Model name: model_name=EAM_Dynamo_ZhouWadleyJohnson_2001_Cu__MO_380822813353_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=3.6148132324218762
cohesive_energy=3.540081929549165
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=[1.65397500457722e-19, 2.32865158515462e-19, 2.8488302729153996e-19, 3.29726349100566e-19, 3.6699297760740595e-19, 3.9750803377857e-19, 4.22844855068646e-19, 4.442002674232319e-19, 4.624234244583479e-19, 4.78160003357496e-19, 4.919275071734579e-19, 5.041328887712699e-19, 5.15058131238516e-19, 5.248618500619619e-19, 5.33590508363994e-19, 5.412264822016379e-19, 5.477569541618219e-19, 5.531979460108859e-19, 5.576231578739939e-19, 5.61139935585624e-19, 5.638219792709399e-19, 5.65691719402818e-19, 5.66784403867206e-19, 5.6713848490332e-19, 5.66757166864428e-19, 5.655266952095159e-19, 5.63291658805086e-19, 5.5986300080832595e-19, 5.550740948493e-19, 5.487775406776799e-19, 5.40713785678758e-19, 5.3055278146592995e-19, 5.17850725111578e-19, 5.0203403738073e-19, 4.82373727904916e-19, 4.579597603560239e-19, 4.2768663285659396e-19, 3.9019249526772594e-19, 3.43756609884504e-19, 2.86123112006256e-19, 2.1420460725926398e-19, 1.2368851679779019e-19, 8.67416827470966e-21, -1.385881186233366e-19, -3.28439801263464e-19, -5.757117320718539e-19, -9.029579117429879e-19]
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: 2.2204e-16 eV

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

Energy: 0.013653979672364031
Energy: 0.014157980961853809
Energy: 0.5630405103952971
Energy: 0.09202035988735878
Energy: 0.014157980961853809
Energy: 0.7332773269169005
Energy: 0.09202035988735878
Energy: 0.7332773269175279
Energy: 0.5630405103959244
Energy: 0.09202035988676635
Energy: 0.013653979672364031
Energy: 0.014157980961853809
Energy: 0.09202035988676635
Energy: 0.7332773269144611
Energy: 0.014157980962446243
Energy: 0.7332773269169005

minimum gb energy = 0.013653979672364031 eV
minimum distance =  2.45020622834217 Angstroms
sigma value = 1


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

Energy: 1.1130524766170984
Energy: 0.7330834626733409
Energy: 0.7791247949461505
Energy: 0.7787287976087186
Energy: 0.7557127613314899
Energy: 0.8022269156781895
Energy: 0.7468230904289183
Energy: 0.8022269156781895
Energy: 0.7782724473444579
Energy: 0.7792079165305412
Energy: 1.2035095788501748
Energy: 0.7792079165328234
Energy: 0.7494513601344779
Energy: 0.7483392023126968
Energy: 0.7467447282615834
Energy: 0.7483392023142181
Energy: 0.8101346920910436
Energy: 0.7480077155510858
Energy: 0.74986873762425
Energy: 0.7480077155488035
Energy: 0.7493587308530382
Energy: 0.8441175872642904
Energy: 0.7479701183850228
Energy: 0.8441175872635297
Energy: 0.7899828236729379
Energy: 0.8035325208337929
Energy: 0.809708728060997
Energy: 0.8035325208337929
Energy: 0.7919967688797483
Energy: 0.8283677559528656
Energy: 0.7773096422629233
Energy: 0.8283677559521049
Energy: 0.8097361446946538
Energy: 0.8360180760986384
Energy: 0.8119671347529651
Energy: 0.8360180761009207
Energy: 0.8139198323490862
Energy: 0.8390696689249657
Energy: 0.8114017784668018
Energy: 0.8390696689257264
Energy: 0.8120110884121159
Energy: 0.8355348550202497
Energy: 0.8116338326744653
Energy: 0.8355348550217713
Energy: 0.8140340755934381
Energy: 0.8347056829465904
Energy: 0.7759956768527658
Energy: 0.8347056829473511
Energy: 0.8009729111989803
Energy: 0.8043091392033859
Energy: 0.8110300218272465
Energy: 0.8043091392056682
Energy: 0.7495121296173166
Energy: 0.8051772830044908
Energy: 0.789788853039471
Energy: 0.80517728300373
Energy: 0.7907617927228324
Energy: 0.7466622239905923
Energy: 0.7470208632178467
Energy: 0.7466622239921138
Energy: 0.72984640009148
Energy: 0.7474714336308119
Energy: 0.7468623062013605
Energy: 0.7474714336308119
Energy: 0.7786649712198505
Energy: 0.7779656442724745
Energy: 0.7293669427956758
Energy: 0.7779656442701922
Energy: 0.7465758027204177
Energy: 0.7470981462154098
Energy: 0.7631078647592192
Energy: 0.7470981462131275
Energy: 0.7733183069811695
Energy: 0.7799747360303543
Energy: 0.7797661059217388
Energy: 0.7799747360295936
Energy: 0.7490172898363731
Energy: 0.7477049811696719
Energy: 0.7490877483173678
Energy: 0.7477049811681503
Energy: 0.7484876150390857
Energy: 0.7498729545599774
Energy: 0.8136142893480309
Energy: 0.7498729545584558
Energy: 0.7479251622779255
Energy: 0.7478686966915595
Energy: 0.7494396497297271
Energy: 0.7478686966907987
Energy: 0.8094558953101971
Energy: 0.8064492126484575
Energy: 0.7897605951930499
Energy: 0.8064492126492182
Energy: 0.7729672292677463
Energy: 0.8052413891317096
Energy: 0.7915846533937281
Energy: 0.8052413891324702
Energy: 0.8113317386813413
Energy: 0.8365711962378242
Energy: 0.807935191871081
Energy: 0.8365711962363026
Energy: 0.810714462088913
Energy: 0.8340746580107442
Energy: 0.8147803599609517
Energy: 0.8340746580115049
Energy: 0.8106818787030451
Energy: 0.8355142473592083
Energy: 0.8119339221593709
Energy: 0.8355142473576868
Energy: 0.8144662936641933
Energy: 0.8351324009210684
Energy: 0.810620425289559
Energy: 0.8351324009218293
Energy: 0.8121828993673657
Energy: 0.8043274097207535
Energy: 0.8024670224840504
Energy: 0.8043274097199926
Energy: 0.7897822894487095
Energy: 0.8078756363640597
Energy: 0.7963610832305759
Energy: 0.8078756363632988
Energy: 0.7462863303047873
Energy: 0.7466578654678838
Energy: 0.7635090563732112
Energy: 0.7466578654678838
Energy: 0.7472887457013466
Energy: 0.7471982608300993
Energy: 0.7300506672814236
Energy: 0.7471982608331423
Energy: 0.7290946742608305
Energy: 0.7500282559372108
Energy: 0.7785118985254903
Energy: 0.7500282559379716

minimum gb energy = 0.7290946742608305 eV
minimum distance =  2.22358372102794 Angstroms
sigma value = 1


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

Energy: 1.2576651604971147
Energy: 0.7628045880478712
Energy: 0.8162814038417897
Energy: 0.8153718757458328
Energy: 0.7934957023625148
Energy: 0.8380902397318108
Energy: 0.7817705776494916
Energy: 0.8380902397283414
Energy: 0.8152385580811593
Energy: 0.8162323149026621
Energy: 0.7828361489606368
Energy: 0.8162323149035295
Energy: 0.7852984723668203
Energy: 0.7815472715417193
Energy: 0.7816922331096776
Energy: 0.7815472715512606
Energy: 0.781108621485114
Energy: 0.7820453405232367
Energy: 0.782590226115686
Energy: 0.7820453405258387
Energy: 0.7859580437363514
Energy: 0.8737888476749234
Energy: 0.7834228716126734
Energy: 0.8737888476697189
Energy: 0.8358082581786884
Energy: 0.8498575787976921
Energy: 0.8326298000150529
Energy: 0.8498575787933552
Energy: 0.8356636340037428
Energy: 0.8538394468728321
Energy: 0.8152108979999544
Energy: 0.8538394468632907
Energy: 0.8380175983622274
Energy: 0.8812098418089777
Energy: 0.8465122104341429
Energy: 0.8812098418098452
Energy: 0.8132206624212256
Energy: 0.8814948945342497
Energy: 0.8372204283652346
Energy: 0.8814948945333824
Energy: 0.8327222565642206
Energy: 0.8495332980727704
Energy: 0.8377488648083407
Energy: 0.8495332980693009
Energy: 0.8328950628424577
Energy: 0.852502510223545
Energy: 0.7858528994875643
Energy: 0.8525025102244124
Energy: 0.7823349924962056
Energy: 0.7819028268991594
Energy: 0.8036582346895633
Energy: 0.7819028268930875
Energy: 0.7814986712612355
Energy: 0.7829090880013831
Energy: 0.7591413645620763
Energy: 0.7829090880005157
Energy: 0.7593596971286126
Energy: 0.81449083125621
Energy: 0.8148904065047705
Energy: 0.8144908312570774
Energy: 0.8045141129402427
Energy: 0.7821940051044862
Energy: 0.7815377197852873
Energy: 0.7821940050958122
Energy: 0.8166852152486235
Energy: 0.816395717805612
Energy: 0.7813926737988363
Energy: 0.8163957178038773
Energy: 0.7850181703612767
Energy: 0.7822421425909726
Energy: 0.7843349169919546
Energy: 0.7822421425849007
Energy: 0.7810009550901832
Energy: 0.7852884588758756
Energy: 0.7841097074368164
Energy: 0.7852884588758756
Energy: 0.7867198980625448
Energy: 0.7829593231480497
Energy: 0.7828717119422938
Energy: 0.7829593231428453
Energy: 0.8344425562389599
Energy: 0.8516712298855587
Energy: 0.8323270017882988
Energy: 0.8516712298812217
Energy: 0.8364110591669555
Energy: 0.8515316285391457
Energy: 0.8112287420581051
Energy: 0.8515316285356761
Energy: 0.8567291865406578
Energy: 0.8809685488377434
Energy: 0.8476596402573883
Energy: 0.8809685488446432
Energy: 0.8119904994923356
Energy: 0.8807614710784847
Energy: 0.8541111108673805
Energy: 0.8807614710888935
Energy: 0.833978953731107
Energy: 0.8488393713926475
Energy: 0.8546821177595849
Energy: 0.8488393713969845
Energy: 0.8325373140748011
Energy: 0.8499883316792508
Energy: 0.7862474801652264
Energy: 0.8499883316827205
Energy: 0.7815421086380687
Energy: 0.7819016019184569
Energy: 0.8033374564365966
Energy: 0.7819016019201916
Energy: 0.7810156568514949
Energy: 0.782485125795738
Energy: 0.7591541161186438
Energy: 0.7824851257922685
Energy: 0.7586485889350161
Energy: 0.785781280632556
Energy: 0.8148535341721378
Energy: 0.7857812806316885

minimum gb energy = 0.7586485889350161 eV
minimum distance =  2.23006800885086 Angstroms
sigma value = 25


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

Energy: 1.2801435892307194
Energy: 0.8301760677621118
Energy: 0.8677447698944599
Energy: 0.8669001573289865
Energy: 0.841229543613066
Energy: 0.8869046637226844
Energy: 0.8337415538903515
Energy: 0.8869046637216761
Energy: 0.8673815368693049
Energy: 0.8663351801568938
Energy: 0.8110016719113918
Energy: 0.8663351801568938
Energy: 0.8372390887383839
Energy: 0.834945307592995
Energy: 0.8335656746914637
Energy: 0.8349453075919868
Energy: 0.8096745968243608
Energy: 0.8334937148274799
Energy: 0.8370322949133138
Energy: 0.8334937148294966
Energy: 0.8366990286759728
Energy: 0.8340557626998653
Energy: 0.8334628565216093
Energy: 0.8340557626978486
Energy: 0.8789381579590277
Energy: 0.9190953551180595
Energy: 0.8805421005324366
Energy: 0.9190953551180595
Energy: 0.8789030433457439
Energy: 0.9212570694604066
Energy: 0.8577703613321371
Energy: 0.9212570694634318
Energy: 0.8797883032612743
Energy: 0.9198875977253822
Energy: 0.8410159633838452
Energy: 0.9198875977253822
Energy: 0.8359403875137935
Energy: 0.9199514086184762
Energy: 0.859157688389764
Energy: 0.9199514086204928
Energy: 0.825187815837852
Energy: 0.8674203068699843
Energy: 0.8677731912861554
Energy: 0.867420306872001
Energy: 0.8153293826201111
Energy: 0.853171416881959
Energy: 0.8517136825134372
Energy: 0.8531714168809508
Energy: 0.8005454439805438
Energy: 0.8009757618520561
Energy: 0.7902887803158904
Energy: 0.8009757618480229
Energy: 0.8007488083738071
Energy: 0.7897052389538145
Energy: 0.8523111243491156
Energy: 0.7897052389517978
Energy: 0.8112631857900544
Energy: 0.9005082674440957
Energy: 0.9020495754982197
Energy: 0.9005082674451041
Energy: 0.8465573757827347
Energy: 0.8516239970601368
Energy: 0.8593269954295129
Energy: 0.8516239970601368
Energy: 0.8358875468374628
Energy: 0.845916935027795
Energy: 0.811117956588095
Energy: 0.8459169350288033
Energy: 0.8355230565327353
Energy: 0.8456325695972678
Energy: 0.8957981343837252
Energy: 0.8456325695972678
Energy: 0.8804806327249379
Energy: 0.9129708177460426
Energy: 0.891425247865288
Energy: 0.9129708177460426
Energy: 0.8431469433683293
Energy: 0.9203800053972621
Energy: 0.8912045886515058
Energy: 0.9203800053952454
Energy: 0.840773362607668
Energy: 0.9175505895294476
Energy: 0.9345111603360511
Energy: 0.9175505895294476
Energy: 0.8406619142164888
Energy: 0.9181316882149405
Energy: 0.8403263999274496
Energy: 0.9181316882159488
Energy: 0.8320732343040979
Energy: 0.8322598319615195
Energy: 0.8252100967886383
Energy: 0.8322598319645446
Energy: 0.8315938257542795
Energy: 0.8322464666989027
Energy: 0.8148267146436134
Energy: 0.8322464666989027
Energy: 0.8259134681555993
Energy: 0.8569221075440225
Energy: 0.8651052568795764
Energy: 0.8569221075430143

minimum gb energy = 0.7897052389517978 eV
minimum distance =  2.20968520321884 Angstroms
sigma value = 9


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

Energy: 1.1221753042443314
Energy: 0.8296048206597638
Energy: 0.8998697147486356
Energy: 0.898613897934924
Energy: 0.8964672195715648
Energy: 0.9144420623543857
Energy: 0.8708089173390122
Energy: 0.9144420623495743
Energy: 0.8990293390238047
Energy: 0.8976711303718442
Energy: 0.8961851173265241
Energy: 0.8976711303742498
Energy: 0.8748389191561574
Energy: 0.9144122468105598
Energy: 0.8709343748657297
Energy: 0.914412246808154
Energy: 0.8703915339452024
Energy: 0.8711812714869563
Energy: 0.8747132369384187
Energy: 0.8711812714833478
Energy: 0.8794387016430025
Energy: 0.8709338301450719
Energy: 0.8710132878884358
Energy: 0.8709338301450719
Energy: 0.9195310655673312
Energy: 0.974248197522743
Energy: 0.8729845396115141
Energy: 0.9742481975215402
Energy: 0.8717459577696476
Energy: 0.9781207827941288
Energy: 0.8705140893526343
Energy: 0.9781207827929259
Energy: 0.8703345428216149
Energy: 0.8706020849739916
Energy: 0.8203115432338544
Energy: 0.8706020849739916
Energy: 0.870518432752391
Energy: 0.8710819429372171
Energy: 0.8203456262131815
Energy: 0.8710819429384199
Energy: 0.8210530516956854
Energy: 0.8964132958331337
Energy: 0.8966313949467968
Energy: 0.8964132958319309
Energy: 0.9248837797435874
Energy: 0.8760309740251505
Energy: 0.8707930818851753
Energy: 0.876030974021542
Energy: 0.9027207193116041
Energy: 0.8965893759916187
Energy: 0.8961373151827761
Energy: 0.8965893759916187
Energy: 0.8962426391435955
Energy: 0.8706167307701012
Energy: 0.8734375843329306
Energy: 0.8706167307701012
Energy: 0.8685767011916732
Energy: 0.8770263862481257
Energy: 0.8803035149135988
Energy: 0.8770263862445172
Energy: 0.8753606497151912
Energy: 0.8713228236581148
Energy: 0.8797680522254528
Energy: 0.871322823655709
Energy: 0.9245269004833431
Energy: 0.9744217216692698
Energy: 0.8735344034003897
Energy: 0.9744217216704726
Energy: 0.9254180168676762
Energy: 0.9738433721856903
Energy: 0.870860001150082
Energy: 0.9738433721880959
Energy: 0.869256322824829
Energy: 0.8706202704401462
Energy: 0.8199624243603009
Energy: 0.8706202704341319
Energy: 0.8706262938562298
Energy: 0.8706014196105775
Energy: 0.8203347318074323
Energy: 0.8706014196105775
Energy: 0.8205953807044232
Energy: 0.8747568734730257
Energy: 0.8957106679830793
Energy: 0.8747568734730257

minimum gb energy = 0.8199624243603009 eV
minimum distance =  2.25725270422284 Angstroms
sigma value = 25


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

Energy: 1.008792806422449
Energy: 0.8665855459349336
Energy: 0.9505257571014889
Energy: 0.9493800106356024
Energy: 0.9448159631761253
Energy: 0.9269497756421432
Energy: 0.8825829435885694
Energy: 0.9269497756421432
Energy: 0.9491641375322096
Energy: 0.9456592627349959
Energy: 0.9509579953754052
Energy: 0.9456592627335083
Energy: 0.9478010364652404
Energy: 0.9270593824318697
Energy: 0.8824087276552552
Energy: 0.9270593824303822
Energy: 0.9323271528225322
Energy: 0.9370440263804078
Energy: 0.8828377762135249
Energy: 0.9370440263804078
Energy: 0.859767007382183
Energy: 0.9365052532838565
Energy: 0.8823480930855918
Energy: 0.936505253285344
Energy: 0.8556816231791734
Energy: 0.9370215269900832
Energy: 0.9336711376951596
Energy: 0.9370215269885956
Energy: 0.8557474587318492
Energy: 0.8844707161152685
Energy: 0.8863565187147333
Energy: 0.8844707161152685
Energy: 0.9450401783167574
Energy: 0.9449720116883206
Energy: 1.0283896486471462
Energy: 0.9449720116883206
Energy: 0.9510747188740378
Energy: 0.8605372153809012
Energy: 0.9453827720560972
Energy: 0.8605372153809012
Energy: 0.9537342656144354
Energy: 0.944840069458105
Energy: 0.9538396773237279
Energy: 0.9448400694566174
Energy: 0.948479397608958
Energy: 0.8836434785831905
Energy: 0.9458130054209019
Energy: 0.8836434785802153
Energy: 0.88275459336391
Energy: 0.8597228132838041
Energy: 0.9324599165862334
Energy: 0.8597228132852917
Energy: 0.8830161795914987
Energy: 0.9367080312825194
Energy: 0.8616662493688472
Energy: 0.936708031284007
Energy: 0.933587642064778
Energy: 0.9365429749382066
Energy: 0.8554013837597196
Energy: 0.9365429749382066
Energy: 0.8827532921156179
Energy: 0.9372421520991104
Energy: 0.8553734951225557
Energy: 0.9372421520991104
Energy: 1.029375916404275
Energy: 0.8602927668135992
Energy: 0.943222888042271
Energy: 0.8602927668150868

minimum gb energy = 0.8553734951225557 eV
minimum distance =  2.28721415664883 Angstroms
sigma value = 17


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

Energy: 1.3619130346470243
Energy: 0.9709082904896308
Energy: 1.0289706611099267
Energy: 1.028513032663783
Energy: 0.9088125105879108
Energy: 0.9280974498873859
Energy: 0.9838487912205515
Energy: 0.9280974498899133
Energy: 0.9244977999762753
Energy: 0.9238148357572467
Energy: 1.0283329982448248
Energy: 0.9238148357572467
Energy: 0.9239514375672013
Energy: 0.9842173440625841
Energy: 0.9223361123503256
Energy: 0.9842173440642692
Energy: 0.9227686978839349
Energy: 1.0158677554627131
Energy: 0.8830414502167889
Energy: 1.015867755461871
Energy: 0.9251723283094024
Energy: 1.0157425075504385
Energy: 0.9235147300274312
Energy: 1.015742507549596
Energy: 0.9604003331582197
Energy: 0.9233646493221891
Energy: 0.9258187835635612
Energy: 0.9233646493205041
Energy: 1.0850396069141155
Energy: 0.9230227384361156
Energy: 0.9235890228829676
Energy: 0.9230227384335882
Energy: 1.031061405387027
Energy: 1.022040035102865
Energy: 1.0292115796955472
Energy: 1.0220400351037073
Energy: 1.0211823024854907
Energy: 0.9676771535462899
Energy: 0.9844940658071774
Energy: 0.9676771535488174
Energy: 0.9829031319825214
Energy: 0.9312688473052521
Energy: 0.9023921543558785
Energy: 0.9312688473077412
Energy: 0.9623539711110091
Energy: 0.9293576094603443
Energy: 0.9055255394634516
Energy: 0.9293576094603443
Energy: 0.9603011279193863
Energy: 0.9285484283724611
Energy: 0.9278004719277171
Energy: 0.928548428375831
Energy: 0.9605288847346845
Energy: 0.9286842006422653
Energy: 0.903026110866445
Energy: 0.9286842006397379
Energy: 1.020540867317459
Energy: 1.0382819529414704
Energy: 1.0871919460016946
Energy: 1.038281952940628
Energy: 1.0351073785023241
Energy: 1.020118094759312
Energy: 1.0847792927105289
Energy: 1.0201180947584694
Energy: 1.0286894729193186
Energy: 0.9235921994680295
Energy: 0.9236566085001345
Energy: 0.923592199468872
Energy: 1.02837087148813
Energy: 0.923885567483298
Energy: 0.9218636460046733
Energy: 0.923885567483298
Energy: 0.9234432262928477
Energy: 1.0158513242916372
Energy: 0.9244461771682789
Energy: 1.015851324293322
Energy: 0.9690306904396961
Energy: 1.0170530783015663
Energy: 0.9242739778284877
Energy: 1.0170530783032514
Energy: 0.9247276473482863
Energy: 0.9236357598085544
Energy: 1.0206643347274693
Energy: 0.9236357598102395
Energy: 0.9239142627618394
Energy: 0.9250041570883571
Energy: 0.9606500064102755
Energy: 0.9250041570883571
Energy: 0.9860789571122194
Energy: 0.9820968647781029
Energy: 0.9839904239067024
Energy: 0.9820968647781029
Energy: 1.0297313883374781
Energy: 1.021707739732126
Energy: 1.0226370343087638
Energy: 1.0217077397338106
Energy: 0.9025873748599462
Energy: 0.929021657797712
Energy: 1.0246088133148565
Energy: 0.9290216577993968
Energy: 0.9265942160501434
Energy: 0.9291121516800452
Energy: 0.9244502673916375
Energy: 0.9291121516800452
Energy: 0.9019526314817449
Energy: 0.9081796140724607
Energy: 0.9617018176386924
Energy: 0.9081796140733034
Energy: 0.9043227340900554
Energy: 0.9290402944616359
Energy: 0.9599637898399153
Energy: 0.9290402944624783
Energy: 0.9290436487212658
Energy: 0.9277668555975006
Energy: 0.9603758291420009
Energy: 0.9277668555991473
Energy: 1.0879858198521393
Energy: 1.0221790573303735
Energy: 1.0245028568028325
Energy: 1.0221790573295306

minimum gb energy = 0.8830414502167889 eV
minimum distance =  2.27510228401497 Angstroms
sigma value = 53


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

Energy: 1.2444544506719155
Energy: 0.8661152954278637
Energy: 0.976715753524792
Energy: 0.9737352070561839
Energy: 1.0649941882691463
Energy: 0.911679497730168
Energy: 0.9629220324307313
Energy: 0.9116794977282284
Energy: 0.9615528320512826
Energy: 0.9627239015259513
Energy: 0.9732606704470087
Energy: 0.9627239015298306
Energy: 0.9620966794146059
Energy: 0.912358235067421
Energy: 0.9607693124433828
Energy: 0.912358235067421
Energy: 0.9750926895378897
Energy: 0.9122320931327954
Energy: 0.8506597276271617
Energy: 0.9122320931289164
Energy: 0.9606996975705615
Energy: 0.9145666270899222
Energy: 0.8511304646673088
Energy: 0.9145666270879826
Energy: 1.0777980348871556
Energy: 0.960880876512913
Energy: 0.9624000903248483
Energy: 0.960880876512913
Energy: 1.0631027852600246
Energy: 0.960496437335297
Energy: 0.9596828131259939
Energy: 0.960496437335297
Energy: 0.9613781776390854
Energy: 0.9619013537846819
Energy: 0.9734342620508606
Energy: 0.961901353788561
Energy: 0.9601503894605858
Energy: 0.9134982525118867
Energy: 0.9651786425979871
Energy: 0.9134982525138261
Energy: 0.9750066983440198
Energy: 0.9148697663540318
Energy: 0.8703884909815792
Energy: 0.9148697663559714
Energy: 0.963759541770818
Energy: 0.9118496154690335
Energy: 0.8526250516132895
Energy: 0.9118496154690335
Energy: 1.0630613003595155
Energy: 0.9606120756876172
Energy: 0.9595795485882638
Energy: 0.9606120756876172

minimum gb energy = 0.8506597276271617 eV
minimum distance =  2.27388234442309 Angstroms
sigma value = 9


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

Energy: 1.2164212893313437
Energy: 1.0072589887936285
Energy: 1.0758588705538985
Energy: 1.0752480907379303
Energy: 0.9427878462239893
Energy: 0.9232218848498847
Energy: 1.066821756616423
Energy: 0.9232218848477309
Energy: 0.9361144818743979
Energy: 0.9252614193556149
Energy: 1.0545811929509123
Energy: 0.9252614193570505
Energy: 0.9261549067991002
Energy: 0.9241199636847334
Energy: 1.0783634652088074
Energy: 0.9241199636868869
Energy: 0.9241870953207031
Energy: 0.9221139595169809
Energy: 1.1132558283807843
Energy: 0.9221139595176988
Energy: 0.9223701789506975
Energy: 0.9222001760520355
Energy: 1.1242524442406148
Energy: 0.9222001760534714
Energy: 1.0676178108873235
Energy: 1.0541598963354308
Energy: 1.0690940964714635
Energy: 1.0541598963339953
Energy: 1.0675293522452198
Energy: 1.0539842310524172
Energy: 1.0542893203377093
Energy: 1.0539842310509817
Energy: 0.9575921553094311
Energy: 1.032287912662796
Energy: 0.989673645983816
Energy: 1.0322879126649496
Energy: 0.9243900451644711
Energy: 0.993429524827327
Energy: 1.056676422380366
Energy: 0.9934295248251734
Energy: 0.9544811940897018
Energy: 0.9552194765873581
Energy: 0.9922462362555762
Energy: 0.955219476588076
Energy: 0.968653083415817
Energy: 0.95623499192538
Energy: 1.115476701974609
Energy: 0.95623499192538
Energy: 1.0672002954390991
Energy: 0.9556750855623418
Energy: 0.9738771845653476
Energy: 0.9556750855623418
Energy: 1.068000982709106
Energy: 0.9560197207585631
Energy: 0.9596115362858335
Energy: 0.956019720759999
Energy: 1.0531519335409372
Energy: 0.9756876635115997
Energy: 0.9720449920358137
Energy: 0.9756876635123176
Energy: 0.991302203267856
Energy: 1.0323742955546213
Energy: 0.9691135088518953
Energy: 1.0323742955531856
Energy: 1.0585302827979974
Energy: 1.0060308259334647
Energy: 0.9577432729940271
Energy: 1.006030825932029
Energy: 1.0536964777001934
Energy: 1.0549692564272974
Energy: 1.214677390220908
Energy: 1.0549692564287332
Energy: 1.0671451255707947
Energy: 0.9229456896360169
Energy: 0.9268005188602727
Energy: 0.9229456896345811
Energy: 1.1362765647522617
Energy: 0.9272376753156256
Energy: 0.9275979071499367
Energy: 0.927237675313472
Energy: 1.078160566259764
Energy: 0.9230856016051583
Energy: 0.923441582694611
Energy: 0.9230856016051583
Energy: 1.1241577836207282
Energy: 0.9217641178340378
Energy: 0.9223880446926712
Energy: 0.9217641178369094
Energy: 1.1135609937005921
Energy: 0.922502363663756
Energy: 0.9224818052749645
Energy: 0.9225023636651918
Energy: 1.0704758191512336
Energy: 1.0538144011247768
Energy: 1.0677713557126183
Energy: 1.0538144011247768
Energy: 1.0549001720924638
Energy: 1.0533337145379444
Energy: 1.0675852260964576
Energy: 1.0533337145372268
Energy: 0.9711414011428712
Energy: 1.0332570363582578
Energy: 0.9567708199598352
Energy: 1.0332570363575397
Energy: 1.0586956767742555
Energy: 0.9933634950968572
Energy: 0.9237691780212489
Energy: 0.9933634951026
Energy: 0.9926346533023981
Energy: 0.9551051313793278
Energy: 0.9554970189465541
Energy: 0.9551051313800458
Energy: 1.1155097965427656
Energy: 0.9635881525461054
Energy: 0.9683657406655617
Energy: 0.9635881525446699
Energy: 0.9743893181087446
Energy: 0.9554972762841859
Energy: 1.0674212230526998
Energy: 0.9554972762856216
Energy: 0.958808629242315
Energy: 0.9565555255926296
Energy: 1.05409781792165
Energy: 0.9565555255919116
Energy: 0.964369633230269
Energy: 0.9623411311618573
Energy: 1.0532289831050907
Energy: 0.9623411311625751
Energy: 0.9693791954480309
Energy: 1.0332914831756113
Energy: 0.9914767815107272
Energy: 1.0332914831763291
Energy: 0.9568998358356595
Energy: 1.008201432780716
Energy: 0.9978255033919277
Energy: 1.0082014327821518
Energy: 1.1150279189468144
Energy: 1.0544885223756204
Energy: 1.0597900778771125
Energy: 1.0544885223741847

minimum gb energy = 0.9217641178340378 eV
minimum distance =  2.27541202742766 Angstroms
sigma value = 73


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

Energy: 1.1566108093787497
Energy: 0.9360911836976454
Energy: 1.0387391790447458
Energy: 1.0068791312520478
Energy: 0.967460632413098
Energy: 0.9226193960581002
Energy: 1.0128533140066434
Energy: 0.9226193960558224
Energy: 0.9285137210004111
Energy: 0.9289307357681456
Energy: 1.0222692620953016
Energy: 0.9289307357670067
Energy: 0.9286594595424402
Energy: 0.9260280986177266
Energy: 1.0939352443844277
Energy: 0.9260280986177266
Energy: 0.9239154185431472
Energy: 0.922743600818448
Energy: 1.091426527496007
Energy: 0.9227436008207259
Energy: 0.9232591377199058
Energy: 0.9224720474312784
Energy: 1.091042660192102
Energy: 0.9224720474312784
Energy: 1.0105902788362469
Energy: 1.00614441034803
Energy: 1.015210394317331
Energy: 1.0061444103503079
Energy: 1.0103209752182474
Energy: 1.0051694009704475
Energy: 1.004031484943919
Energy: 1.0051694009704475
Energy: 1.0066919224285478
Energy: 0.9926172329338437
Energy: 1.0252031576140832
Energy: 0.9926172329315658
Energy: 0.9250782889163565
Energy: 0.9939952063724837
Energy: 1.0065511170423345
Energy: 0.9939952063736227
Energy: 1.003699588656698
Energy: 1.0055219125245107
Energy: 0.9266488650466326
Energy: 1.0055219125256498
Energy: 1.0239379886703766
Energy: 1.0071482138747092
Energy: 1.0930490031196705
Energy: 1.0071482138769872
Energy: 1.0032846846981325
Energy: 0.9224041553526814
Energy: 0.922888646007709
Energy: 0.9224041553538205
Energy: 1.0212956376063504
Energy: 0.9236744689745322
Energy: 0.9266022229634391
Energy: 0.9236744689745322
Energy: 1.0934532930997931
Energy: 0.9281128945356455
Energy: 0.9304832674639028
Energy: 0.9281128945356455
Energy: 1.0916260285490205
Energy: 0.925779723781896
Energy: 0.9306473285172401
Energy: 0.9257797237807571
Energy: 1.0953888025012593
Energy: 0.9223432360576113
Energy: 0.9229346220172309
Energy: 0.9223432360564724
Energy: 1.0269494077557588
Energy: 1.026244320592073
Energy: 1.0111008296682835
Energy: 1.026244320592073
Energy: 1.005134204923886
Energy: 0.9891628660596223
Energy: 1.0101432732481126
Energy: 0.9891628660596223
Energy: 1.0219945607142011
Energy: 0.9963322227155348
Energy: 1.0064533858861535
Energy: 0.9963322227155348
Energy: 1.0048745674726987
Energy: 0.997105236027962
Energy: 0.9300734659812829
Energy: 0.997105236029101
Energy: 1.091914087993283
Energy: 1.004579038805251
Energy: 1.0055707307411677
Energy: 1.004579038805251

minimum gb energy = 0.9223432360564724 eV
minimum distance =  2.27752787572546 Angstroms
sigma value = 7


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

Energy: 1.5262592602703788
Energy: 0.9545283770271721
Energy: 1.05804362448311
Energy: 1.0563004887122398
Energy: 0.9761758388516986
Energy: 1.015967887905685
Energy: 1.0223184149050186
Energy: 1.0159678879072958
Energy: 0.9431268090437983
Energy: 0.9471679862938887
Energy: 1.0263770314228857
Energy: 0.9471679863043582
Energy: 0.9465612135022374
Energy: 0.9438623005722774
Energy: 1.0992598843128174
Energy: 0.9438623005722774
Energy: 0.9410597935945832
Energy: 0.938554801238829
Energy: 1.0955072595641508
Energy: 0.9385548012420504
Energy: 0.9422301442401569
Energy: 0.9382682311069661
Energy: 1.0932012654261323
Energy: 0.9382682311029394
Energy: 1.0896330981959448
Energy: 0.9415134496357398
Energy: 0.9416534675896462
Energy: 0.9415134496365453
Energy: 1.021251603469285
Energy: 0.9379943291782656
Energy: 0.9381778232224136
Energy: 0.9379943291806817
Energy: 1.100647718437384
Energy: 0.9407983096559324
Energy: 0.9405898364231376
Energy: 0.9407983096575432
Energy: 1.1141211975127747
Energy: 1.0632752626424842
Energy: 0.9386464623570028
Energy: 1.0632752626440949
Energy: 1.0222862395010095
Energy: 1.015484733788865
Energy: 0.9385564389034344
Energy: 1.0154847337832642
Energy: 1.0168113906032337
Energy: 1.0200668187662427
Energy: 1.094872156491999
Energy: 1.0200668187686588
Energy: 1.0197989038825617
Energy: 1.0008009216400715
Energy: 1.0193952750260593
Energy: 1.000800921648125
Energy: 1.0259421657037309
Energy: 1.0022471724483417
Energy: 0.9560205926112659
Energy: 1.0022471724499522
Energy: 1.0182401134483678
Energy: 0.99941268423492
Energy: 0.9557146125965436
Energy: 0.9994126842276718
Energy: 1.0773525699852116
Energy: 1.0198187227518143
Energy: 1.0162154186293726
Energy: 1.019818722746982
Energy: 0.9509239813836864
Energy: 1.0151320529374073
Energy: 1.022591672475113
Energy: 1.0151320529374073
Energy: 0.9389546661915655
Energy: 1.0631209373849684
Energy: 1.0329946092379936
Energy: 1.0631209373857737
Energy: 0.9414803512893711
Energy: 0.9410998500986381
Energy: 1.0223370651106771
Energy: 0.9410998500898157
Energy: 0.9375852359323601
Energy: 0.9375071880521156
Energy: 0.9529860708091408
Energy: 0.9375071880496995
Energy: 0.9421060264318082
Energy: 0.9416543664061454
Energy: 1.0967137583383733
Energy: 0.9416543664045348
Energy: 1.0196619863561407
Energy: 0.9385234116824998
Energy: 0.9421614096063123
Energy: 0.9385234116929694
Energy: 1.0842992149095236
Energy: 0.938787956392527
Energy: 0.9410932560446154
Energy: 0.9387879563917216
Energy: 1.0987487932373292
Energy: 0.9434983344640195
Energy: 0.9453345299237178
Energy: 0.9434983344648247
Energy: 1.083895198128472
Energy: 0.9475057425544383
Energy: 0.9436046331513294
Energy: 0.9475057425616865
Energy: 1.0855073710526921
Energy: 1.058047943146622
Energy: 0.9426367476436583
Energy: 1.0580479431482328
Energy: 1.0271496305674246
Energy: 1.0280241157870218
Energy: 1.32050515718152
Energy: 1.028024115782995
Energy: 1.015843758133465
Energy: 1.0196619316456759
Energy: 1.0162473991792653
Energy: 1.0196619316448707
Energy: 1.0275210135751935
Energy: 1.0028224563877928
Energy: 1.021922061384055
Energy: 1.0028224563869874
Energy: 1.0153449999965785
Energy: 1.0322519933530105
Energy: 0.9559296891730809
Energy: 1.0322519933497891
Energy: 1.0779258490880204
Energy: 1.0163522464992414
Energy: 1.019867778397109
Energy: 1.0163522464976305

minimum gb energy = 0.9375071880496995 eV
minimum distance =  2.26571932291931 Angstroms
sigma value = 29


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

Energy: 0.8882004071164757
Energy: 0.8896506620041137
Energy: 0.9796505617606919
Energy: 1.0371239903836338
Energy: 0.9057245728069875
Energy: 0.9694777192794289
Energy: 0.9039221244981633
Energy: 0.9694777192791484
Energy: 0.9035766390067261
Energy: 0.9537685787099041
Energy: 0.892023218574344
Energy: 0.9537685787096235
Energy: 0.8953932894718725
Energy: 0.9013395974618592
Energy: 0.9046759417104694
Energy: 0.9013395974612981
Energy: 0.9013908993531123
Energy: 0.9007047367307547
Energy: 0.8925047609729471
Energy: 0.9007047367313157
Energy: 0.9036094623248488
Energy: 0.96149771923806
Energy: 0.8940329457925457
Energy: 0.9614977192389016
Energy: 0.8916928165789044
Energy: 0.9536588934352709
Energy: 0.903575005070917
Energy: 0.953658893435832
Energy: 0.9047109399347347
Energy: 0.9055883827574787
Energy: 0.9037117059098314
Energy: 0.9055883827596606
Energy: 0.9057216597913773
Energy: 0.9033212176685254
Energy: 0.901231321416659
Energy: 0.9033212176696163

minimum gb energy = 0.8882004071164757 eV
minimum distance =  2.25509008320051 Angstroms
sigma value = 5


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

Energy: 1.3228574327110845
Energy: 0.8689545886830752
Energy: 1.0023310114195458
Energy: 0.8862615126377126
Energy: 0.9517183547270074
Energy: 0.8870621824154733
Energy: 1.0161379005109612
Energy: 0.8870621824139517
Energy: 1.0148068475161978
Energy: 0.9559630337280662
Energy: 1.0180382272792006
Energy: 0.955963033721254
Energy: 0.9724187162343718
Energy: 0.9561414526300983
Energy: 1.00775173679562
Energy: 0.9561414526285769
Energy: 0.9503354118388514
Energy: 0.8851441866417623
Energy: 0.9732498163794658
Energy: 0.8851441866371977
Energy: 0.8860614076227102
Energy: 0.8854196188644821
Energy: 0.9737498244724484
Energy: 0.8854196188637213
Energy: 0.884187733155322
Energy: 0.8840726876910648
Energy: 1.0079996535074107
Energy: 0.8840726876948687
Energy: 0.8979223210363011
Energy: 0.8883240660991123
Energy: 1.077222137022649
Energy: 0.8883240661013945
Energy: 0.9918314292990889
Energy: 0.91224796418916
Energy: 1.0664008447042146
Energy: 0.9122479641876384
Energy: 1.0708970879904032
Energy: 0.8702484203076886
Energy: 0.875655624463036
Energy: 0.870248420306167
Energy: 0.9912659450549691
Energy: 0.8676952321649092
Energy: 0.8694936608646525
Energy: 0.8676952321656699
Energy: 1.0865995767726984
Energy: 0.8682581585073614
Energy: 0.8677373268248001
Energy: 0.8682581585088829
Energy: 1.0736297840248679
Energy: 0.86737650955399
Energy: 0.9811976305705649
Energy: 0.8673765095501863
Energy: 0.9925590844079647
Energy: 0.8572913030822261
Energy: 1.0738756030107481
Energy: 0.8572913030852345
Energy: 0.9338496501316976
Energy: 0.8608501022105249
Energy: 1.0918796194522524
Energy: 0.860850102204439
Energy: 0.9326715261508837
Energy: 0.8567097798954905
Energy: 0.901638659180127
Energy: 0.8567097798932082
Energy: 0.9310386161224441
Energy: 0.8587768745223348
Energy: 0.9005461290799828
Energy: 0.8587768745192917
Energy: 1.0441294688019287
Energy: 0.8593150713986676
Energy: 0.9011799812347948
Energy: 0.8593150713986676
Energy: 1.0395587973821063
Energy: 0.9294686391397415
Energy: 0.9252890324115082
Energy: 0.9294686391473492
Energy: 1.0404371742012226
Energy: 0.9988260058575708
Energy: 0.97255990477207
Energy: 0.9988260058514846
Energy: 0.9703605928423202
Energy: 0.8943252748255521
Energy: 0.9050708361598986
Energy: 0.8943252748240306
Energy: 0.9730913883536285
Energy: 0.8904335455685575
Energy: 0.8902928349138497
Energy: 0.8904335455677967
Energy: 1.0335501391890507
Energy: 0.8894428730184906
Energy: 0.8903753192010428
Energy: 0.8894428730177298
Energy: 1.0758892514966294
Energy: 0.8921649193430007
Energy: 0.8983229694774368
Energy: 0.8921649193468044
Energy: 1.071163379386651
Energy: 0.8639508062279816
Energy: 0.90911637238314
Energy: 0.8639508062256993
Energy: 0.8640281853013999
Energy: 0.8665775700691211
Energy: 1.1421942846446953
Energy: 0.8665775700653172
Energy: 0.8672309812676053
Energy: 0.8643465297225467
Energy: 0.9204930526129703
Energy: 0.8643465297271112
Energy: 0.8636875973573845
Energy: 0.866405778170722
Energy: 0.9121667287577512
Energy: 0.866405778170722
Energy: 0.8627871477241461
Energy: 0.8635004945756751
Energy: 1.0734588922510535
Energy: 0.8635004945711106
Energy: 1.0923155143803256
Energy: 0.9075754775484525
Energy: 0.9079307772873765
Energy: 0.9075754775484525
Energy: 1.092106965980261
Energy: 0.8845748803907547
Energy: 0.8878933446346802
Energy: 0.8845748803907547
Energy: 1.0064302101737557
Energy: 0.8840137877346291
Energy: 0.887372436476018
Energy: 0.8840137877346291
Energy: 0.8919853680969689
Energy: 0.883677548198198
Energy: 0.8841908177535508
Energy: 0.883677548201241

minimum gb energy = 0.8567097798932082 eV
minimum distance =  2.22704516042755 Angstroms
sigma value = 1


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

Energy: 1.3087478971628703
Energy: 0.8113770220310496
Energy: 0.9649973968375151
Energy: 0.8380069670699679
Energy: 0.855532212347742
Energy: 0.8403850519758952
Energy: 1.01844269829454
Energy: 0.8403850519779988
Energy: 1.0189419892584188
Energy: 0.9288677862768078
Energy: 1.020326134821445
Energy: 0.9288677862768078
Energy: 0.8604770340082669
Energy: 0.9290524023916654
Energy: 1.007527103984227
Energy: 0.929052402395873
Energy: 0.8390430185413368
Energy: 0.8364846185280506
Energy: 1.0150880283680936
Energy: 0.8364846185217395
Energy: 0.8372680716533029
Energy: 0.8375927241579804
Energy: 1.0150961572443942
Energy: 0.8375927241548248
Energy: 0.83570927679213
Energy: 0.8361286409674749
Energy: 1.0086833193059752
Energy: 0.8361286409695784
Energy: 0.8442403346217129
Energy: 0.8429700641611414
Energy: 1.1495071507015917
Energy: 0.8429700641611414
Energy: 1.0104401353178085
Energy: 0.8780670445977079
Energy: 1.1481814837433466
Energy: 0.8780670445966561
Energy: 1.0149363479231293
Energy: 0.84359436262888
Energy: 0.8429371016467998
Energy: 0.8435943626257244
Energy: 1.0092513637236615
Energy: 0.8360729315526864
Energy: 0.8361319002721149
Energy: 0.8360729315547901
Energy: 1.1467415189497139
Energy: 0.8406397061409221
Energy: 0.8375997509355734
Energy: 0.8406397061388183
Energy: 1.147256601178724
Energy: 0.8368999024826079
Energy: 0.8379430158211425
Energy: 0.836899902481556
Energy: 0.8397981339399276
Energy: 0.9284987045084722
Energy: 1.0192836580572568
Energy: 0.9284987045105759
Energy: 0.8643718807198867
Energy: 0.9279667968269318
Energy: 1.0185921543035896
Energy: 0.9279667968300874
Energy: 0.8670421876313859
Energy: 0.8384729640461211
Energy: 0.838617822587146
Energy: 0.8384729640461211
Energy: 0.837587991379385
Energy: 0.8376817118083487
Energy: 1.017566014634533
Energy: 0.837681711806245
Energy: 0.8479878071286922
Energy: 0.8426718973075841
Energy: 1.0043420336048914
Energy: 0.8426718973054804
Energy: 0.835864941917763
Energy: 0.8365658560792474
Energy: 1.1481333319627258
Energy: 0.8365658560845068
Energy: 0.8390764606489023
Energy: 0.8432627753540157
Energy: 1.1495264568690444
Energy: 0.8432627753561194
Energy: 1.015250847612237
Energy: 0.8745359798897858
Energy: 1.0079576719009116
Energy: 0.8745359798876821
Energy: 1.0168251891049551
Energy: 0.8385105021560956
Energy: 0.8423508319093942
Energy: 0.8385105021571473
Energy: 0.8383859509179216
Energy: 0.8364105218739522
Energy: 0.8375478860743363
Energy: 0.8364105218771077
Energy: 1.147407410175958
Energy: 0.8370263903702676
Energy: 0.8372758777166665
Energy: 0.8370263903734232

minimum gb energy = 0.8113770220310496 eV
minimum distance =  2.24303794776054 Angstroms
sigma value = 17


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

Energy: 1.4021673539258057
Energy: 0.8126174195055286
Energy: 0.9695328563384472
Energy: 0.833009569144222
Energy: 0.8587168365348289
Energy: 0.8328329185776495
Energy: 0.9461673925099975
Energy: 0.8328329185756991
Energy: 1.0335876795996821
Energy: 0.8330432609546651
Energy: 0.9630538704476055
Energy: 0.8330432609605165
Energy: 1.0416464098882645
Energy: 0.8745644776314743
Energy: 0.9385442063277352
Energy: 0.8745644776301741
Energy: 0.9236167137819221
Energy: 0.8141119343353297
Energy: 1.0590727962444555
Energy: 0.8141119343359797
Energy: 0.8144925773100248
Energy: 0.8136924997545291
Energy: 1.04700401698051
Energy: 0.8136924997545291
Energy: 0.8143734239891146
Energy: 0.8142108435547563
Energy: 0.8473035818147743
Energy: 0.8142108435547563
Energy: 0.8204039174065796
Energy: 0.815815688398027
Energy: 1.0610738639408466
Energy: 0.8158156883954264
Energy: 1.0542986110645518
Energy: 0.8138298146698238
Energy: 1.032469989988325
Energy: 0.8138298146691738
Energy: 0.9621085654477578
Energy: 0.8776765984740722
Energy: 0.9515877473420145
Energy: 0.8776765984753725
Energy: 1.052413883651055
Energy: 0.8291454977055652
Energy: 0.8437324487664892
Energy: 0.8291454977101163
Energy: 1.060691180768326
Energy: 0.8340895074399877
Energy: 0.9390516166463844
Energy: 0.8340895074380373
Energy: 1.047131575649636
Energy: 0.8300619519865351
Energy: 0.8303768448710633
Energy: 0.8300619519852348
Energy: 0.8308022333416667
Energy: 0.8299398598033134
Energy: 0.8310809035865513
Energy: 0.8299398598026634
Energy: 1.0740875629131592
Energy: 0.832041502322243
Energy: 0.8372482936692367
Energy: 0.8320415023254936
Energy: 1.0613022593184558
Energy: 0.8303783228740895
Energy: 0.833054358367952
Energy: 0.8303783228747397
Energy: 0.8308395483847486
Energy: 0.8343710871861737
Energy: 1.0508568825325428
Energy: 0.8343710871836323
Energy: 0.8294330779736143
Energy: 0.8294217838871716
Energy: 1.0552978528767123
Energy: 0.8294217838897722
Energy: 0.8325703051481763
Energy: 0.8354329575554125
Energy: 1.0298919048364328
Energy: 0.8354329575580131
Energy: 0.8312300870621794
Energy: 0.8298769227920031
Energy: 1.0618039935504677
Energy: 0.8298769227926532
Energy: 0.9441292265441433
Energy: 0.831427319682657
Energy: 0.8307638148176926
Energy: 0.8314273196794063
Energy: 0.9451440108546457
Energy: 0.8318884980822798
Energy: 1.036005065660341
Energy: 0.8318884980842303
Energy: 0.939216088717252
Energy: 0.8726123681456677
Energy: 1.0747407215749603
Energy: 0.8726123681443673
Energy: 1.0514980981015705
Energy: 0.8154254336891064
Energy: 0.9235611854512857
Energy: 0.8154254336878061
Energy: 1.0620665288180011
Energy: 0.8135741493045237
Energy: 0.8133863580439621
Energy: 0.8135741493012728
Energy: 0.939392850023789
Energy: 0.8143070975184302
Energy: 0.8177143554605328
Energy: 0.8143070975158295
Energy: 1.0615248233896062
Energy: 0.8148468919220528
Energy: 0.8137411686932863
Energy: 0.814846891927254
Energy: 0.9401410056483134
Energy: 0.8150531452179498
Energy: 1.0579253407891143
Energy: 0.8150531452114486
Energy: 0.9458292967001048
Energy: 0.8756661673076503
Energy: 0.9618267672446199
Energy: 0.8756661673056999
Energy: 0.8442321622768262
Energy: 0.8290327594510849
Energy: 0.9237161860955883
Energy: 0.8290327594497846
Energy: 0.9381306764364441
Energy: 0.8302233601980112
Energy: 1.0645115634468412
Energy: 0.8302233601973611
Energy: 0.8298443569322648
Energy: 0.8300073493209699
Energy: 1.0663438589791159
Energy: 0.8300073493196696
Energy: 0.829270372774808
Energy: 0.829613697811285
Energy: 0.8321509943921929
Energy: 0.829613697811285
Energy: 0.8412626790416529
Energy: 0.8337003962967467
Energy: 1.0749515785376125
Energy: 0.8337003962980468
Energy: 0.8321444970459496
Energy: 0.8539358153353133
Energy: 1.0611459643856762
Energy: 0.8539358153359634
Energy: 1.0530176446874544
Energy: 0.8354240936515832
Energy: 0.8312567879468518
Energy: 0.8354240936522334
Energy: 1.0515092735545113
Energy: 0.830138384866696
Energy: 0.8298371866004284
Energy: 0.8301383848653958
Energy: 1.0331164935032968
Energy: 0.835954286781037
Energy: 0.831578774501447
Energy: 0.835954286781037

minimum gb energy = 0.8126174195055286 eV
minimum distance =  2.23589937536899 Angstroms
sigma value = 89


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

Energy: 1.7160722353164777
Energy: 0.7661878684488993
Energy: 0.959633768190778
Energy: 0.8046137698441292
Energy: 0.918563162700589
Energy: 0.878368866677503
Energy: 0.8219561547331649
Energy: 0.878368866677503
Energy: 0.9078418235323796
Energy: 0.8791871339068161
Energy: 0.8245036255802809
Energy: 0.8791871339051149
Energy: 0.9084602000322389
Energy: 0.8794292537213348
Energy: 0.7550973002438361
Energy: 0.8794292537213348
Energy: 0.8920310781012147
Energy: 0.7524034274813044
Energy: 0.9009276064303013
Energy: 0.7524034274796033
Energy: 0.8908982549265672
Energy: 0.7525364742740694
Energy: 0.9009038047906781
Energy: 0.7525364742723682
Energy: 0.8898728562519497
Energy: 0.7524130419276868
Energy: 0.7570325323351785
Energy: 0.7524130419242846
Energy: 0.8900641733420424
Energy: 0.752673814322331
Energy: 0.7541608223682803
Energy: 0.75267381432063
Energy: 0.8926918166499646
Energy: 0.7535873900085623
Energy: 0.7536822592740097
Energy: 0.7535873900085623
Energy: 0.8922607177107224
Energy: 0.8227140955341808
Energy: 0.7552408494032019
Energy: 0.8227140955341808
Energy: 0.8920723826354626
Energy: 0.8246833906600594
Energy: 0.9380520627614519
Energy: 0.8246833906583584
Energy: 0.9015378914925879
Energy: 0.8224350547327841
Energy: 0.7540501267329586
Energy: 0.8224350547327841
Energy: 0.9007499384207541
Energy: 0.8061002987710382
Energy: 0.8060987174623534
Energy: 0.8061002987727393
Energy: 0.8925088743128484
Energy: 0.8038804156196503
Energy: 0.8045189082914473
Energy: 0.8038804156196503
Energy: 0.9164732978855353
Energy: 0.8059429509004294
Energy: 0.8061521731825032
Energy: 0.8059429509021306

minimum gb energy = 0.7524034274796033 eV
minimum distance =  2.23501038401357 Angstroms
sigma value = 13


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

Energy: 1.3216379006452834
Energy: 0.7151653412422159
Energy: 0.898039702806783
Energy: 0.7243920028873159
Energy: 0.7837646310996078
Energy: 0.7216059155021592
Energy: 0.840670794014298
Energy: 0.7216059155064372
Energy: 0.7245202736121399
Energy: 0.7191549272956536
Energy: 0.8567922310223925
Energy: 0.7191549272928015
Energy: 0.9869669625909249
Energy: 0.719943416741304
Energy: 0.8433125853222755
Energy: 0.719943416741304
Energy: 0.8480009154356378
Energy: 0.7217978708616937
Energy: 0.8401884251406545
Energy: 0.7217978708752406
Energy: 0.8433439453861028
Energy: 0.7204290576082722
Energy: 0.8396245907973178
Energy: 0.7204290576154021
Energy: 0.8429437836933232
Energy: 0.7194550400444922
Energy: 0.8401375527344571
Energy: 0.7194550400352234
Energy: 0.8434080208089886
Energy: 0.7189958013971545
Energy: 0.8552760421438339
Energy: 0.7189958013978676
Energy: 0.7185277620177829
Energy: 0.7272587373124563
Energy: 0.8484686453466544
Energy: 0.7272587373103173
Energy: 0.7185580012120576
Energy: 0.7194851780219739
Energy: 0.8469290919640898
Energy: 0.7194851780141309
Energy: 0.721745148118261
Energy: 0.7201100009262691
Energy: 1.321768183771791
Energy: 0.720110000930547
Energy: 0.8395227384861889
Energy: 0.7607397198996332
Energy: 0.8469782104815279
Energy: 0.7607397198903642
Energy: 0.8423109391473252
Energy: 0.7594728341582369
Energy: 0.8385302269545275
Energy: 0.7594728341511068
Energy: 0.9710881197596802
Energy: 0.7562242886913096
Energy: 0.9865178303709552
Energy: 0.7562242886905967
Energy: 0.85997535960454
Energy: 0.7223332412439327
Energy: 0.970733765294221
Energy: 0.7223332412460717
Energy: 0.8513838556441375
Energy: 0.7205526544840115
Energy: 0.7228666138441298
Energy: 0.7205526544783075
Energy: 0.8406127051743899
Energy: 0.71901109154254
Energy: 0.7220270411964294
Energy: 0.719011091546818
Energy: 0.7259462452292187
Energy: 0.71930223387058
Energy: 0.7217577517197878
Energy: 0.7193022338677281
Energy: 0.9498239201282502
Energy: 0.7191589143960958
Energy: 0.8384613403010938
Energy: 0.7191589144003737
Energy: 0.8455344965720402
Energy: 0.7185316438235535
Energy: 0.8577817725015406
Energy: 0.7185316438321093
Energy: 1.0116477361133562
Energy: 0.7204314689570643
Energy: 0.8397260231294069
Energy: 0.7204314689662685
Energy: 0.8453777568882817
Energy: 0.71872015727822
Energy: 0.8389735578123654
Energy: 0.7187201572718029
Energy: 0.8495417998122902
Energy: 0.7213740567028208
Energy: 0.8412531730883734
Energy: 0.7213740566999688
Energy: 0.7250910438021275
Energy: 0.7181329194245972
Energy: 0.9724078955094148
Energy: 0.7181329194352923
Energy: 0.8407698857247056
Energy: 0.7187750030355905
Energy: 0.8600176525583074
Energy: 0.7187750030348776
Energy: 0.7206591607138068
Energy: 0.7189505317675375
Energy: 0.8457875054045201
Energy: 0.7189505317732415
Energy: 0.7188466295150113
Energy: 0.7188246552730753
Energy: 0.8429429402032598
Energy: 0.7188246552737882
Energy: 0.7189937093105484
Energy: 0.7292063938815226
Energy: 0.728207123597791
Energy: 0.7292063938765316
Energy: 0.8380155369034039
Energy: 0.7190991056382123
Energy: 0.9500971974819152
Energy: 0.7190991056374993
Energy: 0.8560860690254354
Energy: 0.7562526051856275
Energy: 0.8382854040909211
Energy: 0.7562526051884795
Energy: 0.8398834084750081
Energy: 0.7582663015215096
Energy: 1.0119963633329847
Energy: 0.7582663015193707
Energy: 0.8505299994725283
Energy: 0.7202906986519758
Energy: 0.8382320878223152
Energy: 0.7202906986548278
Energy: 0.8546159430201028
Energy: 0.7208998621819986
Energy: 0.718882221562719
Energy: 0.7208998621812857
Energy: 0.9714841820966335
Energy: 0.719491476875831
Energy: 0.7187038049622939
Energy: 0.7194914768694141
Energy: 0.9501453584688899
Energy: 0.720226016468782
Energy: 0.7239264059089073
Energy: 0.7202260164659301

minimum gb energy = 0.7151653412422159 eV
minimum distance =  2.26019467911822 Angstroms
sigma value = 37


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

Energy: 1.1554521539163582
Energy: 0.6574373072185362
Energy: 0.8462769846668213
Energy: 0.6565541666961969
Energy: 0.7729597015994806
Energy: 0.6564814909318389
Energy: 0.8616169651316444
Energy: 0.6564814909318389
Energy: 1.0620372642109064
Energy: 0.6547912798587511
Energy: 0.8657516262981192
Energy: 0.6547912798587511
Energy: 1.061087819036419
Energy: 0.7293341097829281
Energy: 0.8600686401307636
Energy: 0.7293341097841548
Energy: 0.6675165837375128
Energy: 0.7366520811246852
Energy: 0.8639618642247853
Energy: 0.7366520811259119
Energy: 0.8671101219944999
Energy: 0.6555979065524238
Energy: 0.6589960114205078
Energy: 0.6555979065524238
Energy: 0.651796009115135
Energy: 0.6546972267264348
Energy: 0.8628090014231246
Energy: 0.6546972267276616
Energy: 0.665690317300744
Energy: 0.6560919710426969
Energy: 0.8576723272133671
Energy: 0.6560919710414703
Energy: 0.656647353158168
Energy: 0.6558421436048539
Energy: 1.0669468055639582
Energy: 0.6558421436048539
Energy: 0.6550602558718469
Energy: 0.656457982087388
Energy: 0.8605210328377341
Energy: 0.6564579820886146
Energy: 0.846276984664368
Energy: 0.6565541666912903
Energy: 1.1554521539188116
Energy: 0.6574373072148562
Energy: 0.8616169651304177
Energy: 0.6564814909306123
Energy: 1.0608524063664757
Energy: 0.6564814909306123
Energy: 0.8657516262956658
Energy: 0.6547912798599776
Energy: 1.0620372642109064
Energy: 0.6547912798599776
Energy: 0.8600686401283102
Energy: 0.7293341097817014
Energy: 1.0610878190376458
Energy: 0.7293341097817014
Energy: 0.8639618642235587
Energy: 0.7366520811271385
Energy: 0.6675165838723923
Energy: 0.7366520811283652
Energy: 0.6589960114217344
Energy: 0.6555979065548772
Energy: 0.8671101219957266
Energy: 0.6555979065548772
Energy: 0.8628090014280313
Energy: 0.6546972267264348
Energy: 0.651796009118815
Energy: 0.6546972267264348
Energy: 0.8576723272158203
Energy: 0.6560919710414703
Energy: 0.6656903173031974
Energy: 0.6560919710414703
Energy: 1.0669468055639582
Energy: 0.6558421436097606
Energy: 0.6566473531618481
Energy: 0.6558421436073073
Energy: 0.8605210326893613
Energy: 0.6564579820898412
Energy: 0.6550602558743003
Energy: 0.6564579820898412

minimum gb energy = 0.651796009115135 eV
minimum distance =  2.27076775193491 Angstroms
sigma value = 25


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

Energy: 1.3948774204129517
Energy: 0.5947425874614347
Energy: 0.8006506620102043
Energy: 0.5869378046638513
Energy: 1.0080180455486387
Energy: 0.5867779308886936
Energy: 0.7560241724831561
Energy: 0.5867779308896515
Energy: 1.210762776912337
Energy: 0.5854941669637194
Energy: 0.759726731636031
Energy: 0.5854941669627616
Energy: 0.9253105352732244
Energy: 0.5864964095724445
Energy: 0.756579316187173
Energy: 0.5864964095734024
Energy: 0.9402513403865681
Energy: 0.6469565069987655
Energy: 1.0761819198938842
Energy: 0.6469565069997235
Energy: 0.9263320602448061
Energy: 0.6464768002819336
Energy: 1.0705666458215917
Energy: 0.6464768002828915
Energy: 0.9291337346761048
Energy: 0.6476317076303951
Energy: 0.9409568406657324
Energy: 0.6476317076303951
Energy: 0.7561032020730203
Energy: 0.5867874374772367
Energy: 1.0679732775813398
Energy: 0.5867874374734051
Energy: 0.7591399429139399
Energy: 0.5855420650867588
Energy: 1.0692081317883964
Energy: 0.585542065084843
Energy: 0.7623288246345258
Energy: 0.5865965889981981
Energy: 1.0704297348912446
Energy: 0.5865965889972403
Energy: 0.5867323407933102
Energy: 0.5864399691399722
Energy: 1.180147254993525
Energy: 0.5864399691399722
Energy: 0.5926214387944442
Energy: 0.5864783817432716
Energy: 1.0704511935048608
Energy: 0.5864783817442295
Energy: 0.5875057182793634
Energy: 0.5858927962826219
Energy: 0.9297667805925223
Energy: 0.5858927962835797
Energy: 0.5952421572827735
Energy: 0.587958774377884
Energy: 1.2057177626983493
Energy: 0.5879587743759682
Energy: 0.7603871152833587
Energy: 0.5853570877867689
Energy: 1.072104034751692
Energy: 0.5853570877848531
Energy: 0.7561258101468181
Energy: 0.5869316281452507
Energy: 1.2134126625330244
Energy: 0.5869316281442929
Energy: 0.941295792158943
Energy: 0.5852526812128134
Energy: 1.2065463339547335
Energy: 0.5852526812137713
Energy: 0.7593920758584174
Energy: 0.6503002936463348
Energy: 0.940966245221298
Energy: 0.6503002936492084
Energy: 1.0695135865151677
Energy: 0.6474476140158658
Energy: 0.9290313285622276
Energy: 0.6474476140168238
Energy: 1.070671470699301
Energy: 0.6463604574080946
Energy: 0.9264734854215877
Energy: 0.6463604574061788
Energy: 1.0681335182545155
Energy: 0.588153189515501
Energy: 0.7561770855766734
Energy: 0.5881531895145431
Energy: 1.0707168635123834
Energy: 0.5848222306048658
Energy: 0.5862443141357538
Energy: 0.5848222306048658
Energy: 1.067938964478587
Energy: 0.5856680965399538
Energy: 0.7560801964655005
Energy: 0.5856680965389959
Energy: 1.0683355852290553
Energy: 0.5880894856518095
Energy: 0.586186809499398
Energy: 0.5880894856518095
Energy: 1.072291406419606
Energy: 0.5854842460879819
Energy: 0.5860443479530333
Energy: 0.5854842460879819
Energy: 1.21211692563417
Energy: 0.5871333207532358
Energy: 0.5917815783336946
Energy: 0.5871333207541936

minimum gb energy = 0.5848222306048658 eV
minimum distance =  2.27270529545676 Angstroms
sigma value = 41


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

Energy: 1.2774266952363227
Energy: 0.5462853465479754
Energy: 0.7698842514856244
Energy: 0.5411167303556631
Energy: 1.1298808891002263
Energy: 0.5400590355064643
Energy: 0.6864556459657117
Energy: 0.5400590355025379
Energy: 1.2518958239169429
Energy: 0.539175867728462
Energy: 0.6871327338816208
Energy: 0.5391758677339592
Energy: 1.1288953505333026
Energy: 0.540884532823396
Energy: 0.8246497974628625
Energy: 0.5408845328218255
Energy: 1.0827714174978635
Energy: 0.5378441406039846
Energy: 0.9543380326821915
Energy: 0.5378441406094816
Energy: 1.1322416442652816
Energy: 0.7205722319710103
Energy: 0.9501475010710985
Energy: 0.7205722319702251
Energy: 1.1372621635580271
Energy: 0.5905372942397323
Energy: 1.0406246503772223
Energy: 0.5905372942475855
Energy: 0.9525200273771868
Energy: 0.5905183999758815
Energy: 1.0163086594544175
Energy: 0.5905183999719549
Energy: 0.8862315378446214
Energy: 0.5392070540184009
Energy: 1.192045789578008
Energy: 0.5392070540121542
Energy: 0.8850683493709472
Energy: 0.5357826983148688
Energy: 1.069344836973944
Energy: 0.5357826983132983
Energy: 0.6707668192695194
Energy: 0.5346714068911486
Energy: 1.246612922190226
Energy: 0.5346714068825102
Energy: 0.6801898280495275
Energy: 0.5363008107411681
Energy: 1.0692744051890657
Energy: 0.5363008107427387
Energy: 0.6712897199799444
Energy: 0.5328178967369325
Energy: 1.131415099397228
Energy: 0.532817896733006
Energy: 0.6096871207533494
Energy: 0.5363257092391397
Energy: 1.2467039314485215
Energy: 0.5363257092336426
Energy: 0.614013248633759
Energy: 0.5364648807862257
Energy: 1.304284841314546
Energy: 0.5364648807846549
Energy: 0.607863360296105
Energy: 0.5360630836566119
Energy: 1.3117402535655014
Energy: 0.5360630836589678
Energy: 0.7592305884796791
Energy: 0.5336702654478997
Energy: 1.3022292503129165
Energy: 0.5336702654518263
Energy: 0.7542309224884908
Energy: 0.5326812721720285
Energy: 1.0752891653565
Energy: 0.5326812721673169
Energy: 0.7560185565205699
Energy: 0.5355948130071521
Energy: 1.1353784155915347
Energy: 0.5355948130063667
Energy: 0.940494159653741
Energy: 0.5339979685151975
Energy: 1.1333356504964642
Energy: 0.5339979685190884
Energy: 0.9542324756945764
Energy: 0.536501554663977
Energy: 1.0725869428815837
Energy: 0.5365015546702594
Energy: 0.9409709696007383
Energy: 0.5846258381343357
Energy: 1.1390135138450936
Energy: 0.5846258381445445
Energy: 1.1958585403576973
Energy: 0.5864897134585275
Energy: 1.1302028270236182
Energy: 0.5864897134663805
Energy: 1.0152325448481125
Energy: 0.5917660131296718
Energy: 0.9535050081766703
Energy: 0.5917660131320277
Energy: 1.1948593573249473
Energy: 0.5409363170047141
Energy: 0.8916335540995372
Energy: 0.5409363170007875
Energy: 1.2532111648065212
Energy: 0.5393294463247446
Energy: 0.9506866759784237
Energy: 0.539329446323174
Energy: 1.2466334553604972
Energy: 0.5394978401121491
Energy: 0.6852472996018998
Energy: 0.5394978401097932
Energy: 1.0815307461540953
Energy: 0.5383135646323138
Energy: 0.6856695454830166
Energy: 0.5383135646268168
Energy: 1.2464916278232527
Energy: 0.538868791441253
Energy: 0.6895055397941225
Energy: 0.5388687914443943
Energy: 1.253128677372404
Energy: 0.5420867296917179
Energy: 0.5467305669556211
Energy: 0.5420867296846501
Energy: 1.083237302872122
Energy: 0.5385378774856054
Energy: 0.5396584879911996
Energy: 0.5385378774824999
Energy: 1.2495808613763815
Energy: 0.5420945948276665
Energy: 0.5462419455743115
Energy: 0.5420945948331638

minimum gb energy = 0.5326812721673169 eV
minimum distance =  2.26566384321917 Angstroms
sigma value = 15


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

Energy: 1.3366185464793519
Energy: 0.5072671865253111
Energy: 0.7344719851005107
Energy: 0.49582104101362706
Energy: 1.2231148984093547
Energy: 0.49506176981050326
Energy: 0.6167909415311327
Energy: 0.49506176980983807
Energy: 1.3783948459060045
Energy: 0.49389792852418224
Energy: 0.6221735316894271
Energy: 0.49389792852351694
Energy: 1.179980691443811
Energy: 0.4947548322843774
Energy: 0.8601595711273703
Energy: 0.49475483228304684
Energy: 1.1752795587106217
Energy: 0.49233362677994863
Energy: 0.8510091477525341
Energy: 0.4923336267812792
Energy: 1.1720441228714984
Energy: 0.4929132939426114
Energy: 0.8495370228386483
Energy: 0.49291329389936933
Energy: 0.9594969430059465
Energy: 0.4951248865264473
Energy: 1.0668983284351563
Energy: 0.4951248864167395
Energy: 1.0722266862348064
Energy: 0.5371116332800279
Energy: 0.8527918763781052
Energy: 0.5371116332494862
Energy: 0.957603594024757
Energy: 0.5364429570164968
Energy: 1.0631348671787575
Energy: 0.5364429559851587
Energy: 0.9559610358603077
Energy: 0.6649289743058465
Energy: 1.2718213715830362
Energy: 0.6649289743045159
Energy: 0.8593007510644934
Energy: 0.49659570777108425
Energy: 1.074830983923135
Energy: 0.49659570777307993
Energy: 0.7405244160007892
Energy: 0.49241818433950585
Energy: 1.2713920654666433
Energy: 0.4924181843401711
Energy: 0.8505539570612162
Energy: 0.492567479286629
Energy: 1.273777273479235
Energy: 0.4925674792846332
Energy: 0.6258126173526944
Energy: 0.49412121795422803
Energy: 1.0700810185152319
Energy: 0.49412121795289754
Energy: 0.6185753572104457
Energy: 0.4926944186196219
Energy: 1.1773506658453778
Energy: 0.4926944186189566
Energy: 0.6224185059081562
Energy: 0.49398794157169446
Energy: 1.2765966548264658
Energy: 0.4939879415836691
Energy: 0.4998744904997067
Energy: 0.49562575295137873
Energy: 1.280266300090773
Energy: 0.4956257529500482
Energy: 0.4937827959695944
Energy: 0.4932618652101214
Energy: 1.1764729123002402
Energy: 0.49326186520879084
Energy: 0.4952574631561708
Energy: 0.4950080335684528
Energy: 1.1769083088968857
Energy: 0.4950080335671223
Energy: 0.6246216745006891
Energy: 0.49616104213138196
Energy: 1.3813207847452866
Energy: 0.49616104213138196
Energy: 0.6208516080647907
Energy: 0.49300309712916784
Energy: 1.177104325041599
Energy: 0.49300309712916784
Energy: 0.6255485331721046
Energy: 0.49633176808718127
Energy: 1.1798496845977924
Energy: 0.49633176808252444
Energy: 0.8507943005193017
Energy: 0.49328561223520084
Energy: 1.170294485289247
Energy: 0.4932856122371966
Energy: 0.8527378810806375
Energy: 0.49275651587730096
Energy: 1.2727895585180453
Energy: 0.4927565158746399
Energy: 0.8578984879478313
Energy: 0.4948423294038321
Energy: 0.9655761352307113
Energy: 0.494842329402562
Energy: 1.0648277402931907
Energy: 0.6647041246808856
Energy: 1.1806618524479477
Energy: 0.6647041246795551
Energy: 0.8500238773862174
Energy: 0.5361508362641165
Energy: 1.064055543509944
Energy: 0.5361508362554681
Energy: 1.071512049976239
Energy: 0.5366738667999569
Energy: 0.96440266151222
Energy: 0.5366738667966305
Energy: 1.0675558217107701
Energy: 0.4930006782450537
Energy: 1.0666271611273939
Energy: 0.49300067829428307
Energy: 1.0652900035662438
Energy: 0.4929227630140954
Energy: 0.8506911206767729
Energy: 0.49292276307124755
Energy: 1.1756947204773418
Energy: 0.49215591662077035
Energy: 0.7408414272482596
Energy: 0.4921559166181093
Energy: 1.0710243687496597
Energy: 0.4962507786497554
Energy: 0.8595125628561588
Energy: 0.4962507786490902
Energy: 1.2749378593442109
Energy: 0.4936785493457224
Energy: 0.6211749899631775
Energy: 0.4936785493457224
Energy: 1.2718386424289225
Energy: 0.49402079766042056
Energy: 0.6195305081089123
Energy: 0.49402079766108575
Energy: 1.26962261091582
Energy: 0.49695403468232047
Energy: 0.4979825315061073
Energy: 0.4969540346803246
Energy: 1.2722514803155351
Energy: 0.49397467613489504
Energy: 0.49442897441449996
Energy: 0.4939746761375561
Energy: 1.375670557154337
Energy: 0.4934404622684066
Energy: 0.49652443077506286
Energy: 0.4934404622723981

minimum gb energy = 0.4921559166181093 eV
minimum distance =  2.2787405296958 Angstroms
sigma value = 85


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

Energy: 1.2620270546350378
Energy: 0.44978045700738434
Energy: 0.446082978489862
Energy: 0.4456459298408875
Energy: 1.2762570756545175
Energy: 0.4453333872375957
Energy: 0.5532121325204227
Energy: 0.4453333872375957
Energy: 1.2304107338107364
Energy: 0.44474589146915006
Energy: 0.5578789922604022
Energy: 0.4447458914679961
Energy: 1.0403373964329783
Energy: 0.4448152785347533
Energy: 0.7578663176166556
Energy: 0.444815278537612
Energy: 1.235033872094211
Energy: 0.4434369372905821
Energy: 0.7584170705649794
Energy: 0.4434369372542584
Energy: 1.0421173389144565
Energy: 0.4439122458443183
Energy: 0.7597529868688815
Energy: 0.44391224584547234
Energy: 1.0407809422107173
Energy: 0.4440694490092327
Energy: 0.9483432800304117
Energy: 0.44406944900865575
Energy: 1.1371360841148548
Energy: 0.4435545174781148
Energy: 0.7594994656605535
Energy: 0.44355451747638386
Energy: 1.045437132243024
Energy: 0.6176552790673753
Energy: 0.9492173064439727
Energy: 0.6176552790662214
Energy: 1.0448749428475461
Energy: 0.5185080794596495
Energy: 1.1363507848229886
Energy: 0.5185080794613804
Energy: 0.9483108251203903
Energy: 0.518843026109824
Energy: 0.9472334506416961
Energy: 0.518843026109247
Energy: 0.8556585382973251
Energy: 0.44409612441812596
Energy: 1.1370246316251074
Energy: 0.444096124416972
Energy: 0.9478481955648517
Energy: 0.4436032971494082
Energy: 1.136722615171723
Energy: 0.4436032971459463
Energy: 0.7576848520967187
Energy: 0.4437155476339524
Energy: 0.9461604028937431
Energy: 0.4437155476322215
Energy: 0.6627243823538326
Energy: 0.4436786869717904
Energy: 1.3178999320723233
Energy: 0.44367868697121343
Energy: 0.7578871156417529
Energy: 0.4437268136559322
Energy: 1.1376187212821494
Energy: 0.4437268136588171
Energy: 0.5535995092816506
Energy: 0.44532768186782884
Energy: 1.135251215499035
Energy: 0.44532768186955984
Energy: 0.5539376373228971
Energy: 0.4438243107817836
Energy: 1.2343471339752496
Energy: 0.44382431077947565
Energy: 0.5542066222033735
Energy: 0.4475520131854165
Energy: 1.3162322094040597
Energy: 0.44755201318483945
Energy: 0.44393875990920306
Energy: 0.4453862237082622
Energy: 1.3159587000544861
Energy: 0.4453862237076852
Energy: 0.44508516305008794
Energy: 0.44408476713024386
Energy: 1.2337754996151573
Energy: 0.4440847671337058
Energy: 0.44399895105536885
Energy: 0.4449668232570256
Energy: 1.2274559530368678
Energy: 0.4449668232564486
Energy: 0.5528671275459816
Energy: 0.4456620350761809
Energy: 1.2294669051382663
Energy: 0.445662035075604
Energy: 0.5537479605585554
Energy: 0.4436319518817056
Energy: 1.3193308493487146
Energy: 0.44363195188112864
Energy: 0.5543386163964431
Energy: 0.4456001974854638
Energy: 1.0402943748852418
Energy: 0.4456001974871948
Energy: 0.7584680652103709
Energy: 0.44393125790878873
Energy: 1.4107416761299223
Energy: 0.44393125790994276
Energy: 0.7578424710115178
Energy: 0.44359815532969166
Energy: 1.2300103348264135
Energy: 0.4435981553279607
Energy: 0.8732464194399707
Energy: 0.4439301138477406
Energy: 1.041099770052906
Energy: 0.4439301138483176
Energy: 0.9505587504914537
Energy: 0.44354358733509114
Energy: 1.2351405867327048
Energy: 0.4435435873368221
Energy: 0.9485155527683098
Energy: 0.44467362565753554
Energy: 1.0423234368605838
Energy: 0.44467362565695856
Energy: 1.140180783390389
Energy: 0.5195126744038002
Energy: 0.853638967226766
Energy: 0.5195126744061082
Energy: 0.9470162526433511
Energy: 0.5193081251427685
Energy: 1.0534856975660478
Energy: 0.5193081251456535
Energy: 1.137547622006262
Energy: 0.4444810040721076
Energy: 0.8514100334375293
Energy: 0.4444810040732615
Energy: 1.2359431436217612
Energy: 0.4433904093176115
Energy: 0.8521416527330548
Energy: 0.4433904093458837
Energy: 0.9458878977488792
Energy: 0.44390415616417744
Energy: 0.7576468107738076
Energy: 0.4439041561687933
Energy: 1.3202503764389322
Energy: 0.4435614078381035
Energy: 0.7581339386736206
Energy: 0.44356140783348763
Energy: 1.3196819006443745
Energy: 0.4440073970605761
Energy: 0.7583894566474781
Energy: 0.4440073970605761
Energy: 1.1351562385910492
Energy: 0.445038810639777
Energy: 0.5545535431938537
Energy: 0.44503881063920003
Energy: 1.2354648775006964
Energy: 0.4436140407327595
Energy: 0.5535476717496199
Energy: 0.4436140407327595
Energy: 1.3157243136316132
Energy: 0.44779313173683205
Energy: 0.5528924642132459
Energy: 0.44779313173683205
Energy: 1.1346911601941472
Energy: 0.4456859560225968
Energy: 0.4450197906349414
Energy: 0.4456859560225968
Energy: 1.2345600352298016
Energy: 0.4440294758120282
Energy: 0.44450596734897624
Energy: 0.44402947581260516
Energy: 1.227491710668075
Energy: 0.446769217954389
Energy: 0.4449641160002246
Energy: 0.446769217954966

minimum gb energy = 0.4433904093176115 eV
minimum distance =  2.27560076303654 Angstroms
sigma value = 113


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

Energy: 0.015447714550027802
Energy: 0.016082511696884343
Energy: 1.0733094276937303
Energy: 0.37390067481746797
Energy: 0.01621781883867834
Energy: 0.10272097174205849
Energy: 0.8003232079797195
Energy: 0.10272097174205849
Energy: 0.016047603142314664
Energy: 0.1021580623475593
Energy: 0.7981567739198322
Energy: 0.1021580623466968
Energy: 0.017311412882042715
Energy: 0.10495503590804232
Energy: 0.7994357393681641
Energy: 0.10495503590631738
Energy: 0.7994882954675883
Energy: 0.10377284999065689
Energy: 0.7995571409223337
Energy: 0.10377284998935087
Energy: 0.015817670956255286
Energy: 0.10178342791093473
Energy: 0.7982747559386275
Energy: 0.10178342791049119

minimum gb energy = 0.015447714550027802 eV
minimum distance =  2.52140889150065 Angstroms
sigma value = 1