Model name: model_name=Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Cu__MO_173787283511_004
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=3.6131481304764748
cohesive_energy=3.4950398727056187
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=[1.7089136413570798e-19, 2.3514505586564397e-19, 2.8382719288973397e-19, 3.2335449262714797e-19, 3.56495516301438e-19, 3.8515364975379595e-19, 4.10072302942398e-19, 4.3186350734143193e-19, 4.51022335530804e-19, 4.6790767507653e-19, 4.827838851232199e-19, 4.95870463869732e-19, 5.07375694278486e-19, 5.1752868760814395e-19, 5.26353476508216e-19, 5.339542024599119e-19, 5.40420587354736e-19, 5.45831137847754e-19, 5.50320436776222e-19, 5.53890086316774e-19, 5.565897539450639e-19, 5.5846590278347795e-19, 5.59564995954402e-19, 5.59923883520418e-19, 5.59581017720742e-19, 5.58393804834948e-19, 5.56194016316466e-19, 5.527974018523859e-19, 5.47981258890582e-19, 5.414924435228819e-19, 5.33050574838336e-19, 5.222166564392279e-19, 5.08510035335358e-19, 4.913715518814599e-19, 4.7027889649485e-19, 4.44128169474702e-19, 4.1178022323424195e-19, 3.7178348574306596e-19, 3.22274625575832e-19, 2.60941701849678e-19, 1.8465406142176798e-19, 8.908694890394579e-20, -3.1497831318459594e-20, -1.8480466602536398e-19, -3.82053437967006e-19, -6.391899703109339e-19, -9.79836755348844e-19, -1.440625959640512e-18, -2.07973742329638e-18, -2.9946443683757396e-18, -4.3578403356482994e-18, -6.5013604107442196e-18, -1.013230922931306e-17, -1.6990282115252998e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.016525092403098303
Energy: 0.9380986484914746
Energy: 0.49331097118261996
Energy: 1.308546089644992
Energy: 1.3014517707487276
Energy: 0.4548390525667892
Energy: 0.017044223007504463
Energy: 0.09880343691453392
Energy: 0.9294592090468685
Energy: 0.09971457349623844
Energy: 0.24308006950586283
Energy: 0.921978739392499
Energy: 0.01892471937152139
Energy: 0.10114837624167425
Energy: 0.01704190720879377
Energy: 0.9297442211667217
Energy: 0.24249452367508864
Energy: 0.2424678318754949
Energy: 0.9233995605996872
Energy: 0.09904778344508124
Energy: 0.10122272940568278
Energy: 0.019977770887583273
Energy: 0.9340461122924208
Energy: 0.24275840871941798
Energy: 0.9237730612663283
Energy: 0.9297591824747033
Energy: 0.09960984512873168
Energy: 0.01819618913940303
Energy: 0.09949611226113113
Energy: 0.929231222340688
Energy: 0.10003510573055328
Energy: 0.2438541001757182
Energy: 0.9223042583446011
Energy: 0.017979026835233527
Energy: 0.10183067910849658
Energy: 0.016987384572145922
Energy: 0.9266576872263877
Energy: 0.24419959163846078
Energy: 0.24236961672826332
Energy: 0.9256089769755879
Energy: 0.09886592482801655
Energy: 0.10085659903671099

minimum gb energy = 0.016525092403098303 eV
minimum distance =  2.52894919042776 Angstroms
sigma value = 5


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

Energy: 1.520878847994174
Energy: 1.4903817509896302
Energy: 1.5331342195189839
Energy: 1.527822785331519
Energy: 1.664733184605813
Energy: 1.568328397278218
Energy: 1.5319060619126068
Energy: 1.4809152034826991
Energy: 1.6051164033284409
Energy: 1.5144298234138422
Energy: 1.6692012548560244
Energy: 1.540025414271259
Energy: 1.5282710380287856
Energy: 1.6065973602781864
Energy: 1.4976151843170393
Energy: 1.5977815980382553
Energy: 1.566377656972392
Energy: 1.5434178055861547
Energy: 1.5567918222280297
Energy: 1.6010639378359441
Energy: 1.5636947567192652
Energy: 1.4981199614120195
Energy: 1.6549522368503955
Energy: 1.5129674463070923
Energy: 1.5514817931543783
Energy: 1.5184742229176225
Energy: 1.4998854959270858
Energy: 1.5715130489536384
Energy: 1.5056659873135378
Energy: 1.5345458136471442
Energy: 1.5194394745280166
Energy: 1.532219900336703
Energy: 1.6093942974713482
Energy: 1.5232353115005681
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Energy: 1.5907064318131818
Energy: 1.5965063645772446
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Energy: 1.5782154179479009
Energy: 1.5576433031801769
Energy: 1.6358455901996702
Energy: 1.6887977670982843
Energy: 1.5215550154919533
Energy: 1.5473146305745402
Energy: 1.5285471528957655
Energy: 1.5026717154428422
Energy: 1.5035677935954732
Energy: 1.5919502063385758
Energy: 1.55804364576574
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Energy: 1.5286475427308825
Energy: 1.5839419133213972
Energy: 1.6014606417224457
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Energy: 1.5557964184357842
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Energy: 1.6497826355113554
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Energy: 1.6276476714218877
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Energy: 1.4785562042588223
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Energy: 1.5106428722910716
Energy: 1.6654164453277973
Energy: 1.5612227166540842
Energy: 1.5042816416376592
Energy: 1.5816223742590347
Energy: 1.5060075963552013
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Energy: 1.5747712771921092
Energy: 1.5733852193839615
Energy: 1.6507472535072243
Energy: 1.5690497683968563
Energy: 1.4942559001128222
Energy: 1.5921306026045017
Energy: 1.521382529297339
Energy: 1.5731147029503993
Energy: 1.5330475852346999
Energy: 1.5428610513991898
Energy: 1.5565168101774531
Energy: 1.5728653157194283
Energy: 1.5838640162611308
Energy: 1.5196947613874237
Energy: 1.5308230928672022
Energy: 1.5001896722096413
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Energy: 1.5737695257094515
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Energy: 1.5943289936662235
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Energy: 1.576780186457179
Energy: 1.5010893233211602
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Energy: 1.5247901104825259
Energy: 1.533769170080732
Energy: 1.48276516999149
Energy: 1.528237878774563
Energy: 1.6470941692236172
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Energy: 1.6067445151634818
Energy: 1.6089838307918083
Energy: 1.5546936037825296
Energy: 1.6254745637966095
Energy: 1.526459041880768
Energy: 1.511033242667275
Energy: 1.5165295812137691
Energy: 1.5233135542148877
Energy: 1.5662668526291952
Energy: 1.532211542881094
Energy: 1.5221536039889303
Energy: 1.5874657211458507
Energy: 1.4792833815066266
Energy: 1.5851376743017096
Energy: 1.5268114918518825
Energy: 1.5878425784890118
Energy: 1.5703590216830996
Energy: 1.5130357764488767
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Energy: 1.5106904673498087
Energy: 1.490639587992811
Energy: 1.5763197996708198
Energy: 1.55197687035577
Energy: 1.5562384274381236
Energy: 1.6223373570088544
Energy: 1.514780037984843
Energy: 1.5482717474084058
Energy: 1.488082140802219
Energy: 1.5912154679461168
Energy: 1.5927898978055668
Energy: 1.5120560728700274
Energy: 1.5171884952699664
Energy: 1.5184320686896347
Energy: 1.4990435855576123
Energy: 1.5627953006363435
Energy: 1.5805719886460594
Energy: 1.605970987284762
Energy: 1.591766634613131
Energy: 1.4947167436405588
Energy: 1.507809655789294
Energy: 1.6493021929784548
Energy: 1.4828672086633712
Energy: 1.5921321217081446
Energy: 1.507774269075942
Energy: 1.5026931568449966
Energy: 1.5542978230198399
Energy: 1.4754668272898226
Energy: 1.5904857710313687
Energy: 1.5165040164659442
Energy: 1.622486270680551
Energy: 1.7188117676404915
Energy: 1.5015804890391382
Energy: 1.584995181498042
Energy: 1.5445874862436013
Energy: 1.52508797074263
Energy: 1.5261895267178587
Energy: 1.5364938162653066
Energy: 1.5546204779819317
Energy: 1.4760808647973265
Energy: 1.5670817692771668
Energy: 1.5185137794320889
Energy: 1.5349754530835007
Energy: 1.4838450346021503
Energy: 1.5250952642622173
Energy: 1.6859671451233247
Energy: 1.5910963310406454
Energy: 1.558521895905781

minimum gb energy = 1.4754668272898226 eV
minimum distance =  2.26181231572857 Angstroms
sigma value = 401


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

Energy: 1.5645075349559177
Energy: 1.5116152365685949
Energy: 1.466922160177405
Energy: 1.5868738274166783
Energy: 1.5432935433337585
Energy: 1.5746355684160942
Energy: 1.505920990883444
Energy: 1.5182246310517553
Energy: 1.5675174544601649
Energy: 1.5931621920008723
Energy: 1.715665993214394
Energy: 1.4900291701505928
Energy: 1.4891990304283633
Energy: 1.5710468386497585
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Energy: 1.5961307160419105
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Energy: 1.4968058082192002
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Energy: 1.599833791727725
Energy: 1.5872743617966605
Energy: 1.5442959602176662
Energy: 1.5021847263243115
Energy: 1.5040074831341335
Energy: 1.4828677554604872
Energy: 1.717874179195629
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Energy: 1.4617102212961397
Energy: 1.532297977305752
Energy: 1.5038434886608405
Energy: 1.5424834565203154
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Energy: 1.5840007830170009
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Energy: 1.6078089864583123
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Energy: 1.4890072072238456
Energy: 1.5637726033359016
Energy: 1.510106039292101
Energy: 1.533854162976238
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Energy: 1.5254964671678461
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Energy: 1.5146178083658113
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Energy: 1.5526344569225226
Energy: 1.5018124192018394
Energy: 1.5762030002983511
Energy: 1.5613497448444085
Energy: 1.7214870598244179
Energy: 1.5502018011062835
Energy: 1.490508859146177
Energy: 1.563097190446573
Energy: 1.5119406399334505
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Energy: 1.5365644937263925
Energy: 1.5968252437048178
Energy: 1.6617620999349227
Energy: 1.5463536532954998
Energy: 1.5667442206836495
Energy: 1.5316707186185339
Energy: 1.5324590728051681
Energy: 1.5179831247191404
Energy: 1.6099245100874537
Energy: 1.4892905778770968
Energy: 1.4939043507792573
Energy: 1.555063728833478
Energy: 1.462939259556864
Energy: 1.5316802492147565
Energy: 1.5031809293655212
Energy: 1.550891846733305
Energy: 1.4726653172774746
Energy: 1.5525415633338637
Energy: 1.8212725825586407
Energy: 1.5868599519068962
Energy: 1.5712511197736063
Energy: 1.502166583804103
Energy: 1.5057956948693958
Energy: 1.482441642079515
Energy: 1.5440162921203733
Energy: 1.5787883083751477
Energy: 1.537644456235678
Energy: 1.597432335477218
Energy: 1.5139198225453472
Energy: 1.5234826679385398
Energy: 1.4723166203053255
Energy: 1.5455538826032873
Energy: 1.5727188218143064
Energy: 1.5375072348600598
Energy: 1.5426440964964654
Energy: 1.525029914468236
Energy: 1.5659496186605808
Energy: 1.485287364346043
Energy: 1.5544636167572787
Energy: 1.684979993485263
Energy: 1.5014649959716504
Energy: 1.5225651273482446
Energy: 1.567696912438149
Energy: 1.6065418088754508
Energy: 1.4897913026246288
Energy: 1.489312517400083
Energy: 1.553679817629844
Energy: 1.5144034759023715
Energy: 1.525870818685916
Energy: 1.5398102561949152
Energy: 1.5974462122864819
Energy: 1.594315964703455
Energy: 1.5260612231514028
Energy: 1.5477842758991123
Energy: 1.5016916612389686
Energy: 1.5757098974976367
Energy: 1.5589504167426382
Energy: 1.7121763908002756
Energy: 1.585443693474448
Energy: 1.4729790035161043
Energy: 1.5162386008548518
Energy: 1.5022216285144407
Energy: 1.530810042708008
Energy: 1.5054664100561643
Energy: 1.5486926704458688
Energy: 1.551387425701634
Energy: 1.4858371998259816
Energy: 1.5527211379288497
Energy: 1.510394918803117
Energy: 1.5333936224522295
Energy: 1.5360736700369446
Energy: 1.4709118089784623
Energy: 1.628692747661275
Energy: 1.5495829102436751
Energy: 1.5666970718412387
Energy: 1.5320064483419267
Energy: 1.5290361565443553
Energy: 1.515486127742586
Energy: 1.6147927255812737
Energy: 1.4906523909662883
Energy: 1.491994971198085
Energy: 1.587394579969437
Energy: 1.4743729445374347
Energy: 1.5432878179132612
Energy: 1.5403121945050102
Energy: 1.5637749209951575
Energy: 1.5204189997494018
Energy: 1.4981314469392966
Energy: 1.846467318955326
Energy: 1.5869861043793783
Energy: 1.5757930916537903
Energy: 1.50384126200077
Energy: 1.5024209255755163
Energy: 1.4803167164977429
Energy: 1.6548812248086622
Energy: 1.5770874797251313
Energy: 1.4748686420533472
Energy: 1.5990655214493832
Energy: 1.5134837613842165
Energy: 1.5653016411274832
Energy: 1.479983993277134
Energy: 1.5462984659787113
Energy: 1.5701901307464128
Energy: 1.534842799386954
Energy: 1.5433160994188335
Energy: 1.5150446466927043
Energy: 1.5667649537440187
Energy: 1.4896355265927756
Energy: 1.5887705414605633
Energy: 1.6847514204362306
Energy: 1.5022401126479357
Energy: 1.5222521374292708
Energy: 1.56491277649774
Energy: 1.5140579578935438
Energy: 1.5458732076621555
Energy: 1.4882742101775326
Energy: 1.5596674797104733
Energy: 1.5112202309495446
Energy: 1.5268987116232058
Energy: 1.5337824086085314
Energy: 1.5945173118640978
Energy: 1.598538705363808
Energy: 1.476247496524455
Energy: 1.5556589768659796
Energy: 1.5042736515875657
Energy: 1.5697702990328297
Energy: 1.5531241869930301
Energy: 1.7121333736249489
Energy: 1.5875438368368964
Energy: 1.4618212016398928
Energy: 1.5699510318042906

minimum gb energy = 1.4617102212961397 eV
minimum distance =  2.26899548175348 Angstroms
sigma value = 311


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

Energy: 1.5712740884370742
Energy: 1.6568456231110151
Energy: 1.5954164687176384
Energy: 1.6010994108839645
Energy: 1.566270285188574
Energy: 1.5938722013085145
Energy: 1.6273630993618173
Energy: 1.6237900488151873
Energy: 1.5289369490738167
Energy: 1.6137980304565613
Energy: 1.5904248337616729
Energy: 1.682775365592914
Energy: 1.5489365120257876
Energy: 1.631343778729574
Energy: 1.5566563757398435
Energy: 1.561518524692378
Energy: 1.5894541307025911
Energy: 1.5965791644655198
Energy: 1.564713341126326
Energy: 1.6198499216803934
Energy: 1.6054872913295244
Energy: 1.577098054760303
Energy: 1.5720252808397228
Energy: 1.584586754278153
Energy: 1.6017279067127281
Energy: 1.6082023192914496
Energy: 1.5954760112016022
Energy: 1.61728193542153
Energy: 1.5575387456138678
Energy: 1.5957228876487186
Energy: 1.575538528396669
Energy: 1.5806296563590578
Energy: 1.597603109058183
Energy: 1.6085355577217426
Energy: 1.616499727782715
Energy: 1.6264806694773637
Energy: 1.5791994645187122
Energy: 1.5943643579248588
Energy: 1.5414030757403856
Energy: 1.5837079629964765
Energy: 1.5768584204521057
Energy: 1.5432903242045994
Energy: 1.5756327255076663
Energy: 1.634055762609841
Energy: 1.5759731147426672
Energy: 1.6425058512840183
Energy: 1.6739069983357093
Energy: 1.5948883614778213
Energy: 1.604422028048778
Energy: 1.6107485337944958
Energy: 1.600226496107534
Energy: 1.5402956203027658
Energy: 1.5804515571496185
Energy: 1.735581173580074
Energy: 1.6022513798358786
Energy: 1.6049964340179848
Energy: 1.5960794055489163
Energy: 1.6720958019200658
Energy: 1.5545578359964576
Energy: 1.5978996685153408
Energy: 1.6005610511026476
Energy: 1.5671104905657867
Energy: 1.5676122088114406
Energy: 1.5922589473923945
Energy: 1.6087273779328937
Energy: 1.6234058050520235
Energy: 1.5674392622790054
Energy: 1.600093284155906
Energy: 1.5725905290432036
Energy: 1.5351104265922275
Energy: 1.5861740779788096
Energy: 1.5494961065596846
Energy: 1.5740683056720217
Energy: 1.5678037887292433
Energy: 1.576583301815963
Energy: 1.5508538845811162
Energy: 1.5264036566523977
Energy: 1.5533202037547844
Energy: 1.6051768534962365
Energy: 1.5784768084562852
Energy: 1.4963652380309496
Energy: 1.5709568495177597
Energy: 1.549296830925819
Energy: 1.6030210817044317
Energy: 1.5583070435772512
Energy: 1.6637237188076004
Energy: 1.5703559862092353
Energy: 1.658614586136813
Energy: 1.538369120907198
Energy: 1.6101957059906253
Energy: 1.6536951787497083
Energy: 1.6022358084308013
Energy: 1.5843889971321259
Energy: 1.6115110177698762
Energy: 1.5639236890861274
Energy: 1.7552383064680712
Energy: 1.5800319672302503
Energy: 1.6579151263858072
Energy: 1.634490530375234
Energy: 1.6504870899494761
Energy: 1.5457775815623709
Energy: 1.6213514858368516
Energy: 1.5904358312550464
Energy: 1.5458613890540258
Energy: 1.638217089593982
Energy: 1.577275467060062
Energy: 1.6104239817126735
Energy: 1.5566816947813011
Energy: 1.5628328935545552
Energy: 1.5551823263151097
Energy: 1.5587640466919133
Energy: 1.5671466151680775
Energy: 1.616055750973275
Energy: 1.56979734919096
Energy: 1.638866565544764
Energy: 1.5820780152571743
Energy: 1.5760844022867255
Energy: 1.5564232140814016
Energy: 1.5954364304784878
Energy: 1.5559989623826784
Energy: 1.6319528993837464
Energy: 1.5802088229112783
Energy: 1.553123201074262
Energy: 1.5574861792525645
Energy: 1.5570074692090916
Energy: 1.5421827921766678
Energy: 1.6119986196110128
Energy: 1.6448038312615196
Energy: 1.623095638650199
Energy: 1.5998126871776641
Energy: 1.5676948179674073
Energy: 1.5894494700812005
Energy: 1.5932701746469868
Energy: 1.6244799858902284
Energy: 1.568140876980715
Energy: 1.6190297171629826
Energy: 1.6232189473871335
Energy: 1.7213105663943784
Energy: 1.653703569703172
Energy: 1.683993924583553
Energy: 1.5838255418434992
Energy: 1.6145235748406066
Energy: 1.6270214318086467
Energy: 1.639189759651992
Energy: 1.5731462139546544
Energy: 1.6074019271178777
Energy: 1.6474936103166078
Energy: 1.576367312650752
Energy: 1.5870604999758064
Energy: 1.568330868161317
Energy: 1.521806009495848
Energy: 1.6240216461290236
Energy: 1.5852583999239973
Energy: 1.6052525565359577
Energy: 1.6053775740196783
Energy: 1.5909758668199974
Energy: 1.5743690876612702
Energy: 1.5668422217861937
Energy: 1.5969159638441868
Energy: 1.5921577566098764
Energy: 1.5562659040986064
Energy: 1.5830475948455158
Energy: 1.6453881011741902
Energy: 1.5973729390992921
Energy: 1.5406005149341855
Energy: 1.5548583024873783
Energy: 1.5768487366443116
Energy: 1.6267807113126718
Energy: 1.6029095495141596
Energy: 1.6073107105941087
Energy: 1.575609152633977
Energy: 1.6157318703286854
Energy: 1.5761233664203738
Energy: 1.5750961214536827
Energy: 1.6755974946753602
Energy: 1.578943437194115
Energy: 1.5762906843852502
Energy: 1.5864201709534076
Energy: 1.5754206683181886
Energy: 1.7087673119303999
Energy: 1.5503654971176437
Energy: 1.6834824468754603
Energy: 1.5747296391339864
Energy: 1.5980042139715909
Energy: 1.5800814049428027
Energy: 1.6007384472759838
Energy: 1.5656708905758139
Energy: 1.573013039342941
Energy: 1.5969919081124497
Energy: 1.563703057955638
Energy: 1.565929825310184
Energy: 1.6016378809456153
Energy: 1.4983084216140663
Energy: 1.576640357848591
Energy: 1.5904415260680342
Energy: 1.566160511020403
Energy: 1.5750558400545394
Energy: 1.5802336015737466
Energy: 1.605599480980278
Energy: 1.595318652394762
Energy: 1.6421291296782485
Energy: 1.61406047148173
Energy: 1.578170384247179
Energy: 1.6167832424714297
Energy: 1.6343535633279689
Energy: 1.5920763549669577
Energy: 1.5657568692274508
Energy: 1.5753337766958075
Energy: 1.5859642707441322
Energy: 1.6118006531846483
Energy: 1.5441549746896743
Energy: 1.5824984935199904
Energy: 1.5638186666499123
Energy: 1.589983853326985
Energy: 1.5688133565023312
Energy: 1.6044780522624702
Energy: 1.6550366125794782
Energy: 1.5335768374293126
Energy: 1.5893085481620703
Energy: 1.584503864393004
Energy: 1.5509259358781413
Energy: 1.7123447314521776
Energy: 1.5757282645258668
Energy: 1.7022141848219723
Energy: 1.6204510461303343
Energy: 1.5623385036809532
Energy: 1.5984148017130317
Energy: 1.5770450475635158
Energy: 1.535677273900484
Energy: 1.5909467776957276
Energy: 1.694852169545417
Energy: 1.6065772069180086
Energy: 1.588969624548987
Energy: 1.5904297967889747
Energy: 1.5305877627146445
Energy: 1.548673303926475
Energy: 1.5652118311938439
Energy: 1.6129512969043558
Energy: 1.596688078741058
Energy: 1.5238904694998596
Energy: 1.5996716488689235
Energy: 1.6040114968367585
Energy: 1.5483815517273851
Energy: 1.5599597742922784
Energy: 1.5943009505349832
Energy: 1.60235543286011
Energy: 1.561370565699272
Energy: 1.6156042743935117
Energy: 1.5573768583876528
Energy: 1.5634109571733938
Energy: 1.5816858722340206
Energy: 1.6183366288555436

minimum gb energy = 1.4963652380309496 eV
minimum distance =  2.26462358616348 Angstroms
sigma value = 39


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

Energy: 1.4810819207084305
Energy: 1.633216243933974
Energy: 2.1626855757570347
Energy: 1.8285054947977173
Energy: 1.5450981244743407
Energy: 1.64896388120436
Energy: 1.4623849319952111
Energy: 1.5604783966423357
Energy: 1.5874389024272377
Energy: 1.4987865861628902
Energy: 1.569918574119503
Energy: 1.585346669108545
Energy: 1.5566443598951207
Energy: 1.5517145347052614
Energy: 1.555526157711901
Energy: 1.4278683620769264
Energy: 1.4973478036664472
Energy: 1.6938101033156259
Energy: 1.5789513412437528
Energy: 1.555063293698592
Energy: 1.554543664987758
Energy: 1.5552490915119142
Energy: 1.424304585105482
Energy: 1.5023125379245696
Energy: 1.4225406413664083
Energy: 1.6586982195457516
Energy: 1.500484763423403
Energy: 1.6316690102817863
Energy: 1.5845125587856244
Energy: 1.5856352816250308
Energy: 1.6980533861783849
Energy: 1.501894251879938
Energy: 1.5884615534851672
Energy: 1.5029565450710716
Energy: 1.5550905340940417
Energy: 1.4614314864526063
Energy: 1.5810017599437025
Energy: 1.4987361277126559
Energy: 1.4229928663798286
Energy: 1.5736182076133935
Energy: 1.554515263811391
Energy: 1.5938137050794254
Energy: 1.5566185051375376
Energy: 1.5424673429700049
Energy: 1.4979589559627642
Energy: 1.5838598469608327
Energy: 1.4634488680722095
Energy: 1.4637540359318055
Energy: 1.5501847636728363
Energy: 1.4644585652925481
Energy: 1.579803160103124
Energy: 1.6643727987013177
Energy: 1.4243630003347933
Energy: 1.6617108943119105
Energy: 1.4998388078912632
Energy: 1.5902918204259207
Energy: 1.4648589417891653
Energy: 1.580278753927795
Energy: 1.6591810427878586
Energy: 1.4236432633595981
Energy: 1.5791959665071476
Energy: 1.514613288333294
Energy: 1.5905118480795315
Energy: 1.5564282742163018
Energy: 1.4227679327572942
Energy: 1.4988197268935337
Energy: 1.571743683206485
Energy: 1.5746412507996477
Energy: 1.5537994226603649
Energy: 1.5547709768596374
Energy: 1.5556976267763676
Energy: 1.5286277074971755
Energy: 1.5056519554641676
Energy: 1.4250426657859416
Energy: 1.5881971251882012
Energy: 1.559809662445561
Energy: 1.6347686634791383
Energy: 1.5882923713311914
Energy: 1.4689374509475392
Energy: 1.5331916593459807
Energy: 1.422722899353797
Energy: 1.569980503342789
Energy: 1.5012102412718722
Energy: 1.560183627501606
Energy: 1.4638956716298122
Energy: 1.4719385801483489
Energy: 1.6637236725596416
Energy: 1.509899178102266
Energy: 1.5861475795268327
Energy: 1.4419956807489867
Energy: 1.5547386363419577
Energy: 1.5554417904707818
Energy: 1.424418580040711
Energy: 1.4977774630390286
Energy: 1.5889466256253895
Energy: 1.4638577899468805
Energy: 1.4636692756305405
Energy: 1.5509377455643565
Energy: 1.4609644210444819
Energy: 1.5317262141339933
Energy: 1.4970435379684972
Energy: 1.5848480185428535
Energy: 1.4619134817710353
Energy: 1.4629338593765553
Energy: 1.5513976406802064
Energy: 1.4615426770374194
Energy: 1.6293631520194614
Energy: 1.662529165130055
Energy: 1.5048431194523535
Energy: 1.5547035734740502
Energy: 1.6492715636027908
Energy: 1.4620735744631261
Energy: 1.5608355610562945
Energy: 1.5862921360744473
Energy: 1.4984500797073403
Energy: 1.5700188670283624
Energy: 1.5827630402565858
Energy: 1.5564015158090692
Energy: 1.5512366629825995
Energy: 1.555632146164616
Energy: 1.426158668258991
Energy: 1.497600447940295
Energy: 1.6947841071645067
Energy: 1.586449545850251
Energy: 1.5553079193966584
Energy: 1.6268411382889016
Energy: 1.5554323524663511
Energy: 1.4245174009541604
Energy: 1.5015111234824565
Energy: 1.4223887084414137
Energy: 1.6598714645906822
Energy: 1.502343865309604
Energy: 1.7223230309277309
Energy: 1.586383863941287
Energy: 1.5853313215545641
Energy: 1.6982217389534464
Energy: 1.5003994416515143
Energy: 1.668771639116341
Energy: 1.4971105569265368
Energy: 1.5550759606542348
Energy: 1.4614366676704593
Energy: 1.5814678359963192
Energy: 1.498658511079437
Energy: 1.4230365476767732
Energy: 1.5736583916781672
Energy: 1.4618296808590916
Energy: 1.5942622689470596
Energy: 1.5563912614120177
Energy: 1.534695641599592
Energy: 1.4977564760462982
Energy: 1.5832663916336969
Energy: 1.4635964833536663
Energy: 1.4637800643648013
Energy: 1.550281757884901
Energy: 1.463983503387955
Energy: 1.57961869894524
Energy: 1.662913605623212
Energy: 1.4235933557358424
Energy: 1.6612789468337594
Energy: 1.499529545622304
Energy: 1.590097758027081
Energy: 1.4616987540538577
Energy: 1.579607038601173
Energy: 1.658625274063306
Energy: 1.4227695235896085
Energy: 1.5793980538309502
Energy: 1.5149106367012615
Energy: 1.590815752924957
Energy: 1.5565183971866594
Energy: 1.534351816754572
Energy: 1.4984496194019559
Energy: 1.5705783340746717
Energy: 1.574583674667431
Energy: 1.5536950769505184
Energy: 1.5547539909207024
Energy: 1.5560768464043353
Energy: 1.5287350252664986
Energy: 1.5058596090776066
Energy: 1.4246038158946135
Energy: 1.5884705791753997
Energy: 1.4978207122489162
Energy: 1.633947683385587
Energy: 1.5880720689593426
Energy: 1.4690606533053674
Energy: 1.533026170259075
Energy: 1.4233215325800366
Energy: 1.5700925437686937
Energy: 1.4993276072365362
Energy: 1.5603069982847244
Energy: 1.4635600809242832
Energy: 1.4713262840122987
Energy: 1.6637027516846294
Energy: 1.51049119106355
Energy: 1.5866267330465744
Energy: 1.5171393642084579
Energy: 1.5546120266102148
Energy: 1.554727045717207
Energy: 1.4242334817544795
Energy: 1.497402427974534
Energy: 1.6044115077556311
Energy: 1.4633384385230894
Energy: 1.4626896801299583
Energy: 1.5510798756219175
Energy: 1.4608939186423502
Energy: 1.532419078030496
Energy: 1.4971692742586773
Energy: 1.42217503789757
Energy: 1.4619319218395657
Energy: 1.4619108240454417
Energy: 1.551711315918613

minimum gb energy = 1.42217503789757 eV
minimum distance =  2.31119518123838 Angstroms
sigma value = 21


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

Energy: 1.885632305520614
Energy: 1.7710600179484126
Energy: 1.4859944816976145
Energy: 1.885962072322796
Energy: 1.5227052034287016
Energy: 1.5236669318409866
Energy: 1.7976085371552306
Energy: 1.657079513711763
Energy: 1.5687585262802926
Energy: 1.6698158776910963
Energy: 1.4724124203933113
Energy: 1.4131880758845097
Energy: 1.6499597360201808
Energy: 1.5189847323343226
Energy: 1.6342815814190343
Energy: 1.5079926929232257
Energy: 1.5307562653793676
Energy: 1.454696280902804
Energy: 1.5029267943832199
Energy: 1.5120132745417239
Energy: 1.5260443095124538
Energy: 1.793490345906536
Energy: 1.5050167549608282
Energy: 1.5660030732950694
Energy: 1.5675407139325694
Energy: 1.573471237473622
Energy: 1.5216335981295945
Energy: 1.6624684935996246
Energy: 1.4879136332419896
Energy: 1.4749440472723307
Energy: 1.5619616975647352
Energy: 1.4486784594800695
Energy: 1.3814425513644066
Energy: 1.5286009177772046
Energy: 1.5171299539969834
Energy: 1.4496858431331108
Energy: 1.412049238884505
Energy: 1.6017862158046
Energy: 1.5041356167190754
Energy: 1.375682821457537
Energy: 1.5114205556353701
Energy: 1.4922223392839065
Energy: 1.654541725076717
Energy: 1.4422801062066937
Energy: 1.5246875503871975
Energy: 1.5272806608717684
Energy: 1.4493991056422355
Energy: 1.449417330095026
Energy: 1.4906765621188516
Energy: 1.5220312507391554
Energy: 1.4511204117285679
Energy: 1.5305984510474857
Energy: 1.5639695838653123
Energy: 1.5207807454080293
Energy: 1.4883181925467255
Energy: 1.497867559255418
Energy: 1.5496693144177685
Energy: 1.4645992795804046
Energy: 1.5982060211474232
Energy: 1.576957347600232
Energy: 1.382680214345954
Energy: 1.671979560983239
Energy: 1.5143797700982402
Energy: 1.8324949633306526
Energy: 1.5573105197505428
Energy: 1.4362971876991137
Energy: 1.5354956881074202
Energy: 1.5218691658130674
Energy: 1.5223272187105146
Energy: 1.4876192533303731
Energy: 1.5849299528447698
Energy: 1.5217824814799534
Energy: 1.5437313074003245
Energy: 1.584276743978609
Energy: 1.4489684248256522
Energy: 1.4492016289869973
Energy: 1.5296262960153684
Energy: 1.5242064551338483
Energy: 1.5655250597035966
Energy: 1.6973286717093488
Energy: 1.4653305195167927
Energy: 1.6096606554473065
Energy: 1.7468288763757271
Energy: 1.5114129860398906
Energy: 1.7467095101700065
Energy: 1.5044478976095632
Energy: 1.4887410022303411
Energy: 1.6918112934235074
Energy: 1.4668948656295204
Energy: 1.5212510199105755
Energy: 1.4492899566584492
Energy: 1.4481710065968432
Energy: 1.5063900417543141
Energy: 1.5507550634680582
Energy: 1.6070879968754663
Energy: 1.4951166272411986
Energy: 1.5228147227406013
Energy: 1.5191557196186811
Energy: 1.5225408876256128
Energy: 1.569137850392947
Energy: 1.5409948024714342
Energy: 1.464056768521366
Energy: 1.580324154908795
Energy: 1.651567691321994
Energy: 1.4888211272784508
Energy: 1.554378138248265
Energy: 1.400277499643711
Energy: 1.5231673254409301
Energy: 1.5248590022391002
Energy: 1.5165777269271041
Energy: 1.5134322159667783
Energy: 1.519909655288492
Energy: 1.4877980513914593
Energy: 1.5009835404802412
Energy: 1.530332973068165
Energy: 1.4497124138955686
Energy: 1.3354947850587648
Energy: 1.4989823586503503
Energy: 1.5905138187077037
Energy: 1.45101305158279
Energy: 1.4010754320320622
Energy: 1.5471095400975055
Energy: 1.4437993638463489
Energy: 1.5092775650221
Energy: 1.4930496121037278
Energy: 1.4797772112678764
Energy: 1.7462807905326334
Energy: 1.4500391593047175
Energy: 1.5652109855771301
Energy: 1.4396200502889276
Energy: 1.4494003792615957
Energy: 1.4493816123586092
Energy: 1.4939112625160167
Energy: 1.8811962922510734
Energy: 1.4484723293548216
Energy: 1.513835126688998
Energy: 1.562685418960513
Energy: 1.6460905171079467
Energy: 1.488139393705736
Energy: 1.5132292501695774
Energy: 1.5220254340013446
Energy: 1.4010709498461347
Energy: 1.598950674643448
Energy: 1.5705289116950343
Energy: 1.5076231876430755
Energy: 1.6586659102315355
Energy: 1.5444199372468679
Energy: 1.637645003421701
Energy: 1.4604954283868745
Energy: 1.5637203850946833
Energy: 1.5545892268659949
Energy: 1.4064005599919736
Energy: 1.4994691238398303
Energy: 1.5723121138011003
Energy: 1.4009565070548773
Energy: 1.4506566366464695
Energy: 1.4865961350305945
Energy: 1.530962410373825
Energy: 1.5322708047260942
Energy: 1.5210420144618204
Energy: 1.488840450460005
Energy: 1.5226544188834639
Energy: 1.5701446162867092
Energy: 1.4304800162596432
Energy: 1.5722953437594076
Energy: 1.7471606424249384
Energy: 1.747093349597253
Energy: 1.5098362371139904
Energy: 1.4483196574802994
Energy: 1.56574467437225
Energy: 1.4812820515878151
Energy: 1.5836157660103674
Energy: 1.5982077397199919
Energy: 1.5210168900725745
Energy: 1.5296763268882154

minimum gb energy = 1.3354947850587648 eV
minimum distance =  2.28825774591773 Angstroms
sigma value = 113


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

Energy: 1.4504559664590666
Energy: 1.6001115648984252
Energy: 1.5361297900343853
Energy: 1.4944109952945657
Energy: 1.5176671835067086
Energy: 1.4425360891386854
Energy: 1.5345215744554823
Energy: 1.5896917937003792
Energy: 1.5618500501999697
Energy: 1.4176889180284447
Energy: 1.4592735261711394
Energy: 1.4033644396853058
Energy: 1.454629736819315
Energy: 1.449756909607393
Energy: 1.597929094770442
Energy: 1.5771576699982728
Energy: 1.5272643557803782
Energy: 1.4561252861203156
Energy: 1.3943244434340634
Energy: 1.5432947180537424
Energy: 1.4741865333494555
Energy: 1.456179559220764
Energy: 1.60805149071331
Energy: 1.4444444652519657
Energy: 1.4273515004158208
Energy: 1.501092872688598
Energy: 1.48195407779211
Energy: 1.5390828132611156
Energy: 1.4601601840365848
Energy: 1.4913416690290855
Energy: 1.453536514599837
Energy: 1.5515249178603066
Energy: 1.4960969161782143
Energy: 1.4998246666452135
Energy: 1.629230229105239
Energy: 1.593417775868763
Energy: 1.5049290608056896
Energy: 1.5385873719221421
Energy: 1.4062170475615285
Energy: 1.4716195396630107
Energy: 1.5979485754605098
Energy: 1.455318897023035
Energy: 1.5527951764392751
Energy: 1.5110669580091314
Energy: 1.5530338601086933
Energy: 1.4403103049968629
Energy: 1.4914152320878085
Energy: 1.4899855671861215
Energy: 1.5574570861825274
Energy: 1.420352875073483
Energy: 1.47070350974765
Energy: 1.4427980376331988
Energy: 1.4334178224654315
Energy: 1.3992411039561767
Energy: 1.416287537010342
Energy: 1.3965588688737602
Energy: 1.482823387567558
Energy: 1.4124788330333347
Energy: 1.635367102827535
Energy: 1.415988047650569
Energy: 1.4229979777482105
Energy: 1.5822056385648213
Energy: 1.3714603834970949
Energy: 1.6017974071425918
Energy: 1.4845440936449643
Energy: 1.5415880816598933
Energy: 1.4459773570415038
Energy: 1.4253193597074478
Energy: 1.5324698901155953
Energy: 1.4435987849008007
Energy: 1.5458818483035082
Energy: 1.4428970237120309
Energy: 1.5435106112486099
Energy: 1.4000696147541019
Energy: 1.4509165095491714
Energy: 1.5563699860611482
Energy: 1.3931249396375194
Energy: 1.509095929302289
Energy: 1.4054498379620015
Energy: 1.7050377988045438
Energy: 1.4161025914311154
Energy: 1.4842229284461483
Energy: 1.632014179229542
Energy: 1.4310129136689411
Energy: 1.4438566905535564
Energy: 1.4544462161550684
Energy: 1.5734160342994314
Energy: 1.4357934238984171
Energy: 1.448244340921797
Energy: 1.4693925652552544
Energy: 1.4353354398352212
Energy: 1.6117908404636059
Energy: 1.4382730492899374
Energy: 1.455225301609978
Energy: 1.4789458549812264
Energy: 1.4640093253247857
Energy: 1.4852624425019272
Energy: 1.3977409473009503
Energy: 1.5520746280869688
Energy: 1.4138153102552475
Energy: 1.608059761672306
Energy: 1.4165035762043277
Energy: 1.424403547552521
Energy: 1.673049223804802
Energy: 1.4614482260998694
Energy: 1.4145580902029664
Energy: 1.4236629836697303
Energy: 1.4203318228889068
Energy: 1.502286224012174
Energy: 1.4179290136089195
Energy: 1.4441992775208508
Energy: 1.6036570746520111
Energy: 1.453791619857752
Energy: 1.5749029662069123
Energy: 1.4288792799611878
Energy: 1.4773729735200847
Energy: 1.4213900156011177
Energy: 1.4945008287631405
Energy: 1.548752304076356
Energy: 1.593680487193364
Energy: 1.468023806324637
Energy: 1.5301808625702165
Energy: 1.4135138221650072
Energy: 1.4426188945867329
Energy: 1.5183414619929423
Energy: 1.519888157330719
Energy: 1.4884239711074239
Energy: 1.520494659420722
Energy: 1.637690079612402
Energy: 1.5619652248321765
Energy: 1.4401393661945205
Energy: 1.4929368654559798
Energy: 1.466228801105257
Energy: 1.3918007812219042
Energy: 1.4032948520287718
Energy: 1.5204569984029852
Energy: 1.4133353372118
Energy: 1.6229001237805964
Energy: 1.4794547096305508
Energy: 1.4324945199172525
Energy: 1.6137382884074045
Energy: 1.475125925079184
Energy: 1.4129947410809716
Energy: 1.4043495762963485
Energy: 1.4040271388670091
Energy: 1.397324450881192
Energy: 1.5083329211007603
Energy: 1.434623112776681
Energy: 1.4330364096456365
Energy: 1.478745454926869
Energy: 1.4623469320229996
Energy: 1.4641535096078313
Energy: 1.4083747611071977
Energy: 1.5111181713771888
Energy: 1.382543582528181
Energy: 1.3964579620717807
Energy: 1.4190813535392386
Energy: 1.4158310792122355
Energy: 1.5246140499007632
Energy: 1.5268573303470394
Energy: 1.4627363116306296
Energy: 1.4819969741534138
Energy: 1.5492731026354656
Energy: 1.4042912187246912
Energy: 1.551762507640096
Energy: 1.4842891035366088
Energy: 1.4139503599897794
Energy: 1.5694132178566416
Energy: 1.4041455664198752
Energy: 1.6270593580433361
Energy: 1.5801137870418596
Energy: 1.402494655312166
Energy: 1.4147723259154203
Energy: 1.5075758391611582
Energy: 1.6186836025533082
Energy: 1.396692539563995
Energy: 1.4224748255859885
Energy: 1.4097676816726972
Energy: 1.4262493263444855
Energy: 1.4738753114075083
Energy: 1.4816186575802297
Energy: 1.50912466027895
Energy: 1.3946153147159948
Energy: 1.4374910254012907
Energy: 1.4194696699479274
Energy: 1.410899084094592
Energy: 1.4520522376619542
Energy: 1.5020599751081414
Energy: 1.5771261125469855
Energy: 1.5942921360847682
Energy: 1.509058413670354
Energy: 1.490234038232719
Energy: 1.4172597406997602
Energy: 1.4035910637011997
Energy: 1.604941623523521
Energy: 1.4202576674687521
Energy: 1.6382049827548846
Energy: 1.4797181861421207
Energy: 1.466116343767511
Energy: 1.4731157301671989
Energy: 1.4509033040620307
Energy: 1.538989938622314
Energy: 1.4563220173885676
Energy: 1.3964276460483669
Energy: 1.4901926193613195
Energy: 1.4622454840256118
Energy: 1.4595727509266108
Energy: 1.5127472136727604
Energy: 1.4275150803518688
Energy: 1.440745896635774
Energy: 1.4766687112261312
Energy: 1.5057371010282328
Energy: 1.6448648802436747
Energy: 1.4751035168673043
Energy: 1.5319328537382997
Energy: 1.6139938226747155
Energy: 1.4295507132984937
Energy: 1.6139293280841296
Energy: 1.459363760486312
Energy: 1.5784747962963568
Energy: 1.411778822851583
Energy: 1.4476373024544689
Energy: 1.5583449328671395
Energy: 1.436269335413845
Energy: 1.5487526230832214
Energy: 1.4485052851860847
Energy: 1.542905119934436
Energy: 1.4049278755770789
Energy: 1.4405724654017893
Energy: 1.4980550809625472
Energy: 1.3993783041624952
Energy: 1.4601000842822711
Energy: 1.4268660073166222
Energy: 1.704438250763257
Energy: 1.4934130345481806
Energy: 1.417791874393593
Energy: 1.716239320321263
Energy: 1.52753464506867
Energy: 1.4466301269153248
Energy: 1.465731596860036
Energy: 1.495219638165247
Energy: 1.4621117631824467
Energy: 1.5344804595761263
Energy: 1.4390515065490246
Energy: 1.4501750816147165
Energy: 1.6624071993359022
Energy: 1.470142887774816
Energy: 1.4736410625127
Energy: 1.4775493076680088
Energy: 1.431563230181575
Energy: 1.5012326254934354
Energy: 1.4750072300602217
Energy: 1.5484038834269682
Energy: 1.450270382311837
Energy: 1.5599732567775437
Energy: 1.4106423006748972
Energy: 1.3914050451234945
Energy: 1.6176774117546078
Energy: 1.4319523173530933
Energy: 1.4040875294278161
Energy: 1.4469570213177545
Energy: 1.4407279158937238
Energy: 1.4521468547410614
Energy: 1.4467531091140005
Energy: 1.4451285657198103
Energy: 1.5912553976155346
Energy: 1.480661322550114
Energy: 1.5148108380116636
Energy: 1.463778812229387
Energy: 1.4552251989596046
Energy: 1.4183968666146334
Energy: 1.4438978698783616
Energy: 1.5616314896166592
Energy: 1.4572595569159559
Energy: 1.6033388497890189
Energy: 1.6355924428321738
Energy: 1.4406327722718286
Energy: 1.4200126278539578
Energy: 1.5048107213426443
Energy: 1.5258365083398986
Energy: 1.5797128720866849
Energy: 1.611690546000016
Energy: 1.4886352089696315
Energy: 1.6171476516574739
Energy: 1.4166961572314452
Energy: 1.4199910950156545
Energy: 1.4747146604446824
Energy: 1.458020221827275
Energy: 1.4137650446192365
Energy: 1.4452056023765565
Energy: 1.6374592638496708
Energy: 1.397364823233389
Energy: 1.506075002261569
Energy: 1.429131255322984
Energy: 1.499505048070134
Energy: 1.5939776090493467
Energy: 1.4140557979345645
Energy: 1.4678725112373772
Energy: 1.3992756990843764
Energy: 1.3915713815527084
Energy: 1.4421443247804184
Energy: 1.6392348347565615
Energy: 1.4346070088189962
Energy: 1.421549502084882
Energy: 1.4028867378797885
Energy: 1.3969283758444675
Energy: 1.3944212683626198
Energy: 1.4486704332236797
Energy: 1.3973338303179659
Energy: 1.4106296490625185
Energy: 1.5507004350315021
Energy: 1.460090336442837
Energy: 1.5858214005598923
Energy: 1.401265084270408
Energy: 1.574879999408667

minimum gb energy = 1.3714603834970949 eV
minimum distance =  2.24536485207107 Angstroms
sigma value = 365


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

Energy: 1.4756336518808029
Energy: 1.84646367099405
Energy: 1.2592079917571293
Energy: 1.2587338890608442
Energy: 1.2587920920802882
Energy: 1.2590457216183606
Energy: 1.258587838800354
Energy: 1.4722065585574289
Energy: 1.5138427231649154
Energy: 1.2573714464597932
Energy: 1.2566923964089576
Energy: 1.2565236949797498
Energy: 1.2569430943791613
Energy: 1.5142848227527226
Energy: 1.480212486891136
Energy: 1.5139748874431864
Energy: 1.2568228072990466
Energy: 1.2603791295303557
Energy: 1.2571801824812345
Energy: 1.2597352393757641
Energy: 1.259259174085368
Energy: 1.479560912724451
Energy: 1.5135449794778453
Energy: 1.2604890099955786
Energy: 1.260744579715093
Energy: 1.2597322341279078
Energy: 1.2607714092910773
Energy: 1.2593663612335133
Energy: 1.4031303039160916
Energy: 1.5147887195277336
Energy: 1.2736198570260624
Energy: 1.514227274039073
Energy: 1.2572551043430973
Energy: 1.2726439095123274
Energy: 1.5152922230443904
Energy: 1.4762824961196497
Energy: 1.5145541314365631
Energy: 1.2595270827569363
Energy: 1.2589323431091117
Energy: 1.2592866454945288
Energy: 1.2591827415343346
Energy: 1.2589934465412875
Energy: 1.2579345363013517
Energy: 1.5129405411002401
Energy: 1.2568224501242542
Energy: 1.2566841424950175
Energy: 1.2565608418244747
Energy: 1.2573340193550162
Energy: 1.5131068137823507
Energy: 1.478631735052149
Energy: 1.5133663525991181
Energy: 1.2569190363562301
Energy: 1.2607626229589164
Energy: 1.2564631254309409
Energy: 1.2623631862817453
Energy: 1.5127264206008366
Energy: 1.4772204383109588
Energy: 1.5138483333817283
Energy: 1.2595040396504102
Energy: 1.2594549286456926
Energy: 1.2591784630200908
Energy: 1.2600618439642024
Energy: 1.258779735523231
Energy: 1.6431433127157118
Energy: 1.5146911119076771
Energy: 1.2718617953854037
Energy: 1.5150262765749627
Energy: 1.5128210278573613
Energy: 1.2708464154830383
Energy: 1.5147185685828664
Energy: 1.477879036307442
Energy: 1.5137479706362296
Energy: 1.260421940710708
Energy: 1.2592470595555565
Energy: 1.2600590675673073
Energy: 1.2597064219524203
Energy: 1.2592590740340674
Energy: 1.478557257760782
Energy: 1.5144636856122058
Energy: 1.2565451792698277
Energy: 1.2568772020894163
Energy: 1.2608694137998284
Energy: 1.2566530765767374
Energy: 1.5127150443323965
Energy: 1.2587072954193115
Energy: 1.5138033527111634
Energy: 1.2566818102918413
Energy: 1.2619163307387171
Energy: 1.2567079693506145
Energy: 1.2564102542094573
Energy: 1.5129653078276089
Energy: 1.4758913857014018
Energy: 1.5149193080303727
Energy: 1.2591063121313004
Energy: 1.2591833690276806
Energy: 1.2588275645017624
Energy: 1.2594103464786666
Energy: 1.258659309357737
Energy: 1.4040407084445485
Energy: 1.5145887475853237
Energy: 1.2722022374620692
Energy: 1.256865123019776
Energy: 1.2563953752628654
Energy: 1.2575711742329148
Energy: 1.5143598575174517
Energy: 1.4796777587264773
Energy: 1.5132340638508186
Energy: 1.2578042444704587
Energy: 1.2601385545146242
Energy: 1.260674272137723
Energy: 1.2607818668955963
Energy: 1.2597244524611286
Energy: 1.4803256648212297
Energy: 1.5134873664674307
Energy: 1.2606938011428124
Energy: 1.261340826869394
Energy: 1.2600945225009852
Energy: 1.2576735244034483
Energy: 1.2595958379266547
Energy: 1.4030384417596184
Energy: 1.5144753450702664
Energy: 1.2572146947769836
Energy: 1.2565967920369998
Energy: 1.2564756585656522
Energy: 1.2573192290588682
Energy: 1.5146120767365845
Energy: 1.475748861528974
Energy: 1.5143208768616356
Energy: 1.259258795587755
Energy: 1.2587409527874909
Energy: 1.2588649079684457
Energy: 1.259137082543551
Energy: 1.2587414758637288
Energy: 1.2574861087496745
Energy: 1.5133616042769815
Energy: 1.257188319084571
Energy: 1.256286177830125
Energy: 1.2631558418154827
Energy: 1.256667083803605
Energy: 1.5138973996182958

minimum gb energy = 1.256286177830125 eV
minimum distance =  2.39295126654237 Angstroms
sigma value = 23