0.99972820431642
Energy: 0.6800514257051391
Energy: 1.1545822045797656
Energy: 0.6800514257051391
Energy: 1.0028878253249645
Energy: 0.6818254667111611
Energy: 1.1535372344771564
Energy: 0.6818254667111611
Energy: 0.8066693947399051
Energy: 0.6203600635819747
Energy: 1.1500242206758762
Energy: 0.6203600635819747
Energy: 0.8105383049307694
Energy: 0.6143563164388286
Energy: 1.3123364071267658
Energy: 0.6143563164378709
Energy: 0.8112469182294347
Energy: 0.615401771438601
Energy: 1.3086015098257693
Energy: 0.615401771438601
Energy: 0.6156528498771475
Energy: 0.6195980042557598
Energy: 1.2365893830588945
Energy: 0.6195980042682111
Energy: 0.6182783834825744
Energy: 0.6151941422357982
Energy: 1.3086261736007234
Energy: 0.6151941422377136
Energy: 0.6162296282108423
Energy: 0.6183081092510252
Energy: 1.3023226674623976
Energy: 0.6183081092510252
Energy: 0.628140795787573
Energy: 0.6221464319644623
Energy: 1.3004125841517926
Energy: 0.6221464319644623
Energy: 0.8106500055398048
Energy: 0.6140389050819722
Energy: 1.3056491398199994
Energy: 0.6140389050800567
Energy: 0.8112079254872784
Energy: 0.6157690319523517
Energy: 1.308533996859728
Energy: 0.6157690319523517
Energy: 1.008154543468057
Energy: 0.617486699154254
Energy: 1.302232374727139
Energy: 0.6174866991532962
Energy: 0.8153933470649448
Energy: 0.6846826476641641
Energy: 1.15655308219019
Energy: 0.6846826476632063
Energy: 1.1533748254884721
Energy: 0.6809463684899697
Energy: 1.0019090691673633
Energy: 0.6809463684899697
Energy: 1.3085838150061984
Energy: 0.6810470451529725
Energy: 1.0004401084606802
Energy: 0.6810470451529725
Energy: 1.2374988615797557
Energy: 0.6184362074854326
Energy: 0.8135848184107939
Energy: 0.6184362074844748
Energy: 1.3100023162759737
Energy: 0.613547411529841
Energy: 0.6149574371519689
Energy: 0.613547411529841
Energy: 1.303484325460158
Energy: 0.6170558686490344
Energy: 0.8062840478246752
Energy: 0.6170558686490344
Energy: 1.1518380062877616
Energy: 0.6168524643538305
Energy: 0.6226825484679258
Energy: 0.6168524643538305
Energy: 1.3058699182956939
Energy: 0.6139957225431575
Energy: 0.6146927678504642
Energy: 0.6139957225441153
Energy: 1.3069411593382205
Energy: 0.6161137436795158
Energy: 0.6196963562285839
Energy: 0.616113743678558

minimum gb energy = 0.613547411529841 eV
minimum distance =  2.30892702689457 Angstroms
sigma value = 41


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

Energy: 1.60392133383441
Energy: 0.5669502673155472
Energy: 0.8235093184813292
Energy: 0.5624986557379573
Energy: 1.4050286423584473
Energy: 0.5583282781383079
Energy: 0.7174249955897375
Energy: 0.5583282781375226
Energy: 1.403342434525859
Energy: 0.5565164310207942
Energy: 0.7223951201204725
Energy: 0.5565164310223646
Energy: 1.1537674864956018
Energy: 0.5596643934089867
Energy: 0.8905916883493682
Energy: 0.5596643934105571
Energy: 1.2775443275902572
Energy: 0.5550064666106825
Energy: 1.0182201171032585
Energy: 0.5550064666075417
Energy: 1.1467075850025343
Energy: 0.5567822973079104
Energy: 1.0132751215099527
Energy: 0.5567822973079104
Energy: 1.1510896456994482
Energy: 0.613143437397842
Energy: 1.1528858291690691
Energy: 0.6131434373962714
Energy: 1.021434197339517
Energy: 0.6178891178243813
Energy: 1.0201104032299255
Energy: 0.6178891178243813
Energy: 0.8806167688174877
Energy: 0.5574577232867857
Energy: 1.274449804546757
Energy: 0.557457723288356
Energy: 0.8799809633651438
Energy: 0.5552690577289939
Energy: 1.2794346623009123
Energy: 0.5552690577274234
Energy: 0.7278711205625371
Energy: 0.5612970454671887
Energy: 1.2714174385683383
Energy: 0.5612970454664034
Energy: 0.7190597085300182
Energy: 0.5560723810210301
Energy: 1.4030131931327157
Energy: 0.5560723810178891
Energy: 0.718202462539884
Energy: 0.5584558076211823
Energy: 1.407064803247031
Energy: 0.5584558076211823
Energy: 0.5658829177678115
Energy: 0.5599085997975093
Energy: 1.270040544365533
Energy: 0.5599085997982944
Energy: 0.5576702108803157
Energy: 0.5574430451614506
Energy: 1.4008830919446464
Energy: 0.5574430451622359
Energy: 0.5621496075266044
Energy: 0.5579715185429754
Energy: 1.4043621984446937
Energy: 0.557971518544546
Energy: 0.7245257672784651
Energy: 0.5600303799809561
Energy: 1.4084714455685892
Energy: 0.5600303799809561
Energy: 0.7191199501339792
Energy: 0.5550957112525111
Energy: 1.39990218856826
Energy: 0.555095711251726
Energy: 0.7196829948931077
Energy: 0.5598735230546484
Energy: 1.1486254158921776
Energy: 0.5598735230554336
Energy: 1.0140715143641734
Energy: 0.5577935712083323
Energy: 1.1467847702937386
Energy: 0.5577935712091175
Energy: 1.0218773248435193
Energy: 0.5559376531287729
Energy: 1.2719619329150935
Energy: 0.5559376531303432
Energy: 1.0148690174983566
Energy: 0.6113814713397091
Energy: 1.1541726108319692
Energy: 0.611381471338924
Energy: 1.2746445966905238
Energy: 0.6094938114142068
Energy: 1.1443574803372152
Energy: 0.6094938114142068
Energy: 1.0190711706013966
Energy: 0.611819437337717
Energy: 1.0141036967252193
Energy: 0.611819437337717
Energy: 1.2728560547897319
Energy: 0.5555927369296919
Energy: 0.8815877300842672
Energy: 0.5555927369304773
Energy: 1.2747493749304064
Energy: 0.5574539661835431
Energy: 1.014646882606363
Energy: 0.5574539661835431
Energy: 1.2796434736965088
Energy: 0.5607015057758195
Energy: 0.7198557448820689
Energy: 0.5607015057758195
Energy: 1.3993386543462323
Energy: 0.5558336473761751
Energy: 0.7206900442485908
Energy: 0.5558336473769604
Energy: 1.278394335931415
Energy: 0.5596101139001979
Energy: 0.723519512890896
Energy: 0.5596101138986275
Energy: 1.2760936305362343
Energy: 0.559537747517285
Energy: 0.5584251013139956
Energy: 0.5595377475164999
Energy: 1.4003467333414177
Energy: 0.5572733631660285
Energy: 0.5572162407380022
Energy: 0.5572733631660285
Energy: 1.395496021916611
Energy: 0.5583415601256053
Energy: 0.5654036515288021
Energy: 0.5583415601248201

minimum gb energy = 0.5550064666075417 eV
minimum distance =  2.30707005724118 Angstroms
sigma value = 15


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

Energy: 1.4628527121102095
Energy: 0.5248877785251312
Energy: 0.7928900768721099
Energy: 0.5206769041778773
Energy: 1.471228592055229
Energy: 0.5158227823233386
Energy: 0.6562340495866916
Energy: 0.515822782324669
Energy: 1.4719061608345945
Energy: 0.5152771926920725
Energy: 0.6556612187547912
Energy: 0.5152771927000549
Energy: 1.314621342361682
Energy: 0.5225928665064906
Energy: 0.9173314651985013
Energy: 0.5225928665005038
Energy: 1.3658574110550121
Energy: 0.5133274060393384
Energy: 0.909643437435661
Energy: 0.5133274060360123
Energy: 1.3069848408020255
Energy: 0.513535701762483
Energy: 0.9085086704723827
Energy: 0.513535701762483
Energy: 1.0828737032456175
Energy: 0.5227184066498395
Energy: 1.1384273777966667
Energy: 0.5227184066544958
Energy: 1.14408691960947
Energy: 0.5643279199769836
Energy: 0.970444573309352
Energy: 0.5643279199756533
Energy: 1.081358866084343
Energy: 0.5600806292836215
Energy: 1.1357431474743651
Energy: 0.5600806292756391
Energy: 1.07977861428301
Energy: 0.515714268468868
Energy: 1.3562479938667804
Energy: 0.5157142684874935
Energy: 0.9170391110459234
Energy: 0.5245382132050793
Energy: 1.2060715263760606
Energy: 0.5245382131991532
Energy: 0.849168559725238
Energy: 0.5141820266514373
Energy: 1.3565237644304484
Energy: 0.5141820266461158
Energy: 0.908220670718136
Energy: 0.515430640815267
Energy: 1.4138986569870367
Energy: 0.5154306408086152
Energy: 0.6497495226524598
Energy: 0.5139743871510022
Energy: 1.2032939903448305
Energy: 0.5139743871503369
Energy: 0.6478503682301997
Energy: 0.5135227867119763
Energy: 1.414223386137553
Energy: 0.5135227867106459
Energy: 0.6452990833361016
Energy: 0.5120198038394801
Energy: 1.417148191762721
Energy: 0.5120198038388147
Energy: 0.5897465036232594
Energy: 0.5163721117974114
Energy: 1.4203448195402502
Energy: 0.5163721117974114
Energy: 0.5796138480264401
Energy: 0.5123412456252017
Energy: 1.463566280559118
Energy: 0.512341245633184
Energy: 0.5879347275846357
Energy: 0.5157587572298415
Energy: 1.2535240430170016
Energy: 0.5157587572291763
Energy: 0.7272300290916747
Energy: 0.5141912126131412
Energy: 1.4719121253901088
Energy: 0.5141912126111455
Energy: 0.7168115451090198
Energy: 0.5121313213141127
Energy: 1.4621918943460888
Energy: 0.5121313213167734
Energy: 0.7285384770075893
Energy: 0.5183754038385318
Energy: 1.313277441189313
Energy: 0.51837540383188
Energy: 0.8954200789823736
Energy: 0.5153234386768607
Energy: 1.3048982618066576
Energy: 0.5153234386821822
Energy: 0.9059031384839414
Energy: 0.5133200461902321
Energy: 1.3036318593598892
Energy: 0.5133200462208309
Energy: 0.9041054553877501
Energy: 0.5145259241326698
Energy: 1.0909169658036448
Energy: 0.514525924130009
Energy: 1.1392403436996965
Energy: 0.5609525183672075
Energy: 1.245544631239871
Energy: 0.5609525183711987
Energy: 0.9669233236924597
Energy: 0.5597123796115333
Energy: 1.1345399357548127
Energy: 0.5597123796161292
Energy: 1.1450075804416475
Energy: 0.5637717003665603
Energy: 1.0901789087372624
Energy: 0.5637717003878465
Energy: 1.1977341555088488
Energy: 0.5655266126872716
Energy: 1.0931172960550581
Energy: 0.5655266126839457
Energy: 1.1949145587632017
Energy: 0.5138215528672211
Energy: 0.9074211331105148
Energy: 0.5138215528725425
Energy: 1.3645312204389153
Energy: 0.5128162663250339
Energy: 0.8490686656588984
Energy: 0.5128162663316858
Energy: 1.2015371782832949
Energy: 0.5208046154521628
Energy: 0.9149767808627012
Energy: 0.5208046154508325
Energy: 1.4149867027793164
Energy: 0.5159132426177063
Energy: 0.6566096214580472
Energy: 0.5159132426183716
Energy: 1.4711579587287584
Energy: 0.514939480700562
Energy: 0.6553548177831583
Energy: 0.5149394806979012
Energy: 1.4089275942934891
Energy: 0.5206234918706407
Energy: 0.5285835498855618
Energy: 0.5206234918746319
Energy: 1.472237975213925
Energy: 0.5174683801237617
Energy: 0.5197136198671295
Energy: 0.517468380121101
Energy: 1.4703989236598671
Energy: 0.5187734027654867
Energy: 0.5207849168107
Energy: 0.5187734027614955

minimum gb energy = 0.5120198038388147 eV
minimum distance =  2.30591582267836 Angstroms
sigma value = 85


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

Energy: 1.5510987137728987
Energy: 0.4803495676063796
Energy: 0.46137406296665584
Energy: 0.461712210561769
Energy: 1.3567573473061705
Energy: 0.4612165796977122
Energy: 0.5853161458164596
Energy: 0.4612165796959814
Energy: 1.3570900575442535
Energy: 0.4606885657509612
Energy: 0.5853965546225991
Energy: 0.4606885657509612
Energy: 1.1572723908119658
Energy: 0.46351371082068155
Energy: 0.8082351256802054
Energy: 0.4635137108212584
Energy: 1.35941198103605
Energy: 0.4591610332230037
Energy: 0.8082966665063394
Energy: 0.4591610332230037
Energy: 1.161840854483558
Energy: 0.45985856684373155
Energy: 0.8091612058462507
Energy: 0.4598585668443085
Energy: 1.1586765189242192
Energy: 0.46032954654062513
Energy: 1.0153086179252822
Energy: 0.46032954654120206
Energy: 1.2181025593273016
Energy: 0.45924103896449436
Energy: 0.8617526096183755
Energy: 0.45924103896737906
Energy: 1.1651209153616338
Energy: 0.46023829098931573
Energy: 1.011800950155885
Energy: 0.46023829096220026
Energy: 1.1641179993756685
Energy: 0.5426553055417245
Energy: 1.2098538007060338
Energy: 0.5426553055423015
Energy: 1.0126197502007133
Energy: 0.4594929766181376
Energy: 1.059755932032558
Energy: 0.45949297657602217
Energy: 0.9643879447013234
Energy: 0.4589586585101061
Energy: 1.2102934374040188
Energy: 0.45895865865774604
Energy: 1.012011982386391
Energy: 0.45890058245565696
Energy: 1.2606239212847605
Energy: 0.45890058245508003
Energy: 0.8082720127170583
Energy: 0.46108230092231023
Energy: 1.0578633618721367
Energy: 0.46108230092057945
Energy: 0.7540348667034121
Energy: 0.45859194987193685
Energy: 1.4016221346084685
Energy: 0.45859194987424445
Energy: 0.8116916000040555
Energy: 0.4611465139973128
Energy: 1.261737048565446
Energy: 0.4611465140001974
Energy: 0.5751633470887023
Energy: 0.45948450272066016
Energy: 1.2576953293805873
Energy: 0.4594845027200832
Energy: 0.5776570900234098
Energy: 0.45939251979673634
Energy: 1.4514665540836256
Energy: 0.45939251979558243
Energy: 0.5720810442957093
Energy: 0.4598564976247019
Energy: 1.4487766322973028
Energy: 0.45985649762239417
Energy: 0.519321979467467
Energy: 0.45918595722309236
Energy: 1.4481608016923362
Energy: 0.4591859572225155
Energy: 0.5170251587000112
Energy: 0.4568973125233729
Energy: 1.4978236965106548
Energy: 0.4568973125216422
Energy: 0.5193536196790443
Energy: 0.4618979637881862
Energy: 1.3057606520573832
Energy: 0.4618979637876093
Energy: 0.6465321718623698
Energy: 0.46011997323791326
Energy: 1.4943450177284532
Energy: 0.46011997323791326
Energy: 0.6404877335047889
Energy: 0.4587618262608856
Energy: 1.496542161038561
Energy: 0.4587618262614625
Energy: 0.6434769046672069
Energy: 0.45917251723651537
Energy: 1.1574885918936346
Energy: 0.4591725172342076
Energy: 0.8034638205856917
Energy: 0.4591069880586884
Energy: 1.5012421681648522
Energy: 0.45910698805580374
Energy: 0.8032380903540737
Energy: 0.4583230387069156
Energy: 1.3562044601936971
Energy: 0.4583230387069156
Energy: 0.9032906512951994
Energy: 0.45964259111044997
Energy: 1.1589029572204697
Energy: 0.45964259110871925
Energy: 1.0155955254310713
Energy: 0.45856544511210257
Energy: 1.3568345428487487
Energy: 0.45856544511152564
Energy: 1.0126300072001826
Energy: 0.45838401512087845
Energy: 1.1611306878384446
Energy: 0.4583840151451093
Energy: 1.2136264008798785
Energy: 0.5422936645495695
Energy: 0.9625394714298526
Energy: 0.5422936645870696
Energy: 1.0593179296038535
Energy: 0.5424356832285345
Energy: 1.1703953409348409
Energy: 0.5424356831420221
Energy: 1.212745040894495
Energy: 0.6119008926747439
Energy: 0.9603774792766692
Energy: 0.6119008926753208
Energy: 1.3153242289667064
Energy: 0.46082985936395726
Energy: 0.9618322982564482
Energy: 0.46082985934838033
Energy: 1.0581678372864511
Energy: 0.4617675784842472
Energy: 0.8081234309537518
Energy: 0.46176757847790106
Energy: 1.4056237114165884
Energy: 0.45914442873494854
Energy: 0.8077384414476474
Energy: 0.45914442873494854
Energy: 1.4527984384326489
Energy: 0.45992507097596425
Energy: 0.8080491939602269
Energy: 0.4599250709794258
Energy: 1.2573819697496993
Energy: 0.4598558446127962
Energy: 0.5821565980573884
Energy: 0.4598558446127962
Energy: 1.5015841245538828
Energy: 0.4592166540147257
Energy: 0.5802520198111216
Energy: 0.45921665401530265
Energy: 1.4482508248262156
Energy: 0.4595895667669651
Energy: 0.5863071763764427
Energy: 0.45958956676811885
Energy: 1.2561353634237253
Energy: 0.46068687325610946
Energy: 0.46178648061794786
Energy: 0.4606868732543787
Energy: 1.4990770724230984
Energy: 0.4592743407892507
Energy: 0.4599904330903457
Energy: 0.4592743407915583
Energy: 1.3539026685267002
Energy: 0.46078735290889616
Energy: 0.459614533947899
Energy: 0.4607873529083192

minimum gb energy = 0.4568973125216422 eV
minimum distance =  2.30167190187567 Angstroms
sigma value = 113


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

Energy: 0.015448593184548564
Energy: 0.016514359937436062
Energy: 1.1478416516884387
Energy: 0.41203944695614625
Energy: 0.01619947004301856
Energy: 0.10532610082400236
Energy: 0.8385213049142313
Energy: 0.10532610082355884
Energy: 0.015969996603531555
Energy: 0.1038040030006645
Energy: 0.8371313641746193
Energy: 0.10380400300024564
Energy: 0.017195079559791167
Energy: 0.10623440690156029
Energy: 0.8402458071253055
Energy: 0.10623440690197916
Energy: 0.8392561339029997
Energy: 0.10562752101072409
Energy: 0.8396705583885538
Energy: 0.10562752101072409
Energy: 0.015980300697745947
Energy: 0.10359398359944917
Energy: 0.8369087370421011
Energy: 0.1035939835990303

minimum gb energy = 0.015448593184548564 eV
minimum distance =  2.52169814889803 Angstroms
sigma value = 1