Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_CuTa__MO_547744193826_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.614939033985138
cohesive_energy=3.540272685207228
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.450365591398598e-19, 2.16695991925134e-19, 2.71525680693882e-19, 3.14808482461392e-19, 3.51467886023946e-19, 3.83899145449374e-19, 4.1237783511872395e-19, 4.37003289983304e-19, 4.581792585548819e-19, 4.76387996000292e-19, 4.92047670421008e-19, 5.055043519699739e-19, 5.170448302646759e-19, 5.269174426833839e-19, 5.35341687424956e-19, 5.42508223508838e-19, 5.48578870775064e-19, 5.536802011777199e-19, 5.57905140961578e-19, 5.61303357602292e-19, 5.63905292455908e-19, 5.65734978171936e-19, 5.66816447399886e-19, 5.671689262593659e-19, 5.667892103971079e-19, 5.6557636268517e-19, 5.63432650348878e-19, 5.602635449668259e-19, 5.55702148089828e-19, 5.49405593918208e-19, 5.410502427718979e-19, 5.30278809261516e-19, 5.16690749228562e-19, 4.99821431449176e-19, 4.791277180444319e-19, 4.5393669482804995e-19, 4.233751755345e-19, 3.86233516805112e-19, 3.4081661576111397e-19, 2.84809327166376e-19, 2.1518193500600397e-19, 1.280743151157018e-19, 1.84251915086634e-20, -1.210646321242884e-19, -3.0212084569674597e-19, -5.43475938195774e-19, -8.7161613242868e-19, -1.3222699673336639e-18, -1.94970476768094e-18, -2.84645905149708e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01672237872400468
Energy: 0.01788768624095125
Energy: 0.26394141642321156
Energy: 0.6597562989224937
Energy: 0.6588398544122758
Energy: 0.22563654754466703
Energy: 0.01783968154059531
Energy: 0.01737611483383334
Energy: 0.5544597065344851
Energy: 0.1737970781264962
Energy: 0.2640568911025761
Energy: 0.5272588585339917
Energy: 0.018031825826217526
Energy: 0.08423359224487952
Energy: 0.017350373591045094
Energy: 0.5558684799299406
Energy: 0.18724944416758058
Energy: 0.2641348070391246
Energy: 0.5632754249276476
Energy: 0.0833605231874813
Energy: 0.08431806449653052
Energy: 0.019140522737403607
Energy: 0.5271826744291307
Energy: 0.264457322230966
Energy: 0.6584221156238464
Energy: 0.5551063233589364
Energy: 0.08363528883374477
Energy: 0.017797149711320483
Energy: 0.08403837865672424
Energy: 0.6619271228089552
Energy: 0.1741002899765088
Energy: 0.2644441512723041
Energy: 0.5271569083293026
Energy: 0.017647307758559147
Energy: 0.0837477500967358
Energy: 0.017101815357290964
Energy: 0.5563015291635371
Energy: 0.26803160542622134
Energy: 0.26435172327661727
Energy: 0.5645323739426948
Energy: 0.08325090146708627
Energy: 0.08429015752199201

minimum gb energy = 0.01672237872400468 eV
minimum distance =  2.53376174722248 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 0.965620873592312
Energy: 0.7846671406408462
Energy: 0.921575055243844
Energy: 0.8564394035946495
Energy: 0.8778131645182531
Energy: 0.889501491655213
Energy: 0.8084606017794301
Energy: 0.7838384147352968
Energy: 0.8410263033794664
Energy: 0.7799273842447739
Energy: 0.8373025409693176
Energy: 0.7992264145447787
Energy: 0.7942955386289402
Energy: 0.8554897154790911
Energy: 0.8117602987737653
Energy: 0.8741255970180767
Energy: 0.8867322367665552
Energy: 0.8662135586656247
Energy: 0.8406111069158019
Energy: 0.8472762701369015
Energy: 0.8783144803903908
Energy: 0.7961917509648125
Energy: 0.8584504130077152
Energy: 0.7945405322051133
Energy: 0.8658899234412839
Energy: 0.8295365329141928
Energy: 0.7829750310781095
Energy: 0.8391531944508598
Energy: 0.8912833291524631
Energy: 0.8194693726140387
Energy: 0.8150831209998111
Energy: 0.8273597840485224
Energy: 0.8733274614963237
Energy: 0.8387514526114997
Energy: 0.8981492327107168
Energy: 0.8294098110712066
Energy: 0.8572491796877314
Energy: 0.7830420688812548
Energy: 0.8146562674795246
Energy: 0.7946541092994778
Energy: 0.849198753265829
Energy: 0.8781227227766837
Energy: 0.8194302093250163
Energy: 0.8515962161686862
Energy: 0.8057562839867678
Energy: 0.8469474908540516
Energy: 0.8429455652436174
Energy: 0.8361195092002858
Energy: 0.8427694018261463
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Energy: 0.8513153710161688
Energy: 0.8647687066562678
Energy: 0.8696206061545542
Energy: 0.8566221009496675
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Energy: 0.795784584793044
Energy: 0.8414823879946958
Energy: 0.87041603682764
Energy: 0.8131385290771416
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Energy: 0.7975662361192974
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Energy: 0.8800534621928218
Energy: 0.8399905372020061
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Energy: 0.909761123902374
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Energy: 0.8334721410390588
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Energy: 0.8760098262657066
Energy: 0.7905471869365427
Energy: 0.8491625155127256
Energy: 0.787949157469202
Energy: 0.796916713739689
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Energy: 0.8233199296985058
Energy: 0.8170400476030429
Energy: 0.9350476959582473
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Energy: 0.8133953806158932
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Energy: 0.8248860539185221
Energy: 0.846209711904974
Energy: 0.8260940730798308
Energy: 0.8576930994240601
Energy: 0.8921520470952565
Energy: 0.8121543248395896
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Energy: 0.8483090794989597
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Energy: 0.7815688436968296
Energy: 0.8403211490248965
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Energy: 0.8331396099567505
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Energy: 0.7776511686778396
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Energy: 0.7789300831884438
Energy: 0.7843733888697856
Energy: 0.8219940373244814
Energy: 0.8713396375683354
Energy: 0.8093827823351554
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Energy: 0.7787496479452862
Energy: 0.8765962788984866
Energy: 0.8794859212647673
Energy: 0.8711421191339245
Energy: 0.834028350468823
Energy: 0.8070732197174388
Energy: 0.8731442537059292
Energy: 0.8278386168606808
Energy: 0.860353689539462
Energy: 0.8143172311307818
Energy: 0.8967113307728893
Energy: 0.8821346768553323
Energy: 0.7791687973429455
Energy: 0.8679346261320496
Energy: 0.8466729988349879
Energy: 0.8371061639790768
Energy: 0.8917651398831901
Energy: 0.8193581977592796
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Energy: 0.8963631141445813
Energy: 0.8552780064947857
Energy: 0.8525785642597182
Energy: 0.839437566465274
Energy: 0.8773275126758922
Energy: 0.8118706092881649
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Energy: 0.7977450079413955
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Energy: 0.8664713793280547
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Energy: 0.849631731407094
Energy: 0.7947947064775241
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Energy: 0.8724945277330193
Energy: 0.8034468346708421
Energy: 0.8222318280042419
Energy: 0.8184906516668639
Energy: 0.8087320337294794
Energy: 0.8375698280765709
Energy: 0.8538004245932138
Energy: 0.8786103900142812
Energy: 0.8541889451642504
Energy: 0.9140209680948156
Energy: 0.8582544635873556
Energy: 0.8563334009125776
Energy: 0.8747128606609883
Energy: 0.8404064782553898
Energy: 0.8435127765331027
Energy: 0.8474408119153114
Energy: 0.8596884712311471
Energy: 0.8644464511988282
Energy: 0.9495808348738144
Energy: 0.8628065115620555
Energy: 0.8279312754940189
Energy: 0.8209229682904308
Energy: 0.8301139784199084
Energy: 0.8937315567334917
Energy: 0.866398645208049
Energy: 0.8154078064207795
Energy: 0.8471593976493064
Energy: 0.7810319340794679
Energy: 0.8169637953376595
Energy: 0.7976040273615291
Energy: 0.7951949566214522
Energy: 0.8499941380775818
Energy: 0.8421988901116658
Energy: 0.7948113774406218
Energy: 0.8312642503725378
Energy: 0.9023146420322714
Energy: 0.8817245279728787
Energy: 0.8350748503170379
Energy: 0.8479043413445643
Energy: 0.8054563621042401
Energy: 0.8861596555068367
Energy: 0.7806013270627803
Energy: 0.8412789787783088
Energy: 0.8137529794276338
Energy: 0.8081690375644255
Energy: 0.83713611209654
Energy: 1.027877057040196
Energy: 0.8037164463736189
Energy: 0.8312241359517563
Energy: 0.8856431174302455
Energy: 0.8504285636113496
Energy: 0.8637699644343781
Energy: 0.835586090974926
Energy: 0.8062996626758865
Energy: 0.8428575469001631
Energy: 0.7918310923524633
Energy: 0.844632596092318
Energy: 0.7858582277535358
Energy: 0.7810266908808975
Energy: 0.8204397393028704
Energy: 0.7975330651010694
Energy: 0.8334089179983856
Energy: 0.8686759505306979
Energy: 0.8636305791100534
Energy: 0.8798097079668257
Energy: 0.8696066457139142
Energy: 0.8507627532949597

minimum gb energy = 0.7776511686778396 eV
minimum distance =  2.30604820211251 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 0.9769098206858098
Energy: 0.8406860443391198
Energy: 0.8260397413631833
Energy: 0.8220217058687561
Energy: 0.8575781417865439
Energy: 0.8521366066637255
Energy: 0.8492935606326365
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Energy: 0.8106064030334588
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Energy: 0.8170665981280738
Energy: 0.8234589168696429
Energy: 0.8588182687392386
Energy: 0.8745855477938189
Energy: 0.8753848057539345
Energy: 0.8094523506699947
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Energy: 0.8000719977254968
Energy: 0.7936754292622242
Energy: 0.8360828128552278
Energy: 0.8171166559907397
Energy: 0.8398220483908767
Energy: 0.9070700085945629
Energy: 0.8454764247364155
Energy: 0.7944659566470001
Energy: 0.825463271573491
Energy: 0.8057073043745177
Energy: 0.8050508948118704
Energy: 0.8522844535712197
Energy: 0.9151755863697973
Energy: 0.8281882532038809
Energy: 0.8051541085427487
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Energy: 0.8351027071103958
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Energy: 0.7954397493523785
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Energy: 0.8035086577498368
Energy: 0.7974543539945741
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Energy: 0.865148362369994
Energy: 0.8033113649806148
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Energy: 0.8496588843548033
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Energy: 0.8577235610945544
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Energy: 0.8091734132962624
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Energy: 0.8406278656636069
Energy: 0.876932549483542
Energy: 0.9156425329308484
Energy: 0.8571913930787153
Energy: 0.8076419325847838
Energy: 0.8171824474292501
Energy: 0.8007433501799114
Energy: 0.8171239945067664
Energy: 0.8847831840779513
Energy: 0.8215225403557233
Energy: 0.8322721961545397
Energy: 0.8060533372664281
Energy: 0.8145823093960741
Energy: 0.7998168653357015
Energy: 0.8207633985875008
Energy: 0.8617079688161144
Energy: 0.8766010029691763
Energy: 0.880404736153016
Energy: 0.8045851133477122
Energy: 0.812574108044692
Energy: 0.7998265369598866
Energy: 0.9846914871275233
Energy: 0.8779806987999289
Energy: 0.7985956910180205
Energy: 0.8314689493710885
Energy: 0.817229455286493
Energy: 0.8137767645959345
Energy: 0.8230314103575309
Energy: 0.9079667540342627
Energy: 0.8558398760332119
Energy: 0.8166819853216859
Energy: 0.8471633136241721
Energy: 0.8054067705731891
Energy: 0.8483587155904767
Energy: 0.7958823886367993
Energy: 0.8062737840105001
Energy: 0.7937947519095135
Energy: 0.7972957091817957
Energy: 0.8069268555126312
Energy: 0.8392793329326285
Energy: 0.8169580700392591
Energy: 0.799520206301862
Energy: 0.8706796149822037
Energy: 0.8027331683726305
Energy: 0.7995658963558453
Energy: 0.8097525808083494
Energy: 0.8373507207836229
Energy: 0.8193391081238376
Energy: 0.8480277636939674
Energy: 0.8564036285811741
Energy: 0.8026904530480969
Energy: 0.8117400994021029
Energy: 0.8094914149247816
Energy: 0.8172491068363386
Energy: 0.8100809052818774
Energy: 0.8133290319864981
Energy: 0.9022723607668681
Energy: 0.8102943571932637
Energy: 1.0359893675006355
Energy: 0.8877005257075505
Energy: 0.7951621478045524
Energy: 0.8343759924134354
Energy: 0.8119705347265718
Energy: 0.8294509793042714
Energy: 0.8746670865879509
Energy: 0.8093092608908901
Energy: 0.84043652119631
Energy: 0.8094068767479379
Energy: 0.8136508002980147
Energy: 0.8221660553891681
Energy: 0.8077711666691265
Energy: 0.8748882148222967
Energy: 0.9458077263339486
Energy: 0.8188128053759681
Energy: 0.8124470639400826
Energy: 0.8339820230886862
Energy: 0.8025428691793127
Energy: 0.8142097095901609
Energy: 0.9737388922707076
Energy: 0.8206547298677269
Energy: 0.8207516141757883
Energy: 0.8014829931010565
Energy: 0.8194030531214523
Energy: 0.8236920460298137
Energy: 0.8013776124847879
Energy: 0.884625925312476
Energy: 0.8464312430755291
Energy: 0.9035977243065817
Energy: 0.7956000963173081
Energy: 0.8314033217973966
Energy: 0.8072820094248715
Energy: 0.846486472715923
Energy: 0.8782399958913552
Energy: 0.8521364204434948
Energy: 0.82411472713414
Energy: 0.8091081986163411
Energy: 0.7999685738676948
Energy: 0.8079161795302755
Energy: 0.8657335120486177
Energy: 0.8324498775351251
Energy: 0.8007298393892882
Energy: 0.8319313419585277
Energy: 0.8113983304887423
Energy: 0.8461322040896878
Energy: 0.8236986609670774
Energy: 0.8231302559109239
Energy: 0.8375446908711757
Energy: 0.8087704464026537
Energy: 0.8104938801603075
Energy: 0.8266221777514924
Energy: 0.7957950370566984
Energy: 0.8180117811412553
Energy: 0.8892227553597938
Energy: 0.8257316865521307

minimum gb energy = 0.7934388247931187 eV
minimum distance =  2.2738156626425 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 0.8524851216656244
Energy: 0.8076953982072164
Energy: 0.8597536744955141
Energy: 0.8102638154595984
Energy: 0.8189124129969831
Energy: 0.8280753928597031
Energy: 0.8544553256984775
Energy: 0.8224398275949248
Energy: 0.8394948530099196
Energy: 0.8298677267106952
Energy: 0.8366095300933604
Energy: 0.839878251900954
Energy: 0.8136849213873053
Energy: 0.8637954087383753
Energy: 0.8251709105036932
Energy: 0.8298817929328424
Energy: 0.8451049326314802
Energy: 0.8684370573246422
Energy: 0.8349440420525595
Energy: 0.8067280350215343
Energy: 0.826097918525022
Energy: 0.8202054582015722
Energy: 0.8387112601221964
Energy: 0.8388314537236504
Energy: 0.8390876606259443
Energy: 0.8688834597171969
Energy: 0.8037782316371921
Energy: 0.8877463038288331
Energy: 0.8436645152078209
Energy: 0.8046990365110623
Energy: 0.8170116264784569
Energy: 0.8165010595489841
Energy: 0.8509236520116126
Energy: 0.8287362569128138
Energy: 0.8603068243970615
Energy: 0.8265166773712674
Energy: 0.815384822450344
Energy: 0.8157674189412297
Energy: 0.8214609934173084
Energy: 0.83841297833643
Energy: 0.8131729896086105
Energy: 0.8298230706113079
Energy: 0.8674076115105468
Energy: 0.8931000711794099
Energy: 0.8729901361378996
Energy: 0.8070555796635313
Energy: 0.8218472525858893
Energy: 0.8656313224797618
Energy: 0.8791865788698418
Energy: 0.8341055057100619
Energy: 0.8481517561267822
Energy: 0.8337866843642764
Energy: 0.8206490081336909
Energy: 0.8571602301260737
Energy: 0.8263310527982645
Energy: 0.8201971247528859
Energy: 0.8357651317186947
Energy: 0.8154642091167075
Energy: 0.8345297081971288
Energy: 0.8215512375789872
Energy: 0.8743633248342778
Energy: 0.8157430207919438
Energy: 0.8273035824892946
Energy: 0.8397896763674025
Energy: 0.8679659722564019
Energy: 0.8147207151790243
Energy: 0.8108291483710823
Energy: 0.8571560475892794
Energy: 0.8237952859533754
Energy: 0.8260451108877807
Energy: 0.8398616082317063
Energy: 0.8132306736202185
Energy: 0.8427620365312863
Energy: 0.8349978654685937
Energy: 0.8294770689472871
Energy: 0.8296366938820641
Energy: 0.8466299539541301
Energy: 0.8129771336581731
Energy: 0.8117656200075943
Energy: 0.8294980292338282
Energy: 0.8119439750001447
Energy: 0.8341905383321908
Energy: 0.8185081520965901
Energy: 0.8401366761006198
Energy: 0.8213517041997276
Energy: 0.858745383840003
Energy: 0.8592390913388804
Energy: 0.8265179612711123
Energy: 0.8851539150241196
Energy: 0.8299501864233315
Energy: 0.8542666537155438
Energy: 0.8469019513829724
Energy: 0.8487155851141724
Energy: 0.8445963751806318
Energy: 0.8903393274733554
Energy: 0.8210213309587007
Energy: 0.8757037091623079
Energy: 0.8951620109305235
Energy: 0.835628404937165
Energy: 0.8080471364992737
Energy: 0.8367147793843117
Energy: 0.8101849207776212
Energy: 0.8420647302163968
Energy: 0.8290313133072568
Energy: 0.8333869924041019
Energy: 0.8212507452621688
Energy: 0.895147653191977
Energy: 0.8257049588002122
Energy: 0.8086055937342177
Energy: 0.8474825048819401
Energy: 0.7898080184528161
Energy: 0.8414035163992553
Energy: 0.8517187582746946
Energy: 0.8113376084161064
Energy: 0.8639901659579077
Energy: 0.8314790456729771
Energy: 0.8380307510608676
Energy: 0.8427426394692655
Energy: 0.8362337284067975
Energy: 0.8203148416452329
Energy: 0.8786637422742374
Energy: 0.8449448904713589
Energy: 0.8132244746694354
Energy: 0.8208734361859805
Energy: 0.8140550221239495
Energy: 0.8728516838780933
Energy: 0.8582418390739714
Energy: 0.8438330163146496
Energy: 0.8346336952880669
Energy: 0.8533182872410788
Energy: 0.8211004024819096
Energy: 0.8507901047990561
Energy: 0.8343861202050907
Energy: 0.8440142846632744
Energy: 0.9159184468540864
Energy: 0.8553371651194435
Energy: 0.8750539374819054
Energy: 0.9025575566183285
Energy: 0.8894544898709306
Energy: 0.9388357271784877
Energy: 0.8284756835526864
Energy: 0.8420226625334836
Energy: 0.8796231738011061
Energy: 0.860281708951181
Energy: 0.8463629186371459
Energy: 0.8474444203541251
Energy: 0.8441063556526722
Energy: 0.8198322369447815
Energy: 0.8667267432257375
Energy: 0.8322480517959849
Energy: 0.8024291073753574
Energy: 0.8479395865945152
Energy: 0.8304920889728538
Energy: 0.8422304442367721
Energy: 0.8466277076381675
Energy: 0.8289203301809374
Energy: 0.842756026674181
Energy: 0.8534323413807209
Energy: 0.8560953231047499
Energy: 0.8508270468085715
Energy: 0.8266669793219822
Energy: 0.8610137896562331
Energy: 0.8798791697287814
Energy: 0.8335980055604242
Energy: 0.8180693352327749
Energy: 0.8391649818750219
Energy: 0.804019531108969
Energy: 0.8526139007839922
Energy: 0.8785357133563928
Energy: 0.8158560424189774
Energy: 0.8146041483156342
Energy: 0.8155848546662173
Energy: 0.828598887180085
Energy: 0.8277954273152214
Energy: 0.8323027524750867
Energy: 0.8359473184726903
Energy: 0.8816830033570694
Energy: 0.8280117833281191
Energy: 0.8792297734937289
Energy: 0.8532790641592116
Energy: 0.867771825904252
Energy: 0.8223744555722269
Energy: 0.873358516743929
Energy: 0.858955018584686
Energy: 0.8325353901320803
Energy: 0.8120005611986768
Energy: 0.8493356541202699
Energy: 0.8399658883277917
Energy: 0.8509330043238899
Energy: 0.8151213233581377
Energy: 0.8771582388986467
Energy: 0.8672643557902451
Energy: 0.8095817675850798
Energy: 0.8219054704905391
Energy: 0.8037642008320514
Energy: 0.8285851648434818
Energy: 0.8551065684879411
Energy: 0.8354067169784205
Energy: 0.829769790105288
Energy: 0.8338557292218763
Energy: 0.8488344377045567
Energy: 0.8337977865620787
Energy: 0.8559428241973556
Energy: 0.8434870145723022
Energy: 0.8836983298064099
Energy: 0.8456969527920166
Energy: 0.8412850821526165
Energy: 0.8407301233343941
Energy: 0.80243984024011
Energy: 0.8866416883777486
Energy: 0.8595954813655222
Energy: 0.813223279457059
Energy: 0.8378950078515944
Energy: 0.8180903245236195
Energy: 0.8335510829804251
Energy: 0.8102858638216326
Energy: 0.8327876767285181
Energy: 0.8347320495206919
Energy: 0.8534012490477073
Energy: 0.812527703896414
Energy: 0.8617065720373691
Energy: 0.8450933198287545
Energy: 0.8576831976892053
Energy: 0.8462480338892908
Energy: 0.8346546883208636
Energy: 0.8606562581599682
Energy: 0.8147197345646179
Energy: 0.8068919090798532
Energy: 0.905094559365944
Energy: 0.8369759398260084
Energy: 0.8571830291497693
Energy: 0.8304587520958979
Energy: 0.8213484400894073
Energy: 0.8435145891974174
Energy: 0.83389292304802
Energy: 0.8248854996596859
Energy: 0.8300687997964442
Energy: 0.8376733003831686
Energy: 0.8433627646903358
Energy: 0.8590496930136218
Energy: 0.8659497635510796
Energy: 0.8284615471875412
Energy: 0.8272212790983485
Energy: 0.8273173377688259
Energy: 0.8781899653157919
Energy: 0.853964993096397
Energy: 0.8558515601287668
Energy: 0.8566186823426454
Energy: 0.8416630126974742
Energy: 0.8528955509764404
Energy: 0.8028536233186279
Energy: 0.8527329591427881

minimum gb energy = 0.7898080184528161 eV
minimum distance =  2.33317170088917 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 0.7749954457918476
Energy: 0.7771780368235043
Energy: 1.0991948993437368
Energy: 0.9584050761831148
Energy: 0.9324359480926129
Energy: 0.8942331284536055
Energy: 0.7543998094256429
Energy: 0.7535791070890965
Energy: 0.8274057415398709
Energy: 0.8922150221364288
Energy: 0.8953556471728495
Energy: 0.8293248289160421
Energy: 0.8176705051335554
Energy: 0.8310809036751295
Energy: 0.8168556276383449
Energy: 0.8280812860173578
Energy: 0.8460374234032232
Energy: 0.8779309352410992
Energy: 0.8290377482811467
Energy: 0.816568510290846
Energy: 0.8160366612833181
Energy: 0.8312341687898867
Energy: 0.8278295161149667
Energy: 0.9090545820709753
Energy: 0.839551098524089
Energy: 0.8775473917334052
Energy: 0.8925443839897801
Energy: 0.8964153772134061
Energy: 0.821556892603934
Energy: 0.8285357054359835
Energy: 0.8842343962210542
Energy: 0.8178148453289047
Energy: 0.8550559468160883
Energy: 0.8194059986219576
Energy: 0.8158947530997137
Energy: 0.7535845896154316
Energy: 0.8278997273128439
Energy: 0.8178805508928808
Energy: 0.830113042057622
Energy: 0.8308981952688645
Energy: 0.8156190476020195
Energy: 0.8470134440276345
Energy: 0.8333361821369354
Energy: 0.8318469829122723
Energy: 0.8153062752763865
Energy: 0.8910178862221035
Energy: 0.7560001204178117
Energy: 0.7546621688681971
Energy: 0.8287133554241825
Energy: 0.7559571722873925
Energy: 0.8283697116047607
Energy: 0.8981414908144735
Energy: 0.8277655498691792
Energy: 0.8950360231838598
Energy: 0.8170889146763134
Energy: 0.8295126942131135
Energy: 0.754663129718778
Energy: 0.828322324650424
Energy: 0.9007027515667644
Energy: 0.8272720385212875
Energy: 0.8257697968187555
Energy: 0.8165166278911714
Energy: 0.8292898675073106
Energy: 0.8321865951881278
Energy: 0.8342667410719193
Energy: 0.8948007465106216
Energy: 0.8781644614484262
Energy: 0.8214895070560047
Energy: 0.8164075860703199
Energy: 0.8157020554297791
Energy: 0.8334996209617456
Energy: 0.8264017039992786
Energy: 0.8418536751366854
Energy: 0.825880118120687
Energy: 0.8313158804191548
Energy: 0.8308077946426516
Energy: 0.8205513329275731
Energy: 0.8299077419245713
Energy: 0.8272691339111143
Energy: 0.8226986814755342
Energy: 0.8258651004113717
Energy: 0.8975215894121944
Energy: 0.8165175122593916
Energy: 0.8207205576737758
Energy: 0.7560538186560185
Energy: 0.8277954385551292
Energy: 0.8957826409547535
Energy: 0.819550150546416
Energy: 0.8861681520092224
Energy: 0.8948891183323469
Energy: 0.8163200998015474
Energy: 0.8307091061009254
Energy: 0.8264492976406427
Energy: 0.8180851291895951
Energy: 0.8944800150197987
Energy: 0.7557134548250257
Energy: 0.7551139297493922
Energy: 0.8289820077013913
Energy: 0.7534767618823918
Energy: 0.8318844549405482
Energy: 0.8156934888715699
Energy: 0.8873874372394027
Energy: 0.7539411928075673
Energy: 0.754500644844563
Energy: 0.830620320817179
Energy: 0.7539563642388923
Energy: 0.8280537002097871
Energy: 0.8462252753921619
Energy: 0.8204159953752046
Energy: 0.9336370210365658
Energy: 0.8959095894196893
Energy: 0.754428492430686
Energy: 0.8224367883841395
Energy: 0.8272453026267432
Energy: 0.8921117455270323
Energy: 0.8959859235147044
Energy: 0.8292448394307697
Energy: 0.8174808983336247
Energy: 0.8306079779833092
Energy: 0.8170521554039331
Energy: 0.8269006542135992
Energy: 0.8458812822546453
Energy: 0.8786774943015253
Energy: 0.8289251617130223
Energy: 0.8220627233609213
Energy: 0.8160100078593215
Energy: 0.8310301795113505
Energy: 0.8290173976906268
Energy: 0.9090403319720715
Energy: 0.8385201712141949
Energy: 0.8773439732754296
Energy: 0.8925726622552681
Energy: 0.9359991340282771
Energy: 0.8219143151454283
Energy: 0.8285661506817832
Energy: 0.8841845781649652
Energy: 0.8178056528780895
Energy: 0.8719777583262667
Energy: 0.8198128873460248
Energy: 0.8159767503077108
Energy: 0.753480339162797
Energy: 0.8281524393006519
Energy: 0.8167128702384356
Energy: 0.8303219353057257
Energy: 0.8308163602337437
Energy: 0.7541690709453333
Energy: 0.8443414172038559
Energy: 0.8331919121758179
Energy: 0.8308925753271763
Energy: 0.8153373785741198
Energy: 0.8881852767251451
Energy: 0.7560652289573515
Energy: 0.7547268449630653
Energy: 0.8288691370155591
Energy: 0.7558345959084415
Energy: 0.828278828479588
Energy: 0.8987622560569908
Energy: 0.8271615934035655
Energy: 0.8952464657053022
Energy: 0.9013828199996975
Energy: 0.8288722642254802
Energy: 0.7545876219592673
Energy: 0.8281999348349071
Energy: 0.8836915459003882
Energy: 0.8266175905897014
Energy: 0.8258509799395651
Energy: 0.8180439095036071
Energy: 0.8293661933950562
Energy: 0.8324042590533076
Energy: 0.8351069990859967
Energy: 0.8954848812261307
Energy: 0.8777810138694074
Energy: 0.821719518263766
Energy: 0.8166995273842503
Energy: 0.8161479952836501
Energy: 0.8330965010806922
Energy: 0.8263821670395947
Energy: 0.8414215587502895
Energy: 0.8262466284889546
Energy: 0.8294603297102218
Energy: 0.8174805791294711
Energy: 0.8698240083869179
Energy: 0.8292976455050156
Energy: 0.8279528819101292
Energy: 0.8232754249918566
Energy: 0.8259193012891655
Energy: 0.8871190718325489
Energy: 0.8176219184420632
Energy: 0.820676578590085
Energy: 0.7552284597256721
Energy: 0.8276794777163183
Energy: 0.8958183900216965
Energy: 0.8198613866179509
Energy: 0.8855779151253167
Energy: 0.8939396918060849
Energy: 0.8165795777039968
Energy: 0.831463163879301
Energy: 0.8266825088237173
Energy: 0.8174752776617915
Energy: 0.894400937622445
Energy: 0.7556791903772883
Energy: 0.7552569958860221
Energy: 0.8288296256022323
Energy: 0.7533680476599519
Energy: 0.8317723830024502
Energy: 0.8157258081143518
Energy: 0.8286402759248204
Energy: 0.7540316429796685
Energy: 0.7544812034763128
Energy: 0.8308589135709081

minimum gb energy = 0.7533680476599519 eV
minimum distance =  2.36599513405228 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.0161283199818794
Energy: 0.9086517875278465
Energy: 0.8977826180078875
Energy: 1.140848292403886
Energy: 0.7938426728492106
Energy: 0.7953564662242059
Energy: 0.8609923327861089
Energy: 0.8260709971731133
Energy: 0.9363740459095301
Energy: 0.847724564273308
Energy: 0.8247835983585721
Energy: 0.7622437360543838
Energy: 0.8045857874671671
Energy: 0.9056066023101857
Energy: 0.7944729071007277
Energy: 0.839760587637092
Energy: 0.8502743067851909
Energy: 0.8425777234652644
Energy: 0.7943326716659559
Energy: 0.8038718870311075
Energy: 0.8249675105779369
Energy: 0.9089230206463422
Energy: 0.7735324241196336
Energy: 0.8195592283619448
Energy: 0.8349166737496534
Energy: 0.7871807648107314
Energy: 0.8034096805060511
Energy: 0.8136905028951948
Energy: 0.7857754534522801
Energy: 0.76116096758526
Energy: 0.8231953378671065
Energy: 0.7992096105131423
Energy: 0.7992521149588518
Energy: 0.8360081935889541
Energy: 0.819960190012622
Energy: 0.7608578003317904
Energy: 0.7718415297092781
Energy: 0.8517760244630459
Energy: 0.7979510991148142
Energy: 0.8253959068514489
Energy: 0.8130273142019036
Energy: 0.8150575785076685
Energy: 0.825584245894347
Energy: 0.7871312486853724
Energy: 0.7935245929199665
Energy: 0.8679915639436354
Energy: 0.7602222297060439
Energy: 0.7607236406925135
Energy: 0.8160119814774829
Energy: 0.7932999208925785
Energy: 0.8006814119426073
Energy: 0.8502159678628913
Energy: 0.8317038947309472
Energy: 0.811979131227469
Energy: 0.7912446839265607
Energy: 0.820465948524447
Energy: 0.8016857004739383
Energy: 0.7987175257404586
Energy: 0.8261302919353312
Energy: 0.8345304150065311
Energy: 0.7720647098370005
Energy: 0.8201608073450734
Energy: 0.8344172515851607
Energy: 0.8963018842845565
Energy: 0.786204134234191
Energy: 0.9021188612039305
Energy: 0.8289759314502486
Energy: 0.7941003532875477
Energy: 0.7957191927162889
Energy: 0.7848677301734672
Energy: 0.8790004384179134
Energy: 0.8088596837122314
Energy: 0.830010582618243
Energy: 0.9002557185396147
Energy: 0.7657704142902794
Energy: 0.7601858405430526
Energy: 0.8458309927591184
Energy: 0.7936909516695634
Energy: 0.7975324634114916
Energy: 0.8174229933867888
Energy: 0.792058932339322
Energy: 0.7597190580644676
Energy: 0.8610503370139321
Energy: 0.9379825851231729
Energy: 0.9769767692022101
Energy: 0.8562840069556298
Energy: 0.7780242429785916
Energy: 0.8400361268701348
Energy: 0.8271391264404752
Energy: 0.7953702741736934
Energy: 0.775700097643392
Energy: 0.7596150913057876
Energy: 0.8198338639025644
Energy: 0.866190020115669
Energy: 0.8628374931486654
Energy: 0.7926593343265093
Energy: 0.8205658146187726
Energy: 0.8156737793206611
Energy: 0.793910786608797
Energy: 0.7963883277416811
Energy: 0.8115688808445567
Energy: 0.8404809542595402
Energy: 1.0242478367426266
Energy: 0.8966934325183841
Energy: 0.9981264369716971
Energy: 0.8461951447467707
Energy: 0.7998902849696371
Energy: 0.8434033466367735
Energy: 0.8607426018714789
Energy: 0.7875606106375866
Energy: 0.8530674131577959
Energy: 0.8227519074384755
Energy: 0.785667216969857
Energy: 0.8271319728987505
Energy: 0.8147960920391549
Energy: 0.8015377000746233
Energy: 0.74603251725413
Energy: 0.7934341222239143
Energy: 0.8204130428220642
Energy: 0.7607283444350135
Energy: 0.7616473738883939
Energy: 0.9137615111485227
Energy: 0.8023673511433436
Energy: 0.8355384655440435
Energy: 0.8168657708882053
Energy: 0.8149496878651776
Energy: 0.7642821613383779
Energy: 0.7679672494060847
Energy: 0.8216907887431496
Energy: 0.8820619393191158
Energy: 0.7613640899239321
Energy: 0.760607744296405
Energy: 0.8154969602875356
Energy: 0.789836175475605
Energy: 0.7994991520142477
Energy: 0.8124391653205139
Energy: 0.8352571721070777
Energy: 0.7609746454673623
Energy: 0.7858284461633939
Energy: 0.8191842442408958
Energy: 0.7935004632952966
Energy: 0.796213512736968
Energy: 0.8225607221194073
Energy: 0.8298767152295109
Energy: 0.8010018994011114
Energy: 0.8150309354399128
Energy: 0.8359436339422988
Energy: 0.8805567797190677
Energy: 0.7705389458841032
Energy: 0.8251944075721123
Energy: 0.8300356557510159
Energy: 0.7826773621526317
Energy: 0.7930928799640659
Energy: 0.8124454026378193
Energy: 0.7857973731501504
Energy: 0.8085343205940063
Energy: 0.785717736861155
Energy: 0.8511873784133416
Energy: 0.8293048375523456
Energy: 0.8864105118999717
Energy: 0.8018480593477555
Energy: 0.7937413783590298
Energy: 0.797172314393663
Energy: 0.8321648219540351
Energy: 0.8938236664362091
Energy: 0.7596645975192564
Energy: 0.8614210272397179
Energy: 0.9752049527329103
Energy: 0.7595463029933288
Energy: 0.8562712130740722
Energy: 0.8280553110378548
Energy: 0.8498747820975723
Energy: 0.8292393118538322
Energy: 0.8458781307443383
Energy: 0.8208832919889001

minimum gb energy = 0.74603251725413 eV
minimum distance =  2.34356555300831 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 0.989853869671845
Energy: 0.989650675226996
Energy: 1.0330614522062342
Energy: 0.9281808358074437
Energy: 0.830316120717563
Energy: 0.9709545628653438
Energy: 0.975670628983735
Energy: 0.9068635143566186
Energy: 0.9301964636460444
Energy: 0.7958976844175858
Energy: 0.8532566728600076
Energy: 0.8384638824987568
Energy: 0.8344470857672636
Energy: 0.8884271800245852
Energy: 0.934955029563965
Energy: 0.9314241277379318
Energy: 0.973387663806609
Energy: 0.8620612074800316
Energy: 0.7779718173928948
Energy: 0.8845434153488803
Energy: 0.9326103019052832
Energy: 0.9280631888624327
Energy: 0.9110729405478292
Energy: 0.9455147713896995
Energy: 0.8047755504736303
Energy: 1.0154908181594748
Energy: 1.0044842077917226
Energy: 0.8731674007592103
Energy: 0.7674869048711921
Energy: 0.8476558966972777
Energy: 0.8812449279750031
Energy: 0.8724141683597164
Energy: 0.8619875468855701
Energy: 0.8829811713990788
Energy: 0.9218695607881437
Energy: 0.8739306910156652
Energy: 0.8422641615000414
Energy: 0.8985108612909364
Energy: 0.8288922306814224
Energy: 0.929686891476163
Energy: 0.8699718973289559
Energy: 0.8316085457017441
Energy: 0.8995131694763623
Energy: 0.8267494251457153
Energy: 0.9348915147004443
Energy: 0.8360798870612596
Energy: 0.8237267603699021
Energy: 0.9427302864502928
Energy: 0.8723825728846275
Energy: 0.8397808442820615
Energy: 0.8420892348718072
Energy: 0.8095368685792594
Energy: 0.827808405733668
Energy: 0.8144133833596735
Energy: 0.8175380487705232
Energy: 0.8292568021876064
Energy: 0.8054611693447331
Energy: 0.8143389110184978
Energy: 0.8963620859705919
Energy: 0.8770486741993854
Energy: 0.9345028169882832
Energy: 0.9183085662702867
Energy: 0.842770336797702
Energy: 0.8682444674116648
Energy: 0.8584278249218013
Energy: 0.8063294713064114
Energy: 0.8206137161704579
Energy: 0.8135565294600922
Energy: 0.8384900431826451
Energy: 0.8398437860891075
Energy: 0.8730198967903947
Energy: 0.8153143803305002
Energy: 0.8146342193014462
Energy: 0.8152707916552052
Energy: 0.8747630985646238
Energy: 0.8749866318026664
Energy: 0.8802460956772004
Energy: 0.820813642331038
Energy: 0.830590919238279
Energy: 0.9319432185698617
Energy: 0.920862630230976
Energy: 0.9125834711149439
Energy: 0.9414778846578996
Energy: 0.8205217562694009
Energy: 0.8891717985635325
Energy: 0.8451746326845302
Energy: 0.8846818158439955
Energy: 0.7952295846597754
Energy: 0.8315347682383832
Energy: 0.8228037773756292
Energy: 0.8306904236784087
Energy: 0.9132624145410919
Energy: 0.8226594721478995
Energy: 0.7994413656436238
Energy: 0.8217643496516963
Energy: 0.8388265842711718
Energy: 0.8332340662699035
Energy: 0.8552379560932366
Energy: 0.8438615346048602
Energy: 0.9218170219700101
Energy: 0.9273541733269287
Energy: 0.8822235855395862
Energy: 0.8774430939480846
Energy: 0.8520665947914691
Energy: 0.9813676919153508
Energy: 0.7779719469885645
Energy: 0.8597194903641591
Energy: 0.8903363438931231
Energy: 0.879103591828341
Energy: 0.8112452686746427
Energy: 0.8724136150527353
Energy: 0.857878987778965
Energy: 0.895967982389933
Energy: 0.855695948026107
Energy: 0.859774853215856
Energy: 0.8770068956435716
Energy: 0.8667568142670693
Energy: 0.9495883861165059
Energy: 0.8261435410222259
Energy: 0.8936856805437967
Energy: 0.9197626262864456
Energy: 0.9402716694928648
Energy: 0.868066900585156
Energy: 0.8435715552121252
Energy: 0.9004120479608088
Energy: 0.8762606688611947
Energy: 0.8255235572693236
Energy: 0.9137730555156777
Energy: 0.9256805015142867
Energy: 0.8537456620720584
Energy: 0.8260360719794637
Energy: 0.8639221972482065
Energy: 0.8849155913542399
Energy: 0.9704099715814147
Energy: 0.8877521672162364
Energy: 1.0267300222551998
Energy: 1.0119584689792511
Energy: 1.0118668489244804
Energy: 0.9544484512030228
Energy: 0.9157543048339539
Energy: 0.9004160463479538
Energy: 0.9567092069955565
Energy: 0.8425898582491181
Energy: 0.9964278656609855
Energy: 0.8629729464452723
Energy: 0.8460910401949023
Energy: 0.9177114599223594
Energy: 0.9121073649353109
Energy: 0.9489795978377125
Energy: 0.8337528807750394
Energy: 0.8600227056454665
Energy: 0.8959573192028962
Energy: 0.8460653988096088
Energy: 0.9459458209466545
Energy: 0.9819600271778504
Energy: 0.8997098459492577
Energy: 1.0204732919549402
Energy: 1.0152068457631969
Energy: 1.0085648544011772
Energy: 1.0283411693900892
Energy: 0.9526533291878311
Energy: 0.7974978135036405
Energy: 0.8887760636792691
Energy: 0.9788121522972385
Energy: 0.8466266594009836
Energy: 0.8962242559194861
Energy: 0.8435358180971388
Energy: 0.8956347035947415
Energy: 0.878367814062433
Energy: 0.9181019916454016
Energy: 0.9729005677614778
Energy: 0.9329599594269549
Energy: 0.8229037896809642
Energy: 0.9487969869249923
Energy: 0.8997308907929982
Energy: 0.9167725819735644
Energy: 0.9475904304861149
Energy: 0.9480834866506188
Energy: 0.8950273895621932
Energy: 0.9576892642543396
Energy: 0.9553951710753055
Energy: 0.8625754965591376
Energy: 0.7748739051355881
Energy: 0.8591443160293004
Energy: 0.9397699113613873
Energy: 0.8566620216989216
Energy: 0.900757872600585
Energy: 0.9158487698693384
Energy: 0.9180850385760606
Energy: 0.8737070198687048
Energy: 0.8806893215007328
Energy: 0.8884463155604962
Energy: 0.8583019596474823
Energy: 0.906886156423943
Energy: 0.8337751843613251
Energy: 0.8610614095826961
Energy: 0.8915907405601073
Energy: 0.8803511010811139
Energy: 0.8718583142211628
Energy: 0.8572056114214551
Energy: 0.8461108236733736
Energy: 0.8717098396673255
Energy: 0.8937227471005686
Energy: 0.8705088823554349
Energy: 0.8407704402747119
Energy: 0.910867188918163
Energy: 0.8173729083648215
Energy: 0.8008520100470072
Energy: 0.8385621692149193
Energy: 0.8384309949049714
Energy: 0.79994715911743
Energy: 0.8442485525406778
Energy: 0.9075592094446228
Energy: 0.8838573924619861
Energy: 0.9358650465484423
Energy: 0.9305579479121346
Energy: 0.8711002549105846
Energy: 0.8511111626033623
Energy: 0.8484176012575548
Energy: 0.7676261469743139
Energy: 0.8169946722392835
Energy: 0.80384305525431
Energy: 0.8129193426257801
Energy: 0.8351301798455887
Energy: 0.8722236032141977
Energy: 0.8242874501321094
Energy: 0.8089611912074273
Energy: 0.814975683281076
Energy: 0.8601980598965114
Energy: 0.8498716458404035
Energy: 0.8383968891582875
Energy: 0.8242994509609869
Energy: 0.8184597990157
Energy: 0.9310842519356839
Energy: 0.8790671694486379
Energy: 0.9509692917717321
Energy: 0.9305311415021518
Energy: 0.8257733001773827
Energy: 0.7952010597636043
Energy: 0.8337322873248566
Energy: 0.8729568488976515
Energy: 0.7924905697534778
Energy: 0.8106061596271993
Energy: 0.8171950452974237
Energy: 0.8294809284183681
Energy: 0.9121093942194168
Energy: 0.8466376115907586
Energy: 0.8742908255636234
Energy: 0.8277072823385985
Energy: 0.8090484607666574
Energy: 0.9196257923298569
Energy: 0.8394141249262645
Energy: 0.8443956185806145
Energy: 0.9063842151263072
Energy: 0.8848263422548163
Energy: 0.8707969983053938
Energy: 0.8753335424606475
Energy: 0.8685868170319393
Energy: 0.8399828150964088
Energy: 0.7789593944596154
Energy: 0.8770606681463016
Energy: 0.8937331793408037
Energy: 0.8670067113389643
Energy: 0.875650287398897
Energy: 0.8700550542662896
Energy: 0.8834381295672463
Energy: 0.8992721423622073
Energy: 0.8210546741275915
Energy: 0.9133900802511504
Energy: 0.8685085590724508
Energy: 0.9836905550986202
Energy: 0.9798643392007851
Energy: 0.8510907755180596
Energy: 0.8941982111339558
Energy: 0.9388469502120126
Energy: 0.9615716716050408
Energy: 0.8821764744757077
Energy: 0.9485441831476363
Energy: 0.8813481784342055
Energy: 0.8929443821202753
Energy: 0.8356299103014383
Energy: 0.960840323930552
Energy: 0.9078098044852728
Energy: 0.8620468969294144
Energy: 0.9192334174569384
Energy: 0.8690389376627277
Energy: 0.8883942688981541
Energy: 0.9637467360143221
Energy: 0.9080789881727359
Energy: 1.038536197068838
Energy: 0.9064845663448762
Energy: 0.8522568693830092
Energy: 0.9554992086366417
Energy: 0.9434976549567825
Energy: 0.9036752259095981
Energy: 0.9398617325501619
Energy: 0.8451403394506669
Energy: 0.8207994550866711
Energy: 0.8662959957455243
Energy: 0.772502960600097
Energy: 0.9444451076107367
Energy: 0.8363071800300141
Energy: 0.9480609045024796
Energy: 0.823091739028917
Energy: 0.9445407503698362
Energy: 0.9611130511277518
Energy: 0.7656887900027767
Energy: 0.8862522521907397
Energy: 0.9862847476017423
Energy: 0.8820290502347902
Energy: 1.0329568903665263
Energy: 0.8743911191231879
Energy: 0.8994545392111992
Energy: 0.9693945617750513
Energy: 0.9406800183782569

minimum gb energy = 0.7656887900027767 eV
minimum distance =  2.25479730147185 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 0.895099745665807
Energy: 0.9028459672725528
Energy: 0.8462733551194921
Energy: 0.8166273952316281
Energy: 0.8173643399014576
Energy: 0.8158911947912028
Energy: 0.9023933052286195
Energy: 0.8887020933358517
Energy: 0.9969626290327377
Energy: 0.815160472454165
Energy: 0.81918867019697
Energy: 0.8172318742026545
Energy: 0.815876132490374
Energy: 0.9964572022047447
Energy: 0.8676007666668434
Energy: 1.100613579475741
Energy: 0.8659610716239917
Energy: 0.8167593574279093
Energy: 0.817515801141121
Energy: 0.8166518913276815
Energy: 0.8143998783319933
Energy: 0.8671314698095094
Energy: 1.0999760602579094
Energy: 0.8650868811873401
Energy: 0.8166491863305433
Energy: 0.8156155825939236
Energy: 0.816686029229349
Energy: 0.9042819732368602
Energy: 0.8873399546024413
Energy: 0.9978817945461618
Energy: 0.8743518050735785
Energy: 0.9961601744296478
Energy: 0.8166871118527252
Energy: 0.8733891222036823
Energy: 0.9959647238555214
Energy: 0.8713547716583289
Energy: 1.099977620269776
Energy: 0.8500138233397713
Energy: 0.8175875860050371
Energy: 0.8182568472697186
Energy: 0.8466316088419997
Energy: 0.9025952691932526
Energy: 0.8698643108049383
Energy: 0.9964829688429298
Energy: 0.8677722374826262
Energy: 0.8166436557846235
Energy: 0.8159280699398487
Energy: 0.816052735908775
Energy: 0.996591844430001
Energy: 0.8687661509534027
Energy: 0.9955338030146201
Energy: 0.8673649747664712
Energy: 0.8170166088453578
Energy: 0.8154449508252071
Energy: 0.8163037449184546
Energy: 0.9980926950535054
Energy: 0.8687234886414124
Energy: 1.100327640310975
Energy: 0.8650360331581313
Energy: 0.8166179183742053
Energy: 0.8158666726649271
Energy: 0.8166605145378545
Energy: 0.9038330724862885
Energy: 0.8870452478578356
Energy: 0.9988139203115175
Energy: 0.8744168565619126
Energy: 0.9954255022194127
Energy: 1.1292182397259944
Energy: 0.8732981847963307
Energy: 0.9993491617969228
Energy: 0.867712809003419
Energy: 1.100487980123983
Energy: 0.8653212919530537
Energy: 0.816822933431331
Energy: 0.8159437988989624
Energy: 0.8165357383889111
Energy: 0.9040542894349168
Energy: 0.8684292391171795
Energy: 0.9952953051995737
Energy: 0.8662310133523897
Energy: 0.8169912466757295
Energy: 0.8155264131126982
Energy: 0.8165823982679024
Energy: 0.997432273488118
Energy: 0.869052168307002
Energy: 0.9961387002517402
Energy: 0.8160893497700508
Energy: 0.8168448200082662
Energy: 0.817967507352487
Energy: 0.8160697908131896
Energy: 0.9971823835823479
Energy: 0.8704317697165203
Energy: 1.100667009437767
Energy: 0.8552598757967137
Energy: 0.8181448708221377
Energy: 0.817904684621495
Energy: 0.8506394872269998
Energy: 0.90271250249553
Energy: 0.8876533651589931
Energy: 0.9984082287164848
Energy: 0.8748830605736739
Energy: 0.8166024011446753
Energy: 0.8162480029306557
Energy: 0.8150649894838906
Energy: 0.9978793330002925
Energy: 0.8672927870616651
Energy: 1.1004355919909554
Energy: 0.8652763325615541
Energy: 0.8159988510729461
Energy: 0.8174549588258415
Energy: 0.817024272500845
Energy: 0.8158284847970281
Energy: 0.8673381667132434
Energy: 1.1007054062003105
Energy: 0.8655016654896611
Energy: 0.8164600426667248
Energy: 0.8155297911676461
Energy: 0.816639473358427
Energy: 0.8148732893604769
Energy: 0.8880123556970576
Energy: 0.9974788314585179
Energy: 0.8643379086268927
Energy: 0.8171784592822333
Energy: 0.8152687100472128
Energy: 0.8167925798940556
Energy: 0.9971640347122189
Energy: 0.8875761109731014
Energy: 1.1004484130265084
Energy: 0.8531553211758113
Energy: 0.8180790255682633
Energy: 0.8191355449449822
Energy: 0.8504928018686866
Energy: 0.9025216623365266
Energy: 0.8691897316349189
Energy: 0.9964355482068288
Energy: 0.8160325730976684
Energy: 0.817914476249163
Energy: 0.8169796703139557
Energy: 0.8150793447330347
Energy: 0.9964926595777748

minimum gb energy = 0.8143998783319933 eV
minimum distance =  2.36332698112597 Angstroms
sigma value = 23