Model name: model_name=EAM_Dynamo_MendelevKramerOtt_2009_CuZr__MO_600021860456_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.639085099101067
cohesive_energy=3.2833744382290693
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=[1.6525650891392998e-19, 2.0798976409597799e-19, 2.4851361769973997e-19, 2.83413831318162e-19, 3.1394971578556796e-19, 3.3924007395325803e-19, 3.60683606022714e-19, 3.8026060231356e-19, 3.9913904959198197e-19, 4.17573693942786e-19, 4.35237691332636e-19, 4.51512601580808e-19, 4.65839265042036e-19, 4.77964537808148e-19, 4.88035820129472e-19, 4.96532162819574e-19, 5.03874938333196e-19, 5.1016187944501195e-19, 5.1534812520927e-19, 5.19412847329728e-19, 5.224121219885759e-19, 5.2444848849039e-19, 5.256292926696479e-19, 5.260138150618079e-19, 5.25630894846282e-19, 5.24353960068984e-19, 5.21713572976152e-19, 5.1724029581402395e-19, 5.105624236035119e-19, 5.01306649188894e-19, 4.89117289357422e-19, 4.73717167551414e-19, 4.54998937936392e-19, 4.3300425710483994e-19, 4.07683457581104e-19, 3.7877698675047594e-19, 3.45722480614422e-19, 3.0754100924956794e-19, 2.62777796272242e-19, 2.0922664445742599e-19, 1.4343870838277158e-19, 6.110493399113579e-20, -4.4746390122669e-20, -1.89358052019192e-19, -4.0485401364545996e-19, -7.605612590429699e-19, -1.415377258065306e-18, -2.74755668788026e-18, -5.5916445179590196e-18, -1.1628261552478859e-17, -2.5767326151631798e-17, -6.40369172313558e-17, -1.9111243543342197e-16]
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: 0.012495500470318706
Energy: 0.012693986587252772
Energy: 0.7175293503719331
Energy: 0.10673280703414345
Energy: 0.012693986587252772
Energy: 1.014161757947844
Energy: 0.10673280703414345
Energy: 1.0141617579472249
Energy: 0.7175293503731366
Energy: 0.10673280703655044
Energy: 0.012495500470318706
Energy: 0.012693986587252772
Energy: 0.10673280703414345
Energy: 1.014161757947844
Energy: 0.012693986587252772
Energy: 1.0141617579472249

minimum gb energy = 0.012495500470318706 eV
minimum distance =  2.55324542514394 Angstroms
sigma value = 1


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

Energy: 1.2987638298170832
Energy: 0.8066590636658025
Energy: 0.8463265350516656
Energy: 0.8452867455138681
Energy: 0.8491269243850373
Energy: 0.8918512025204592
Energy: 0.8261774219917466
Energy: 0.8918512025197087
Energy: 0.8445831879054736
Energy: 0.8455456835898233
Energy: 1.4156506484203903
Energy: 0.8455456835890726
Energy: 0.8294061452868274
Energy: 0.8262853494339918
Energy: 0.8264064416067346
Energy: 0.826285349435493
Energy: 1.203025188616791
Energy: 0.8260813897848062
Energy: 0.8259917263994724
Energy: 0.8260813897840554
Energy: 0.8845933191525317
Energy: 0.9340174773923371
Energy: 0.8266003362991844
Energy: 0.9340174773930877
Energy: 0.8851741732836934
Energy: 0.9324016858282216
Energy: 1.2021989284882326
Energy: 0.9324016858289722
Energy: 0.8822806897137604
Energy: 0.8303164807736825
Energy: 0.9079770858837818
Energy: 0.8303164807736825
Energy: 1.02843883821287
Energy: 1.00884827032862
Energy: 0.9061780642198262
Energy: 1.0088482703256172
Energy: 0.9071865745503076
Energy: 0.9760385525035364
Energy: 0.9056787663880063
Energy: 0.9760385525035364
Energy: 0.9043234518897713
Energy: 1.0105639640101485
Energy: 1.028708840114599
Energy: 1.010563964008647
Energy: 0.8824705338850787
Energy: 1.0090511289614918
Energy: 0.9074397874265001
Energy: 1.0090511289607411
Energy: 0.9005856148305773
Energy: 0.9324683058828068
Energy: 0.9042871698165191
Energy: 0.9324683058850587
Energy: 0.8849107218201591
Energy: 0.9332144883849007
Energy: 0.8796879858734559
Energy: 0.9332144883849007
Energy: 0.8512159265522318
Energy: 0.8259240170664366
Energy: 0.8265382539676968
Energy: 0.8259240170664366
Energy: 0.8554899401386108
Energy: 0.8263881710431529
Energy: 0.8264723883031541
Energy: 0.8263881710446542
Energy: 0.8447784588335726
Energy: 0.8442321064850301
Energy: 0.8048570910522129
Energy: 0.8442321064857807
Energy: 0.8265184933592448
Energy: 0.8305310106138075
Energy: 0.8496337295972679
Energy: 0.8305310106145581
Energy: 0.8257672403198845
Energy: 0.8463149553611252
Energy: 0.8456307710500957
Energy: 0.8463149553618758
Energy: 0.8960751020627601
Energy: 0.8303610433338361
Energy: 0.8464777379730952
Energy: 0.8303610433345868
Energy: 0.826921352612931
Energy: 0.8264969587740172
Energy: 0.9042114196727287
Energy: 0.8264969587747678
Energy: 0.8269988936834447
Energy: 0.8272482980717379
Energy: 0.8846260737443998
Energy: 0.8272482980679847
Energy: 0.8827783951326088
Energy: 0.9325694871631747
Energy: 0.8840268455264875
Energy: 0.9325694871624242
Energy: 0.908341227395076
Energy: 0.9323799567448717
Energy: 0.8846039286649156
Energy: 0.9323799567456222
Energy: 0.9060689539137836
Energy: 1.0091051410914376
Energy: 1.0284822922236045
Energy: 1.0091051410914376
Energy: 0.9071155177875226
Energy: 1.0086108128996325
Energy: 0.9084583091522119
Energy: 1.0086108128981313
Energy: 1.0293162873945874
Energy: 1.0087086678580075
Energy: 0.9045911926332652
Energy: 1.0087086678587582
Energy: 0.9086859173645364
Energy: 1.008973190043363
Energy: 0.9066480703410853
Energy: 1.0089731900448642
Energy: 0.9042132303077036
Energy: 0.932998078300176
Energy: 0.9002492016933112
Energy: 0.932998078300176
Energy: 0.8799206428338778
Energy: 0.9326938491739498
Energy: 0.8849228036452961
Energy: 0.932693849171698
Energy: 0.8257869998450915
Energy: 0.8257396325124966
Energy: 0.8800785235980162
Energy: 0.8257396325117459
Energy: 0.8263114886608887
Energy: 0.8262495446946586
Energy: 0.8555125232065148
Energy: 0.8262495446946586
Energy: 0.8036638020761862
Energy: 0.8438735992473028
Energy: 0.8445142854736658
Energy: 0.8438735992495549

minimum gb energy = 0.8036638020761862 eV
minimum distance =  2.26859746382565 Angstroms
sigma value = 1


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

Energy: 1.4824389339632102
Energy: 0.8475125236952239
Energy: 0.8926781206844897
Energy: 0.8917482846380714
Energy: 0.927385635997957
Energy: 0.9399586816790163
Energy: 0.8721264121356571
Energy: 0.9399586816824398
Energy: 0.8911550864221727
Energy: 0.8917799460670823
Energy: 1.3570338740295789
Energy: 0.8917799460670823
Energy: 0.8764700455424743
Energy: 0.8723221640612662
Energy: 0.8719348666136707
Energy: 0.8723221640569869
Energy: 0.9044890980542594
Energy: 0.8726703168910803
Energy: 0.872682949430474
Energy: 0.872670316892792
Energy: 0.9404074537431619
Energy: 0.9330807869653402
Energy: 0.8723998114486083
Energy: 0.9330807869602051
Energy: 0.942191037602504
Energy: 0.9959157366536308
Energy: 1.1301754977675165
Energy: 0.995915736658766
Energy: 0.940740765813002
Energy: 0.9968632061421723
Energy: 0.9607733146441609
Energy: 0.9968632061413164
Energy: 0.9614069889146076
Energy: 1.0713136403268293
Energy: 0.9583448500181703
Energy: 1.07131364032255
Energy: 0.9603527136052501
Energy: 1.0426746043427506
Energy: 0.9408361444995416
Energy: 1.0426746043384714
Energy: 0.9563255492088233
Energy: 0.9961043241130058
Energy: 0.9671608604048865
Energy: 0.9961043241112941
Energy: 0.9329500306608514
Energy: 0.9966605416954797
Energy: 0.9404480993846267
Energy: 0.9966605416946237
Energy: 0.8734009256569641
Energy: 0.872370415749257
Energy: 0.9555293755712874
Energy: 0.8723704157484011
Energy: 0.872279501116719
Energy: 0.8725538826160106
Energy: 0.9029113568679914
Energy: 0.8725538826134431
Energy: 0.8449442128529734
Energy: 0.8907515413009828
Energy: 0.8914143848823896
Energy: 0.8907515413009828
Energy: 0.9006147020100376
Energy: 0.8764039512627814
Energy: 0.8914927599931645
Energy: 0.8764039512619255
Energy: 0.8925495962502811
Energy: 0.892695765271012
Energy: 0.9053358627065109
Energy: 0.8926957652693003
Energy: 0.892824059254938
Energy: 0.8781737503783892
Energy: 0.9487050474655224
Energy: 0.8781737503783892
Energy: 0.8718988786491304
Energy: 0.8724070923761819
Energy: 0.8731458595703173
Energy: 0.8724070923855576
Energy: 0.9406021673139845
Energy: 0.8720265806583637
Energy: 0.8726228831441935
Energy: 0.8720265806557961
Energy: 0.9402866362590014
Energy: 0.9961014966828186
Energy: 0.9386371157114479
Energy: 0.9961014966862419
Energy: 0.9410630926787893
Energy: 0.9960220860394686
Energy: 0.9616373447115822
Energy: 0.9960220860351893
Energy: 0.9602203813348276
Energy: 1.0721457319278693
Energy: 0.9034818019525102
Energy: 1.07214573192359
Energy: 0.9602281390860432
Energy: 1.0717828300784513
Energy: 0.9605747345355155
Energy: 1.0717828300793073
Energy: 0.9557971638671298
Energy: 0.9962529436684694
Energy: 0.9670800063282005
Energy: 0.9962529436667577
Energy: 0.933906008548474
Energy: 0.996377408736174
Energy: 0.940401819005472
Energy: 0.9963774087421651
Energy: 0.8724314841563503
Energy: 0.8721748547873236
Energy: 0.9334142401682382
Energy: 0.8721748547933147
Energy: 0.8723511316559038
Energy: 0.8726507843343867
Energy: 0.9030107734877503
Energy: 0.8726507843335308
Energy: 0.8431241188499105
Energy: 0.8905718843903792
Energy: 0.89119078055309
Energy: 0.8905718843886675

minimum gb energy = 0.8431241188499105 eV
minimum distance =  2.25907301844048 Angstroms
sigma value = 25


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

Energy: 1.4123254320567806
Energy: 0.8920185598061184
Energy: 0.942336599632239
Energy: 0.9417082021769733
Energy: 0.9808432548678255
Energy: 0.9922004403477053
Energy: 0.9261568334923708
Energy: 0.9922004403477053
Energy: 0.9419397257012562
Energy: 0.9415128023845235
Energy: 0.9256333293470651
Energy: 0.9415128023845235
Energy: 0.9435169840499018
Energy: 1.047100505943997
Energy: 0.9259349497694134
Energy: 1.0471005059469818
Energy: 0.960313576483522
Energy: 0.9256052817740994
Energy: 0.9271629785055029
Energy: 0.9256052817740994
Energy: 1.0064949580310554
Energy: 0.9955033235493629
Energy: 0.9255822066572607
Energy: 0.9955033235473729
Energy: 1.0079952600237214
Energy: 1.0728949284176663
Energy: 1.0054239828762752
Energy: 1.0728949284176663
Energy: 1.0063519888169634
Energy: 1.074221988787428
Energy: 1.0225228675283318
Energy: 1.074221988786433
Energy: 0.9320644081538817
Energy: 1.0728676100727317
Energy: 1.0201411074782412
Energy: 1.0728676100727317
Energy: 1.0062923475241663
Energy: 1.073238461845042
Energy: 0.9263812980449293
Energy: 1.073238461845042
Energy: 0.8860817782753164
Energy: 0.9257291969008141
Energy: 0.9255440381821809
Energy: 0.9257291969028039
Energy: 0.9547106605949476
Energy: 0.9260489013975619
Energy: 0.9259500338610671
Energy: 0.9260489013965669
Energy: 0.9411177266074899
Energy: 0.9413292702491953
Energy: 0.8862767367229165
Energy: 0.9413292702491953
Energy: 0.9413312291459435
Energy: 0.9323018184225894
Energy: 0.9646152357758402
Energy: 0.9323018184215944
Energy: 0.9251650619063355
Energy: 0.9428192700194591
Energy: 0.9438631132111439
Energy: 0.9428192700194591
Energy: 1.0093186757382486
Energy: 0.9325088997184522
Energy: 0.9422788572063936
Energy: 0.9325088997194472
Energy: 0.9257037915384853
Energy: 0.9258328267899053
Energy: 0.9607487497651518
Energy: 0.9258328267899053
Energy: 0.9255359215830268
Energy: 0.9259746095437105
Energy: 1.0066410641541217
Energy: 0.9259746095447053
Energy: 1.0512536233241632
Energy: 1.072920436417289
Energy: 1.0077943302505576
Energy: 1.0729204364182838
Energy: 1.0239365955087494
Energy: 1.073222797388814
Energy: 1.0069039030699205
Energy: 1.0732227973917987
Energy: 1.0199715657224593
Energy: 1.0726202088409167
Energy: 1.0531138129673834
Energy: 1.0726202088419117
Energy: 1.0203826215270746
Energy: 1.0727712354856067
Energy: 1.0062802022559545
Energy: 1.0727712354866017
Energy: 0.9264615843185339
Energy: 0.9259735577131014
Energy: 0.8867329619898041
Energy: 0.9259735577131014
Energy: 0.9256897260229984
Energy: 0.9258194353518167
Energy: 0.954877344223348
Energy: 0.9258194353508217
Energy: 0.8863420010946614
Energy: 0.9415345177976738
Energy: 0.9416986225824724
Energy: 0.9415345177976738

minimum gb energy = 0.8860817782753164 eV
minimum distance =  2.25415453654181 Angstroms
sigma value = 9


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

Energy: 1.3099011329791355
Energy: 0.9405570458963382
Energy: 0.9970976026930062
Energy: 0.9959892696015737
Energy: 1.0673132565589702
Energy: 1.0474990275891554
Energy: 0.9956160352998801
Energy: 1.0474990275903422
Energy: 0.9966261943216745
Energy: 0.9958414615112255
Energy: 1.0149217911232888
Energy: 0.9958414615100388
Energy: 0.9970986297716751
Energy: 1.1156402445935236
Energy: 0.9923093699161087
Energy: 1.1156402445935236
Energy: 1.0185401695283571
Energy: 0.9921220989972359
Energy: 0.9919728590824259
Energy: 0.9921220989972359
Energy: 1.0899586466114537
Energy: 0.9913879571911206
Energy: 0.9924219087183553
Energy: 0.9913879571934945
Energy: 1.049772361832021
Energy: 1.1359361566398112
Energy: 1.0219395324573648
Energy: 1.1359361566386244
Energy: 1.0216156486191101
Energy: 1.1376746801892494
Energy: 1.0899779845501958
Energy: 1.1376746801904363
Energy: 0.9914488503409171
Energy: 0.9925932028497734
Energy: 0.9298372604253393
Energy: 0.9925932028497734
Energy: 0.9924502372827799
Energy: 0.9923036349699375
Energy: 1.0144792030398226
Energy: 0.9923036349687504
Energy: 0.9295545392246939
Energy: 0.9951546573991141
Energy: 0.9955758021445301
Energy: 0.9951546573991141
Energy: 1.0672017754703358
Energy: 0.9983522694404587
Energy: 0.9958477134324093
Energy: 0.9983522694392718
Energy: 0.995402569429269
Energy: 0.9956329462765577
Energy: 0.9944743346532586
Energy: 0.9956329462765577
Energy: 0.995713615759133
Energy: 0.9973821102203635
Energy: 1.0830712621921772
Energy: 0.9973821102191767
Energy: 1.0183420100464453
Energy: 0.9918876355594926
Energy: 0.9917819981845274
Energy: 0.9918876355583056
Energy: 1.089942890697282
Energy: 0.9921786121799553
Energy: 0.9923543339041898
Energy: 0.9921786121799553
Energy: 1.0512284979056945
Energy: 1.1364504008377763
Energy: 1.0216127027210278
Energy: 1.1364504008377763
Energy: 1.0517682083229367
Energy: 1.135993318164822
Energy: 1.0905432872759844
Energy: 1.135993318163635
Energy: 0.9903817627266122
Energy: 0.9925657506249741
Energy: 0.9304871639365973
Energy: 0.9925657506237874
Energy: 0.9920746170214074
Energy: 0.9920857650577828
Energy: 0.9297706192439973
Energy: 0.9920857650577828
Energy: 0.929620063076332
Energy: 0.996236546150574
Energy: 0.9975419016570017
Energy: 0.996236546150574

minimum gb energy = 0.9295545392246939 eV
minimum distance =  2.25812337035822 Angstroms
sigma value = 25


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

Energy: 1.1751638257497223
Energy: 0.992330465945482
Energy: 1.0574274275493047
Energy: 1.0567290869826864
Energy: 1.0532030291816943
Energy: 1.0696337375082137
Energy: 1.0567528854950399
Energy: 1.069633737506746
Energy: 1.0571787160646253
Energy: 1.0564337079523949
Energy: 1.0551132363695648
Energy: 1.0564337079523949
Energy: 1.0577053743026663
Energy: 1.069384748288975
Energy: 1.011039333168536
Energy: 1.069384748288975
Energy: 1.074691782685151
Energy: 1.0814797918236951
Energy: 1.0767411811805554
Energy: 1.0814797918236951
Energy: 0.9843718896630868
Energy: 1.0817482729713774
Energy: 1.0108330652208137
Energy: 1.0817482729713774
Energy: 0.979192993602381
Energy: 1.0769863330639462
Energy: 1.0762281953971617
Energy: 1.0769863330639462
Energy: 0.9794069536396509
Energy: 1.1435100104487068
Energy: 1.0125108443866906
Energy: 1.1435100104487068
Energy: 1.0559452348424878
Energy: 1.0557858039335586
Energy: 1.1219619839149073
Energy: 1.0557858039350263
Energy: 1.0567179707722274
Energy: 0.9845601733433664
Energy: 1.1223362816141706
Energy: 0.9845601733433664
Energy: 1.1449215024901733
Energy: 1.0562514934580365
Energy: 1.0602704700646133
Energy: 1.0562514934580365
Energy: 1.0551714369644238
Energy: 1.059643197316352
Energy: 1.0564019578569184
Energy: 1.05964319731782
Energy: 1.0115448821408515
Energy: 1.1795163666958972
Energy: 1.0745377569978174
Energy: 1.1795163666973651
Energy: 1.077040674446413
Energy: 1.07824848657244
Energy: 1.056892493121262
Energy: 1.0782484865709723
Energy: 1.0788572757434287
Energy: 1.077991446962382
Energy: 1.159236137854552
Energy: 1.077991446962382
Energy: 1.011341699182434
Energy: 1.0777306241614506
Energy: 1.1600761714678747
Energy: 1.0777306241629185
Energy: 1.1261831331597842
Energy: 1.062412619134701
Energy: 1.0618419572849909
Energy: 1.062412619133233

minimum gb energy = 0.979192993602381 eV
minimum distance =  2.27342094108384 Angstroms
sigma value = 17


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

Energy: 1.5437069252837385
Energy: 1.0957645785283028
Energy: 1.1380265491786627
Energy: 1.1388535909745123
Energy: 1.089829456134684
Energy: 1.0593795082917203
Energy: 1.1573535045577117
Energy: 1.0593795082925517
Energy: 1.0597654766068727
Energy: 1.0590852876975572
Energy: 1.1436304031893694
Energy: 1.0590852876983887
Energy: 1.059971553595894
Energy: 1.0593029026918395
Energy: 1.0938569803924145
Energy: 1.0593029026935024
Energy: 1.1178420320213693
Energy: 1.1885552013537308
Energy: 1.1273512356817876
Energy: 1.1885552013537308
Energy: 1.0578890926427806
Energy: 1.190224865036743
Energy: 1.11708836523445
Energy: 1.190224865036743
Energy: 1.090605968342348
Energy: 1.0582435380216046
Energy: 1.0596485311838066
Energy: 1.0582435380216046
Energy: 1.199298955069688
Energy: 1.0580463724722806
Energy: 1.0591101148045374
Energy: 1.0580463724706182
Energy: 1.1412311702638356
Energy: 1.1395372455410822
Energy: 1.1406798563816964
Energy: 1.1395372455410822
Energy: 1.1469811056511439
Energy: 1.147453060978875
Energy: 1.1595022979678775
Energy: 1.1474530609780438
Energy: 1.116617745734746
Energy: 1.078240419302438
Energy: 1.0485444166527966
Energy: 1.0782404193007753
Energy: 1.1512099390462103
Energy: 1.0777494540961279
Energy: 1.0766083910256257
Energy: 1.0777494540969592
Energy: 1.0896200023752238
Energy: 1.07732700661666
Energy: 1.076479566476596
Energy: 1.0773270066183225
Energy: 1.0893660029647436
Energy: 1.077192819451075
Energy: 1.0459576280381457
Energy: 1.0771928194535687
Energy: 1.1507576777180055
Energy: 1.1415998321418896
Energy: 1.1818304460689624
Energy: 1.1415998321418896
Energy: 1.138606576822595
Energy: 1.139303775727687
Energy: 1.1824185695236051
Energy: 1.1393037757268558
Energy: 1.1388384636207916
Energy: 1.0585093903126803
Energy: 1.0577938976519978
Energy: 1.0585093903135117
Energy: 1.1386684781048215
Energy: 1.058920809467029
Energy: 1.057039461350541
Energy: 1.058920809467029
Energy: 1.0601760057973906
Energy: 1.1888566583261517
Energy: 1.1203528247408143
Energy: 1.1888566583269828
Energy: 1.1260896050439513
Energy: 1.1894460509845943
Energy: 1.1180982145390794
Energy: 1.189446050983763
Energy: 1.0584416927947338
Energy: 1.0583574267269453
Energy: 1.181979254607323
Energy: 1.058357426726114
Energy: 1.059166842192477
Energy: 1.0599291827328705
Energy: 1.0901764009081363
Energy: 1.059929182731208
Energy: 1.1565300868691044
Energy: 1.1491760086180551
Energy: 1.1379251403167479
Energy: 1.1491760086172238
Energy: 1.1414203806959615
Energy: 1.1390377944280683
Energy: 1.1375087873235832
Energy: 1.1390377944280683
Energy: 1.0455666196735345
Energy: 1.0768618734803752
Energy: 1.1506385023753938
Energy: 1.0768618734795818
Energy: 1.0765618438299445
Energy: 1.0776631810561195
Energy: 1.1179577386642108
Energy: 1.0776631810569508
Energy: 1.0448812013349429
Energy: 1.1356730495161436
Energy: 1.0908691882384116
Energy: 1.1356730495169751
Energy: 1.0774994472953692
Energy: 1.0779865067421541
Energy: 1.089410384737688
Energy: 1.0779865067429855
Energy: 1.0460038696241478
Energy: 1.0594280585983615
Energy: 1.0955010438088222
Energy: 1.0594280585950364
Energy: 1.1817963144973977
Energy: 1.1380239965449575
Energy: 1.1372540891870575
Energy: 1.1380239965441263

minimum gb energy = 1.0448812013349429 eV
minimum distance =  2.22875402802762 Angstroms
sigma value = 53


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

Energy: 1.4008005321991814
Energy: 1.0132854695780031
Energy: 1.1031648516068189
Energy: 1.1023674983886518
Energy: 1.1878656429781087
Energy: 1.106066602122625
Energy: 1.1031406675055575
Energy: 1.106066602122625
Energy: 1.1020543245589156
Energy: 1.1020389516385287
Energy: 1.098252359718345
Energy: 1.1020389516423563
Energy: 1.101739239953213
Energy: 1.0754670974919973
Energy: 1.1048755822825242
Energy: 1.0754670974881697
Energy: 1.1014184958119864
Energy: 1.074090204394225
Energy: 0.9965406941350786
Energy: 1.0740902043923113
Energy: 1.1049247335103114
Energy: 1.0753500793316877
Energy: 0.9964769133879094
Energy: 1.07535007932786
Energy: 1.1884087714652196
Energy: 1.1023296688488198
Energy: 1.1030429720903945
Energy: 1.1023296688507336
Energy: 1.1889732487995723
Energy: 1.1048077842208872
Energy: 1.1046602624682051
Energy: 1.1048077842208872
Energy: 1.1020536769340097
Energy: 1.1019300272316883
Energy: 1.0988393983719782
Energy: 1.1019300272278607
Energy: 1.104586705768377
Energy: 1.1054799225623606
Energy: 1.1022277950800083
Energy: 1.1054799225642744
Energy: 1.1025121330318897
Energy: 1.0765983363578682
Energy: 0.9965115245521019
Energy: 1.0765983363578682
Energy: 1.1034106856972183
Energy: 1.0739225663902396
Energy: 0.9964444036355773
Energy: 1.0739225663883258
Energy: 1.188657609435524
Energy: 1.1050773721585554
Energy: 1.1037227579067392
Energy: 1.1050773721604692

minimum gb energy = 0.9964444036355773 eV
minimum distance =  2.29134969540601 Angstroms
sigma value = 9


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

Energy: 1.3671469932309936
Energy: 1.1529924002302636
Energy: 1.2049810184971095
Energy: 1.2031859201581445
Energy: 1.0799362378405735
Energy: 1.0709147309110167
Energy: 1.2513143912230271
Energy: 1.0709147309117248
Energy: 1.0723427160264751
Energy: 1.0720228791327793
Energy: 1.2880655159170424
Energy: 1.072022879134904
Energy: 1.0741640499869907
Energy: 1.0717882077681364
Energy: 1.2060614522880662
Energy: 1.0717882077667198
Energy: 1.0734755321353218
Energy: 1.0708013554294213
Energy: 1.2432419567242947
Energy: 1.070801355428713
Energy: 1.0719896187959301
Energy: 1.0704190498224768
Energy: 1.2428656333440995
Energy: 1.0704190498224768
Energy: 1.2071589344073288
Energy: 1.1911051103025263
Energy: 1.2080500987673501
Energy: 1.1911051103018182
Energy: 1.2057127518722128
Energy: 1.1902601764343879
Energy: 1.190513195409645
Energy: 1.1902601764358045
Energy: 1.1024444739516999
Energy: 1.2064578364734104
Energy: 1.143596022178464
Energy: 1.2064578364748273
Energy: 1.0762363496891965
Energy: 1.1444488588793522
Energy: 1.1934981119122527
Energy: 1.1444488588772272
Energy: 1.0989781755259387
Energy: 1.0989936560271818
Energy: 1.1995591814739464
Energy: 1.0989936560278901
Energy: 1.100427614238944
Energy: 1.1548033971691156
Energy: 1.2431336201667742
Energy: 1.1548033971712406
Energy: 1.2051429429226161
Energy: 1.0996779701996027
Energy: 1.119867942461001
Energy: 1.0996779702017276
Energy: 1.2054726591539136
Energy: 1.100424149374874
Energy: 1.1018748628115123
Energy: 1.1004241493762907
Energy: 1.191135020187314
Energy: 1.1206729592979359
Energy: 1.1176786899001865
Energy: 1.1206729592979359
Energy: 1.2097744942753874
Energy: 1.2009704890606774
Energy: 1.1183176291395012
Energy: 1.2009704890606774
Energy: 1.191316158755829
Energy: 1.1645757876581102
Energy: 1.1016070639215565
Energy: 1.1645757876588185
Energy: 1.2029516161539067
Energy: 1.2010109136596285
Energy: 1.366708065712706
Energy: 1.2010109136596285
Energy: 1.2508622090917156
Energy: 1.1899452943997442
Energy: 1.079524653015056
Energy: 1.189945294397619
Energy: 1.2885169733783517
Energy: 1.0724831081439747
Energy: 1.0722347680146695
Energy: 1.0724831081411415
Energy: 1.2054710050398982
Energy: 1.0712624334700211
Energy: 1.071838712464082
Energy: 1.0712624334735628
Energy: 1.2429210120422076
Energy: 1.0703436468684957
Energy: 1.0713044316841207
Energy: 1.0703436468727456
Energy: 1.2432961629082937
Energy: 1.0706697416218025
Energy: 1.0722181730159754
Energy: 1.0706697416196775
Energy: 1.2086614890391512
Energy: 1.1904902857821906
Energy: 1.2055555993068934
Energy: 1.190490285782899
Energy: 1.1909257254341012
Energy: 1.1903565793340192
Energy: 1.2050219024542965
Energy: 1.1903565793347277
Energy: 1.1449322984374968
Energy: 1.2016721871495912
Energy: 1.1007795932259687
Energy: 1.2016721871453415
Energy: 1.1912366934656338
Energy: 1.1459200093103106
Energy: 1.075591863340213
Energy: 1.1459200093067692
Energy: 1.1995432430742463
Energy: 1.0993391341599674
Energy: 1.1001218131531498
Energy: 1.0993391341571341
Energy: 1.3652423679555223
Energy: 1.1038141433032573
Energy: 1.100605026306377
Energy: 1.1038141433032573
Energy: 1.1204908217016583
Energy: 1.0997311362668554
Energy: 1.204916220404867
Energy: 1.099731136268272
Energy: 1.1040432455300873
Energy: 1.101217100178257
Energy: 1.2374509827883908
Energy: 1.1012171001768403
Energy: 1.1006206071154383
Energy: 1.1003816974841187
Energy: 1.1919201288002759
Energy: 1.1003816974834102
Energy: 1.1199490815559383
Energy: 1.2043808265021068
Energy: 1.2105708136741413
Energy: 1.2043808265049398
Energy: 1.1005014882867803
Energy: 1.1654867175431247
Energy: 1.135356586202291
Energy: 1.1654867175431247
Energy: 1.3641593038259932
Energy: 1.1921637275173798
Energy: 1.2011991606252324
Energy: 1.192163727518088

minimum gb energy = 1.0703436468684957 eV
minimum distance =  2.28446571373366 Angstroms
sigma value = 73


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

Energy: 1.4401845704221146
Energy: 1.1275396382533793
Energy: 1.154375933980518
Energy: 1.1524230890684637
Energy: 1.0821447753163946
Energy: 1.2400324330672559
Energy: 1.1786914587803725
Energy: 1.240032433065008
Energy: 1.0856741734563813
Energy: 1.0865632691458469
Energy: 1.2511706047964137
Energy: 1.0865632691424756
Energy: 1.0856930707833718
Energy: 1.0862516594823028
Energy: 1.1785655241349462
Energy: 1.0862516594811789
Energy: 1.089837158318939
Energy: 1.089766329697639
Energy: 1.2388764827118932
Energy: 1.089766329697639
Energy: 1.1347205648048526
Energy: 1.2492608558098819
Energy: 1.2096711459084408
Energy: 1.2492608558110057
Energy: 1.1018548413557672
Energy: 1.1850605191809658
Energy: 1.2092513640631375
Energy: 1.185060519179842
Energy: 1.1690432044225925
Energy: 1.1838698191011308
Energy: 1.1821850916459118
Energy: 1.1838698191033785
Energy: 1.1142778432518325
Energy: 1.2484114505726343
Energy: 1.1826123381291787
Energy: 1.2484114505715103
Energy: 1.138119829057868
Energy: 1.2573242234857633
Energy: 1.1828315505059614
Energy: 1.2573242234846393
Energy: 1.1147348826447434
Energy: 1.0583522670729992
Energy: 1.0585282911534082
Energy: 1.0583522670729992
Energy: 1.1160106224197595
Energy: 1.0588095903588872
Energy: 1.3045956878107212
Energy: 1.0588095903600108
Energy: 1.1821752166753847
Energy: 1.121730826637641
Energy: 1.1158856904446925
Energy: 1.121730826637641
Energy: 1.1821069187198485
Energy: 1.1215352834671684
Energy: 1.117609311284834
Energy: 1.1215352834682921
Energy: 1.195009020047412
Energy: 1.1116682626238832
Energy: 1.1129246903273053
Energy: 1.1116682626238832
Energy: 1.2395506453905687
Energy: 1.1141513487048857
Energy: 1.1124305305276831
Energy: 1.114151348703762
Energy: 1.2102901847552099
Energy: 1.2703596208597485
Energy: 1.113949315676128
Energy: 1.270359620858625
Energy: 1.1887836357547654
Energy: 1.188791270127658
Energy: 1.1013071559262615
Energy: 1.188791270127658
Energy: 1.1608691485704556
Energy: 1.1643380887972938
Energy: 1.101344288152382
Energy: 1.1643380887961698
Energy: 1.2093376688901678
Energy: 1.1843040264850624
Energy: 1.1532473395784406
Energy: 1.1843040264850624
Energy: 1.160484387396553
Energy: 1.2774742901110137
Energy: 1.1409166477251322
Energy: 1.2774742901110137
Energy: 1.21115305366198
Energy: 1.1525642280246347
Energy: 1.152364944465856
Energy: 1.1525642280280062

minimum gb energy = 1.0583522670729992 eV
minimum distance =  2.27418462875466 Angstroms
sigma value = 7


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

Energy: 1.6454281164398112
Energy: 1.1070965214283106
Energy: 1.1896516251246578
Energy: 1.1895826928779178
Energy: 1.0714013391690158
Energy: 1.146925611141017
Energy: 1.2276652490021935
Energy: 1.1469256111441959
Energy: 1.0955855788167188
Energy: 1.2355078678791076
Energy: 1.183836985069697
Energy: 1.2355078678822862
Energy: 1.0906602068126108
Energy: 1.0895763029258356
Energy: 1.227009614588566
Energy: 1.0895763029210674
Energy: 1.0814337299495604
Energy: 1.0804486328699772
Energy: 1.2041987895237602
Energy: 1.080448632872361
Energy: 1.0912408600849672
Energy: 1.07979665854969
Energy: 1.2042015443274756
Energy: 1.0797966585465115
Energy: 1.2254941008703217
Energy: 1.0808969520262612
Energy: 1.0914655473161579
Energy: 1.0808969520350025
Energy: 1.2258016629999215
Energy: 1.0797346940409047
Energy: 1.078130930750948
Energy: 1.0797346940401102
Energy: 1.2281629965725185
Energy: 1.0885040477682992
Energy: 1.0891111375042262
Energy: 1.0885040477770043
Energy: 1.2644011176519128
Energy: 1.2350185894276633
Energy: 1.082464656282756
Energy: 1.2350185894221006
Energy: 1.2271839148069037
Energy: 1.1477294535433387
Energy: 1.157647934151382
Energy: 1.1477294535401599
Energy: 1.1493078999026654
Energy: 1.1496678465494308
Energy: 1.1667887198364328
Energy: 1.1496678465534043
Energy: 1.1487904796733763
Energy: 1.1502295145259689
Energy: 1.1477462828750022
Energy: 1.1502295145267634
Energy: 1.164678807710317
Energy: 1.1679661542415978
Energy: 1.1065627290328965
Energy: 1.167966154250339
Energy: 1.1483796450657273
Energy: 1.1523136786018975
Energy: 1.086034323720769
Energy: 1.152313678601103
Energy: 1.0841665111373762
Energy: 1.1482790081888747
Energy: 1.147251639881028
Energy: 1.1482790081872853
Energy: 1.0884313092668818
Energy: 1.1465011259343716
Energy: 1.2273568426063979
Energy: 1.1465011259303983
Energy: 1.0823372786407846
Energy: 1.2403397222342867
Energy: 1.1827632733447127
Energy: 1.240339722235876
Energy: 1.087077276265564
Energy: 1.0888724099562035
Energy: 1.2283439055915892
Energy: 1.0888724099585874
Energy: 1.0799801776579079
Energy: 1.0794591556009843
Energy: 1.0854596968158507
Energy: 1.0794591555954218
Energy: 1.0915404471356829
Energy: 1.0808650773236932
Energy: 1.2038919259314533
Energy: 1.0808650773236932
Energy: 1.2258977942107254
Energy: 1.0800196013562577
Energy: 1.1581328235130508
Energy: 1.0800196013514898
Energy: 1.2257599485349122
Energy: 1.0806226174481983
Energy: 1.0814927583071061
Energy: 1.0806226174513769
Energy: 1.2275266618533671
Energy: 1.089661631476584
Energy: 1.0901256672109298
Energy: 1.0896616314757894
Energy: 1.2658196350972464
Energy: 1.0910294067931687
Energy: 1.095869298165665
Energy: 1.0910294067963473
Energy: 1.2067415913155835
Energy: 1.1467718962010092
Energy: 1.0801956078896229
Energy: 1.14677189619942
Energy: 1.1476997318405926
Energy: 1.1481619336012716
Energy: 1.453572749421366
Energy: 1.1481619336020663
Energy: 1.1462667048467459
Energy: 1.147624191060736
Energy: 1.0807302278518847
Energy: 1.147624191054379
Energy: 1.186298144631708
Energy: 1.1701821249822653
Energy: 1.148008718620389
Energy: 1.1701821249798814
Energy: 1.1466919071692703
Energy: 1.188051189413068
Energy: 1.1064229090796238
Energy: 1.1880511894146573
Energy: 1.0843174648772078
Energy: 1.1471298031520392
Energy: 1.1490897244083416
Energy: 1.14712980315045

minimum gb energy = 1.0714013391690158 eV
minimum distance =  2.27868757428879 Angstroms
sigma value = 29


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

Energy: 1.0183516920062123
Energy: 1.0197605281641375
Energy: 1.1113637363711146
Energy: 1.1989453687134937
Energy: 1.0164728707547364
Energy: 1.1040833623660504
Energy: 1.0291242119657675
Energy: 1.1040833623657735
Energy: 1.0282874663733512
Energy: 1.113078855615941
Energy: 1.018687018849532
Energy: 1.1130788556164641
Energy: 1.0165137323396711
Energy: 1.0305726025443174
Energy: 1.027372882043834
Energy: 1.0305726025440405
Energy: 1.0267275173818011
Energy: 1.0271902303900036
Energy: 1.0165976516590274
Energy: 1.0271902303900036
Energy: 1.026905024261202
Energy: 1.107093945734193
Energy: 1.0165541788438068
Energy: 1.10709394573447
Energy: 1.019373817968314
Energy: 1.1123021253431105
Energy: 1.0272754154036687
Energy: 1.1123021253428333
Energy: 1.0290632791741705
Energy: 1.0258100398771397
Energy: 1.0167760266507428
Energy: 1.0258100398763401
Energy: 1.015999739827906
Energy: 1.0256112160541633
Energy: 1.024475608101156
Energy: 1.02561121605361

minimum gb energy = 1.015999739827906 eV
minimum distance =  2.25081047910002 Angstroms
sigma value = 5


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

Energy: 1.3050373939210602
Energy: 0.9679814148023039
Energy: 1.1359803401377773
Energy: 0.9897592692478949
Energy: 1.0094957142004257
Energy: 1.0085852530742259
Energy: 1.1413543686124428
Energy: 1.0085852530771942
Energy: 1.138647451288955
Energy: 1.0754899197114016
Energy: 1.130057005755089
Energy: 1.0754899197114016
Energy: 1.008879970436187
Energy: 0.9892149818430189
Energy: 1.137829041148003
Energy: 0.9892149818437695
Energy: 1.1348759600362226
Energy: 0.9948363573224394
Energy: 1.1252072547391827
Energy: 0.9948363573224394
Energy: 1.004655565217213
Energy: 1.0052297279583113
Energy: 1.1259407049146588
Energy: 1.0052297279590618
Energy: 0.9889990989442486
Energy: 0.9889386032763919
Energy: 1.1381717730020442
Energy: 0.9889386032756413
Energy: 1.009242442063203
Energy: 0.9969533490692554
Energy: 1.2345207934246365
Energy: 0.9969533490707567
Energy: 1.0254390474478914
Energy: 1.02962338328229
Energy: 1.2360945311852938
Energy: 1.02962338328229
Energy: 1.155921126344914
Energy: 0.9717247730369749
Energy: 0.9711164526702903
Energy: 0.9717247730354736
Energy: 1.0234359527495054
Energy: 0.9717726210625792
Energy: 0.9708177660068031
Energy: 0.97177262106333
Energy: 1.2376535694157158
Energy: 0.9715987669549425
Energy: 0.9736044750774109
Energy: 0.9715987669549425
Energy: 1.2310441637479235
Energy: 0.9717273963148759
Energy: 0.9735627102172828
Energy: 0.971727396312624
Energy: 0.9944938555176592
Energy: 1.0313566215943804
Energy: 1.1270201016649617
Energy: 1.0313566215943804
Energy: 1.0061441559858584
Energy: 0.9890448253478435
Energy: 1.1373109890451145
Energy: 0.9890448253470929
Energy: 1.008762695911739
Energy: 1.0054667704340796
Energy: 1.1231529757465057
Energy: 1.0054667704340796
Energy: 0.9878055050815896
Energy: 0.9894219052723976
Energy: 1.0079363376809463
Energy: 0.9894219052708962
Energy: 1.1404831771343
Energy: 1.0091749150455005
Energy: 1.0088760987932317
Energy: 1.009174915043999
Energy: 1.1319162581437572
Energy: 1.0733917485633
Energy: 1.139102814136393
Energy: 1.0733917485633
Energy: 1.1380105882070564
Energy: 1.2510882419245024
Energy: 1.0075788413388782
Energy: 1.2510882412807585
Energy: 1.1264499384430096
Energy: 1.0068476869545357
Energy: 1.1352718434141713
Energy: 1.0068476869575382
Energy: 1.1252756978977654
Energy: 0.9942786710343497
Energy: 0.9910098994633026
Energy: 0.9942786710328485
Energy: 1.1384476850609937
Energy: 0.9894241181507492
Energy: 0.9923419368946116
Energy: 0.9894241181530011
Energy: 1.2330112918492402
Energy: 0.9964950856371809
Energy: 1.0073730458565067
Energy: 0.9964950856379315
Energy: 1.2366659992423061
Energy: 1.028659143692751
Energy: 1.0235522323534645
Energy: 1.028659143690499
Energy: 0.9718554623067669
Energy: 0.9710932557002476
Energy: 1.1557987550662312
Energy: 0.9710932557009982
Energy: 0.9715120213603672
Energy: 0.9718568117736909
Energy: 1.0248871251730627
Energy: 0.9718568117744415
Energy: 0.971536104571499
Energy: 0.9707679546241121
Energy: 1.0440066552609082
Energy: 0.9707679546248627
Energy: 0.973450909464155
Energy: 0.9711196322986488
Energy: 1.2321348325712977
Energy: 0.9711196322993996
Energy: 1.1372981739571395
Energy: 1.030124670049949
Energy: 1.011330721930077
Energy: 1.0301246700506996
Energy: 1.1269124542163085
Energy: 0.993194313467389
Energy: 1.0073697378255182
Energy: 0.9931943134666384
Energy: 1.124236419583308
Energy: 0.9944311400108468
Energy: 1.0079579638267648
Energy: 0.9944311400115974
Energy: 1.0108187235011208
Energy: 0.9893185600578458
Energy: 0.9882914336464147
Energy: 0.9893185600593128

minimum gb energy = 0.9679814148023039 eV
minimum distance =  2.21456696697091 Angstroms
sigma value = 1


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

Energy: 1.370018381916788
Energy: 0.9180536233103195
Energy: 1.1061345679757324
Energy: 0.9394467876145787
Energy: 0.9555866686470218
Energy: 0.9556118895173961
Energy: 1.1424000456829984
Energy: 0.955611889518434
Energy: 1.139674842892027
Energy: 1.050334857305606
Energy: 1.1278315236785923
Energy: 1.0503348573097575
Energy: 0.9567506922811596
Energy: 1.0457312511300287
Energy: 1.1202975170312361
Energy: 1.0457312511310666
Energy: 0.9399740931835457
Energy: 0.9398836770504959
Energy: 1.1231051081204864
Energy: 0.9398836770504959
Energy: 0.9396401578589448
Energy: 0.9416413475229861
Energy: 1.1238277968373258
Energy: 0.9416413475209103
Energy: 0.9366351334688636
Energy: 0.937181704175449
Energy: 1.1215536784008016
Energy: 0.9371817041775249
Energy: 0.9595094426322925
Energy: 0.9530137578987746
Energy: 1.275984404753023
Energy: 0.9530137578987746
Energy: 1.1386877773856492
Energy: 0.9963694151393695
Energy: 1.274918338806779
Energy: 0.9963694151372938
Energy: 1.1627878128732856
Energy: 0.9592295041929725
Energy: 0.9557195627002852
Energy: 0.9592295041991998
Energy: 1.1351081508738035
Energy: 0.9370598473100351
Energy: 0.9358482796480685
Energy: 0.9370598473121108
Energy: 1.2716108203809342
Energy: 0.942759424641983
Energy: 0.9419566075887377
Energy: 0.9427594246399073
Energy: 1.2723368465804519
Energy: 0.9383845041987594
Energy: 0.9412095400691496
Energy: 0.9383845042070625
Energy: 1.1196241447899102
Energy: 0.9405020761268033
Energy: 1.1276757703880047
Energy: 0.9405020761319928
Energy: 0.9558525016714098
Energy: 1.0452442523351408
Energy: 1.1415538942378278
Energy: 1.0452442523382546
Energy: 0.9567886788825394
Energy: 0.9413527906819827
Energy: 1.1215741632991143
Energy: 0.9413527906788691
Energy: 0.9404772469771374
Energy: 0.9381998048083875
Energy: 1.122611581501578
Energy: 0.9381998048083875
Energy: 0.9598376836709979
Energy: 0.9567968435022045
Energy: 1.1163653699631997
Energy: 0.9567968434980767
Energy: 0.9365470368279657
Energy: 0.9372887223644645
Energy: 1.275733846046453
Energy: 0.9372887223582372
Energy: 0.9419548007057145
Energy: 0.9446278322998416
Energy: 1.275411335503958
Energy: 0.9445801513628085
Energy: 1.1229229920948587
Energy: 0.9975787489996071
Energy: 1.1218350437406845
Energy: 0.9975787490027207
Energy: 1.1227662374779253
Energy: 0.941967677921525
Energy: 0.9578600367526748
Energy: 0.9419676779236009
Energy: 1.1215734058085176
Energy: 0.939616981469073
Energy: 0.942021163117859
Energy: 0.9396169814711489
Energy: 1.2722575719352334
Energy: 0.9383345552560367
Energy: 0.9376856322493552
Energy: 0.9383345552601882

minimum gb energy = 0.9180536233103195 eV
minimum distance =  2.22086735971415 Angstroms
sigma value = 17


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

Energy: 1.4464159734431754
Energy: 0.9069125911958941
Energy: 1.1041088395985055
Energy: 0.922092418682536
Energy: 0.9322776737690149
Energy: 0.9254598335862289
Energy: 1.0406036664415241
Energy: 0.9254598335849459
Energy: 1.1413899603453854
Energy: 0.9182021291971998
Energy: 1.0437908509247484
Energy: 0.9182021291952753
Energy: 1.136924872863113
Energy: 0.9749829241543727
Energy: 1.0334534210708155
Energy: 0.9749829241562972
Energy: 1.0206329824130278
Energy: 0.9062968876893116
Energy: 1.2402516512423072
Energy: 0.9062968876886701
Energy: 0.908985944347635
Energy: 0.9058114691255083
Energy: 1.2425469973408174
Energy: 0.9058114691267911
Energy: 0.9108077195811943
Energy: 0.9065987989168746
Energy: 1.0338116227917693
Energy: 0.9065987989187991
Energy: 0.9146464238432954
Energy: 0.9112307830670913
Energy: 1.3325326936056272
Energy: 0.9112307830696572
Energy: 1.2397916492003356
Energy: 0.9063281648438231
Energy: 1.1418523513222811
Energy: 0.9063281648463891
Energy: 1.0549368465847762
Energy: 0.9768397086825086
Energy: 1.035588282393746
Energy: 0.9768397086799426
Energy: 1.2381641666397558
Energy: 1.136482215795965
Energy: 0.9282142088752628
Energy: 1.136482215420864
Energy: 1.2392696985766842
Energy: 0.9198130231343586
Energy: 1.0342975291790024
Energy: 0.9198130231356416
Energy: 1.2335697067861213
Energy: 0.9173851939541572
Energy: 0.9170106311984556
Energy: 0.9173851939547986
Energy: 1.0701743580755751
Energy: 0.919085199223946
Energy: 0.9186227784710845
Energy: 0.9190851992226631
Energy: 1.164528387539756
Energy: 0.922536439739683
Energy: 0.9283964709199412
Energy: 0.9225364397384583
Energy: 1.3386539801462154
Energy: 0.9184312061389218
Energy: 1.07343935827851
Energy: 0.9184312061389218
Energy: 0.9180024759529866
Energy: 0.9268591770897487
Energy: 1.23445421384006
Energy: 0.9266764697627587
Energy: 0.9181470794318183
Energy: 0.9175936563584738
Energy: 1.2384459393896263
Energy: 0.9175936563603984
Energy: 0.9214926432969212
Energy: 0.9302559618124199
Energy: 1.1383353263558735
Energy: 0.9302559618156273
Energy: 0.9203893834657446
Energy: 0.9177917956111721
Energy: 1.332230886032868
Energy: 0.9177917956098892
Energy: 1.0403377335136852
Energy: 0.9213187616783872
Energy: 1.0227947206411945
Energy: 0.9213187616764628
Energy: 1.0423631366309816
Energy: 0.9181417545652087
Energy: 1.1431277547575944
Energy: 0.9181417545626428
Energy: 1.0341975791530482
Energy: 0.97276934692016
Energy: 1.1486051472875414
Energy: 0.97276934692016
Energy: 1.2334951962602525
Energy: 0.9098625509185331
Energy: 1.02068775248996
Energy: 0.9098625509178915
Energy: 1.2399905670704534
Energy: 0.9049992508868294
Energy: 0.9052106204369874
Energy: 0.9049992508874708
Energy: 1.0343278709605468
Energy: 0.9084038388016231
Energy: 0.9124137931345634
Energy: 0.9084038388035476
Energy: 1.3326826545252448
Energy: 0.9111387039702284
Energy: 0.909334193545458
Energy: 0.9111387039695868
Energy: 1.1390594400663572
Energy: 0.9110301330376958
Energy: 1.2424658412827259
Energy: 0.9110301330383374
Energy: 1.0402529314179199
Energy: 0.9750005708647952
Energy: 1.0426664661294678
Energy: 0.9750005708628706
Energy: 0.929412027182387
Energy: 1.1551614607491147
Energy: 1.2366914178688129
Energy: 1.1551614584426992
Energy: 1.032964285022008
Energy: 0.9182940496023596
Energy: 1.2419195111374741
Energy: 0.9182940496023596
Energy: 0.9168005607900479
Energy: 0.918262608627667
Energy: 1.2432792689016638
Energy: 0.9182626086283084
Energy: 0.9179752209549188
Energy: 0.9175725394529155
Energy: 1.1338112265673908
Energy: 0.917572539453557
Energy: 0.9271703508221801
Energy: 0.9273640740851289
Energy: 1.1354952881185
Energy: 0.9273640740838458
Energy: 1.1789716259550647
Energy: 0.9175455486927209
Energy: 1.338722074219025
Energy: 0.9175455486907964
Energy: 1.3143932000433207
Energy: 0.9254488034082747
Energy: 0.9193632782989132
Energy: 0.9254488034082747
Energy: 1.237514309780335
Energy: 0.9172599953977418
Energy: 0.9175919163414974
Energy: 0.9172599953983831
Energy: 1.1408497434896798
Energy: 0.9205556592348795
Energy: 0.9193041046512083
Energy: 0.920555659234238

minimum gb energy = 0.9049992508868294 eV
minimum distance =  2.22171607507629 Angstroms
sigma value = 89


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

Energy: 1.5093769529541972
Energy: 0.8629993016288839
Energy: 0.8305659446291036
Energy: 0.8316291833709227
Energy: 0.8227021389161304
Energy: 0.9198964231103132
Energy: 0.8298823158355759
Energy: 0.9198964231086345
Energy: 0.8226737327738171
Energy: 0.9199352192143618
Energy: 0.8511346510910044
Energy: 0.9199352192143618
Energy: 0.8236321478598158
Energy: 0.9127577870740495
Energy: 0.8292370945844036
Energy: 0.9127577870740495
Energy: 0.8287456527846837
Energy: 0.8296574238459353
Energy: 1.1063616972449701
Energy: 0.8296574238459353
Energy: 0.8303013907969743
Energy: 0.8282762795704847
Energy: 1.1065443062388078
Energy: 0.8282762795704847
Energy: 0.8289821610045199
Energy: 0.8277161733184538
Energy: 0.8306652486206412
Energy: 0.8277161733184538
Energy: 0.8280395218653638
Energy: 0.8286840858963115
Energy: 0.8246041440368649
Energy: 0.8286840858963115
Energy: 0.8295888044963722
Energy: 0.8277894744275861
Energy: 0.8290503547397433
Energy: 0.8277894744275861
Energy: 0.8516927848081745
Energy: 0.9354961459667874
Energy: 0.830406633561146
Energy: 0.9354961459667874
Energy: 0.8310153495946903
Energy: 0.9103573601070973
Energy: 0.8215886964320971
Energy: 0.9103573601087757
Energy: 1.107172569919427
Energy: 0.8276857787866128
Energy: 0.8291535353471384
Energy: 0.8276857787866128
Energy: 1.1071097280007063
Energy: 0.8295535441096911
Energy: 0.8290619999073278
Energy: 0.8295535441096911
Energy: 0.8296089429250992
Energy: 0.8271134841339544
Energy: 0.8267053138924263
Energy: 0.8271134841339544
Energy: 0.8277741391232292
Energy: 0.8295777495833184
Energy: 0.8302088196769162
Energy: 0.8295777495833184

minimum gb energy = 0.8215886964320971 eV
minimum distance =  2.25941348997303 Angstroms
sigma value = 13


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

Energy: 1.3296156871682583
Energy: 0.7824743341942823
Energy: 1.0190117745635094
Energy: 0.7839093070846282
Energy: 1.2054117706346308
Energy: 0.7829240425736425
Energy: 0.9219121327706026
Energy: 0.7829240425687177
Energy: 1.2637749061623271
Energy: 0.7819979164473254
Energy: 0.9159187151938887
Energy: 0.781997916433255
Energy: 1.0471531714935725
Energy: 0.785264643111143
Energy: 0.9090248223569817
Energy: 0.7852646431160675
Energy: 1.076030116679383
Energy: 0.7836187231471228
Energy: 1.155875947516283
Energy: 0.7836187231464192
Energy: 0.9077752762602864
Energy: 0.7833942477376191
Energy: 1.15514340845045
Energy: 0.7833942477305839
Energy: 0.9159139759552758
Energy: 0.7824007624921331
Energy: 1.072801773217252
Energy: 0.7824007624886155
Energy: 0.9078588574988656
Energy: 0.7856306313573654
Energy: 1.1473339158293725
Energy: 0.7856306313510337
Energy: 0.8032947244669219
Energy: 0.7853196756122117
Energy: 1.150164636075996
Energy: 0.7853196756122117
Energy: 0.7814286475421246
Energy: 0.7826383246166478
Energy: 1.1512114185410371
Energy: 0.7826383246201655
Energy: 0.7842632362155705
Energy: 0.7883289083221032
Energy: 1.330120236829178
Energy: 0.7883289083059223
Energy: 1.144722735241229
Energy: 0.8365138591811973
Energy: 1.0726929609454492
Energy: 0.8365138591882325
Energy: 1.1583567416178966
Energy: 0.835428037803673
Energy: 1.1431329374490522
Energy: 0.8354280377980449
Energy: 1.1499022824075187
Energy: 0.8381760030332025
Energy: 1.044864335927541
Energy: 0.8381760030219462
Energy: 1.1500272453457925
Energy: 0.7843143150062681
Energy: 1.073721019848093
Energy: 0.7843143149964189
Energy: 1.1564661782864858
Energy: 0.7826982301021116
Energy: 0.7856779555173913
Energy: 0.7826982300992976
Energy: 1.1484825169904975
Energy: 0.7827186791461427
Energy: 0.7830416506315943
Energy: 0.7827186791496602
Energy: 1.269641521264792
Energy: 0.7841282636742567
Energy: 0.7885902590251923
Energy: 0.7841282636763673
Energy: 1.0203953970709918
Energy: 0.8020352733177961
Energy: 0.9026253555808857
Energy: 0.8020352733170927
Energy: 1.1511414088600949
Energy: 0.7814091163748706
Energy: 0.915447248329526
Energy: 0.7814091163847199
Energy: 1.0436350806206172
Energy: 0.7855114933472508
Energy: 0.9053692358210762
Energy: 0.7855114933571001
Energy: 1.0796630525915403
Energy: 0.7820933060261167
Energy: 1.1547178880663744
Energy: 0.782093306022631
Energy: 0.9221271433520473
Energy: 0.7847708014412496
Energy: 1.1563070000993778
Energy: 0.7847708014292898
Energy: 0.7850362782951107
Energy: 0.781623385279144
Energy: 1.075148925021519
Energy: 0.7816233852721088
Energy: 0.9060612021359464
Energy: 0.7829851593250166
Energy: 1.3610477414056337
Energy: 0.7829851593285342
Energy: 0.7835010449959361
Energy: 0.7814515060750165
Energy: 1.3585422969675527
Energy: 0.7814515060792376
Energy: 0.7820552759612779
Energy: 0.781505514728652
Energy: 1.0786857493582496
Energy: 0.781505514725838
Energy: 0.8040275722039153
Energy: 0.7856538175289404
Energy: 1.2696544341546594
Energy: 0.78565381752683
Energy: 1.1436363138278738
Energy: 0.7819683010900251
Energy: 1.0204508574254256
Energy: 0.7819683010808793
Energy: 0.9151585020972236
Energy: 0.8388427016047844
Energy: 1.1448922394746608
Energy: 0.838842701606895
Energy: 1.1480179477149828
Energy: 1.015153491528982
Energy: 1.0439958975115238
Energy: 1.0110661192225836
Energy: 1.1555283578950195
Energy: 0.7827194504675852
Energy: 1.0740073960830134
Energy: 0.7827194504605499
Energy: 1.1499481714504058
Energy: 0.7848066553669112
Energy: 0.8047881187212687
Energy: 0.784806655355655
Energy: 1.073968062633995
Energy: 0.7816832301625372
Energy: 0.7825368816581145
Energy: 0.7816832301723865
Energy: 1.0195509860196836
Energy: 0.7833592793582479
Energy: 0.7844484593665175
Energy: 0.7833592793575443

minimum gb energy = 0.7814091163748706 eV
minimum distance =  2.25543583470417 Angstroms
sigma value = 37


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

Energy: 1.1585225340316254
Energy: 0.7131393119734183
Energy: 0.7107748837311534
Energy: 0.7120306309452057
Energy: 1.1306944981986247
Energy: 0.7108887362362769
Energy: 0.9215294731545162
Energy: 0.7108887362362769
Energy: 1.1316377907708726
Energy: 0.7102671978018644
Energy: 0.924852147969788
Energy: 0.7102671978018644
Energy: 1.1304189297465372
Energy: 0.8073521630841766
Energy: 0.9225762202268142
Energy: 0.8073521630829661
Energy: 1.15212476278578
Energy: 0.8056256522200391
Energy: 0.9207673229958386
Energy: 0.8056256522188288
Energy: 0.8361989055327687
Energy: 0.7101882015674129
Energy: 1.0931621284643112
Energy: 0.7101882015674129
Energy: 0.7067634562998785
Energy: 0.7099567178416046
Energy: 1.1529224610391606
Energy: 0.7099567178403942
Energy: 0.7209312691857019
Energy: 0.7104761686498619
Energy: 1.144399293092354
Energy: 0.7104761686498619
Energy: 0.710682385520339
Energy: 0.7103430132646235
Energy: 1.2939744996971991
Energy: 0.7103430132646235
Energy: 0.7095099351860401
Energy: 0.7124808693999036
Energy: 1.165099510768007
Energy: 0.7124808693999036
Energy: 0.7107748837589645
Energy: 0.7120306309209983
Energy: 1.1585225340292047
Energy: 0.713139311972208
Energy: 0.9215294731533058
Energy: 0.7108887362362769
Energy: 1.2322965190999087
Energy: 0.7108887362374873
Energy: 0.9248521479685776
Energy: 0.7102671978030748
Energy: 1.1316377907708726
Energy: 0.7102671978018644
Energy: 0.9225762202268142
Energy: 0.8073521630853868
Energy: 1.1304189297441163
Energy: 0.8073521630841766
Energy: 0.9207673229970491
Energy: 0.8056256522188288
Energy: 1.15212476278578
Energy: 0.8056256522188288
Energy: 1.0723029141036675
Energy: 0.7101882015674129
Energy: 0.7069077565516245
Energy: 0.7101882015674129
Energy: 1.15292246103795
Energy: 0.709956717842815
Energy: 0.7067634562974576
Energy: 0.7099567178416046
Energy: 1.144399293092354
Energy: 0.7104761686498619
Energy: 0.7209312691869123
Energy: 0.7104761686486514
Energy: 1.2939744996971991
Energy: 0.7103430132658336
Energy: 0.710682385520339
Energy: 0.7103430132646235
Energy: 1.1306944981127154
Energy: 0.7124808693986932
Energy: 0.7095099351860401
Energy: 0.7124808693999036

minimum gb energy = 0.7067634562974576 eV
minimum distance =  2.26588558791263 Angstroms
sigma value = 25


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

Energy: 1.3619608564905692
Energy: 0.6630454015199841
Energy: 0.6332436033957647
Energy: 0.6330777432571111
Energy: 1.2393150247569777
Energy: 0.6312636465126784
Energy: 0.8029894011479641
Energy: 0.6312636465145688
Energy: 1.2394719277848367
Energy: 0.6305921007587647
Energy: 0.8008290334348324
Energy: 0.6305921007578195
Energy: 0.9680184951095715
Energy: 0.6302415375422638
Energy: 0.7985513023549309
Energy: 0.6302415375403735
Energy: 1.2473817324905119
Energy: 0.9097752675630033
Energy: 1.107543997119106
Energy: 0.909775267561113
Energy: 0.9661561120877423
Energy: 0.7042305624139048
Energy: 1.104338158864408
Energy: 0.7042305624120144
Energy: 0.9661070480477756
Energy: 0.9097490171183343
Energy: 1.1059204854846425
Energy: 0.909749017116444
Energy: 0.9845577463749821
Energy: 0.6302510200887399
Energy: 1.102785813623524
Energy: 0.630251020089685
Energy: 0.8005965296586917
Energy: 0.6305512722012081
Energy: 1.2485319091488145
Energy: 0.6305512722012081
Energy: 0.8028634925171722
Energy: 0.6312497159107411
Energy: 1.24877348783811
Energy: 0.6312497159107411
Energy: 0.6304360951383933
Energy: 0.6299663116699007
Energy: 1.1630640078940657
Energy: 0.6299663116689557
Energy: 0.6347927930802407
Energy: 0.6314610755284865
Energy: 1.2492590604026972
Energy: 0.6314610755275414
Energy: 0.632330222851107
Energy: 0.6341598655546351
Energy: 1.2393279988616912
Energy: 0.6341598655546351
Energy: 0.7984276164019037
Energy: 0.6298114779513476
Energy: 1.2371043655167455
Energy: 0.6298114779466649
Energy: 0.800193490566423
Energy: 0.6299778389628601
Energy: 1.24803333794221
Energy: 0.6299778389638052
Energy: 0.8038147126079859
Energy: 0.6318925699690754
Energy: 1.2408230188670926
Energy: 0.6318925699700205
Energy: 1.105448347122413
Energy: 0.6301784550835839
Energy: 1.23849844838526
Energy: 0.6301784550845291
Energy: 0.7981797197218111
Energy: 0.9106847666872511
Energy: 1.1053258783017403
Energy: 0.9106847667042636
Energy: 1.1046573455183606
Energy: 0.9096292744943872
Energy: 0.9655942108556131
Energy: 0.9096292744943872
Energy: 1.2480802411328735
Energy: 0.9094553801675676
Energy: 0.9656486585281981
Energy: 0.9094553801675676
Energy: 1.1642452853864433
Energy: 0.6302671906464414
Energy: 0.7988428034906719
Energy: 0.6302671906482887
Energy: 1.2494595436026288
Energy: 0.629658859607821
Energy: 0.6308678701489969
Energy: 0.6296588596068758
Energy: 1.243887467597095
Energy: 0.6332286132792543
Energy: 0.8007403893080492
Energy: 0.6332286132792543
Energy: 1.107113635915368
Energy: 0.6305197481842227
Energy: 0.6301782144170183
Energy: 0.6305197481842227
Energy: 1.2475007810087435
Energy: 0.6298923679817366
Energy: 0.6310226510175663
Energy: 0.6298923679836269
Energy: 1.2396489952538792
Energy: 0.6322871437710376
Energy: 0.6309151048232743
Energy: 0.6322871437691473

minimum gb energy = 0.6296588596068758 eV
minimum distance =  2.27341680354481 Angstroms
sigma value = 41


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

Energy: 1.4913446409553646
Energy: 0.5976871833765125
Energy: 0.5750143046415542
Energy: 0.5726761246263674
Energy: 1.3172000448708463
Energy: 0.5715336702482511
Energy: 0.7125118683311122
Energy: 0.5715336702467014
Energy: 1.3172545978058585
Energy: 0.5708845565720376
Energy: 0.7115446221687489
Energy: 0.5708845565728125
Energy: 1.0872299073797118
Energy: 0.573863914408941
Energy: 0.9663245889879998
Energy: 0.5738639144112656
Energy: 1.3220834825962666
Energy: 0.813577493721047
Energy: 0.9685878325098362
Energy: 0.813577493721822
Energy: 1.0814909444468352
Energy: 1.0489595201211797
Energy: 0.9673794284846877
Energy: 1.0489595201219546
Energy: 1.0870799212386302
Energy: 1.0461459389885326
Energy: 1.2020646756681694
Energy: 1.0461459389885326
Energy: 1.0895939563266102
Energy: 1.0505627023153357
Energy: 0.9642972068033127
Energy: 1.0505627023153357
Energy: 0.8478394344853987
Energy: 0.5715830408988246
Energy: 1.200315027889128
Energy: 0.5715830408995993
Energy: 0.8485977818868922
Energy: 0.8132689905213614
Energy: 1.3246521172833654
Energy: 0.8132689905213614
Energy: 0.7098755480493824
Energy: 0.5738209361851133
Energy: 1.1982474153912135
Energy: 0.5738209361843384
Energy: 0.7094623894329006
Energy: 0.5700747152285516
Energy: 1.3237295688703379
Energy: 0.5700747152277766
Energy: 0.7163591726151762
Energy: 0.573296145101334
Energy: 1.3243920481794575
Energy: 0.5732961451005592
Energy: 0.5701179811497201
Energy: 0.5766065789139609
Energy: 1.1978661097154242
Energy: 0.576606578913186
Energy: 0.572858115744048
Energy: 0.5711951059195247
Energy: 1.3219374278130105
Energy: 0.5711951059195247
Energy: 0.5760974800522033
Energy: 0.5734515980979766
Energy: 1.3175155286779707
Energy: 0.5734515980979766
Energy: 0.7092748641080189
Energy: 0.5752699209078038
Energy: 1.3140171940421106
Energy: 0.5752699209085788
Energy: 0.7072802779353098
Energy: 0.7116326642182136
Energy: 1.3212614562463527
Energy: 0.7116387861427049
Energy: 0.7134189345685524
Energy: 0.5744102944680048
Energy: 1.0839776483743206
Energy: 0.5744102944695546
Energy: 0.9694813180803901
Energy: 0.5724414520187188
Energy: 1.0821037843543175
Energy: 0.5724414520163942
Energy: 0.9663174467674555
Energy: 0.8149008187065133
Energy: 1.2025482707439419
Energy: 0.8149008187065133
Energy: 0.9700473529065797
Energy: 1.0487487321579105
Energy: 1.0865308923329948
Energy: 1.0487487321563607
Energy: 1.2003866099368672
Energy: 1.0421431956484184
Energy: 1.080712145421503
Energy: 1.0421431956499678
Energy: 0.968204637984069
Energy: 1.0499236747251166
Energy: 0.9710385635879085
Energy: 1.0499236747266663
Energy: 1.202569527734882
Energy: 0.5714537811191651
Energy: 0.8394217326386006
Energy: 0.5714537811214897
Energy: 1.2011006461052212
Energy: 0.5722480054239495
Energy: 0.9685662799756464
Energy: 0.5722480054231747
Energy: 1.2032766615883248
Energy: 0.5728462290799559
Energy: 0.7106421111483165
Energy: 0.5728462290784062
Energy: 1.321272869832842
Energy: 0.7825306878513133
Energy: 0.7062476496708481
Energy: 0.784408338733884
Energy: 1.2026229193686007
Energy: 0.5777911076454929
Energy: 0.7095715535994134
Energy: 0.5777911076439433
Energy: 1.2005853318673803
Energy: 0.5760982036169655
Energy: 0.5705041366271563
Energy: 0.5760982036169655
Energy: 1.3220051688221683
Energy: 0.5713367383111035
Energy: 0.572409372749223
Energy: 0.5713367383111035
Energy: 1.3140066537046866
Energy: 0.577304188816004
Energy: 0.5712683452392363
Energy: 0.5773041888198784

minimum gb energy = 0.5700747152277766 eV
minimum distance =  2.27870267988346 Angstroms
sigma value = 15


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

Energy: 1.2852895981079864
Energy: 0.5472401798746815
Energy: 0.8331362361666206
Energy: 0.5272789832344019
Energy: 1.3791432553706484
Energy: 0.5259370746768056
Energy: 0.6472771359765912
Energy: 0.5259370746735235
Energy: 1.371004355631991
Energy: 0.5248382879879488
Energy: 0.6465694500023493
Energy: 0.5248382879892617
Energy: 1.1737159978899274
Energy: 0.5283630106213698
Energy: 0.8623611799757119
Energy: 0.5283630106226826
Energy: 1.2760816393503633
Energy: 0.5254073882501129
Energy: 0.8633636608335531
Energy: 0.5254073882474872
Energy: 1.1677384139787839
Energy: 0.5240265373512569
Energy: 0.8636980267429414
Energy: 0.5240265373512569
Energy: 0.9657525843677824
Energy: 0.7641679726846389
Energy: 1.0710953295418673
Energy: 0.7641679726839826
Energy: 1.0732010665157243
Energy: 0.9628013529814713
Energy: 0.8588780627723672
Energy: 0.9628013529827841
Energy: 0.9639368903852956
Energy: 0.9594507807085144
Energy: 1.0657686681507468
Energy: 0.9594507807072016
Energy: 0.9629392400464697
Energy: 0.9582857237130039
Energy: 1.2690818381984545
Energy: 0.9582857237130039
Energy: 0.8726454214938673
Energy: 0.7651904182037297
Energy: 1.0733083124205067
Energy: 0.7651904182063555
Energy: 0.7589079786440255
Energy: 0.5251426531483739
Energy: 1.269196388834156
Energy: 0.5251426531496868
Energy: 0.8654891515188065
Energy: 0.5268244211487136
Energy: 1.2682462637944192
Energy: 0.52682442114937
Energy: 0.6433667228980704
Energy: 0.5282827614225795
Energy: 1.071327375476875
Energy: 0.5282827614252052
Energy: 0.6378631229201083
Energy: 0.5239166035087272
Energy: 1.3757370460157865
Energy: 0.5239166035093835
Energy: 0.6521098051830277
Energy: 0.5282089155213441
Energy: 1.2702024396381575
Energy: 0.5282089155206876
Energy: 0.5243545992657215
Energy: 0.530783890588862
Energy: 1.2735679089004346
Energy: 0.5307838905895185
Energy: 0.5239830550683006
Energy: 0.5240866234211448
Energy: 1.3755175470520065
Energy: 0.5240866234211448
Energy: 0.5331691097361512
Energy: 0.5279607363860893
Energy: 1.1707121471965232
Energy: 0.5279607363841201
Energy: 0.6483325120498179
Energy: 0.5290331525191143
Energy: 1.37258184072669
Energy: 0.5290331525197708
Energy: 0.6359069734299891
Energy: 0.5233108220777976
Energy: 1.3764748642456541
Energy: 0.5233108220745155
Energy: 0.649804636274145
Energy: 0.5276915779329994
Energy: 1.172119063067408
Energy: 0.5276915779329994
Energy: 0.8656146855303604
Energy: 0.5277053331989618
Energy: 1.1658987291885514
Energy: 0.5277053332002747
Energy: 0.8649751555546745
Energy: 0.5263978741658114
Energy: 1.2717186425052776
Energy: 0.5263978741677806
Energy: 0.8712639771005573
Energy: 0.7649471549370678
Energy: 0.9706111451795901
Energy: 0.7649471549383806
Energy: 1.0661951030003196
Energy: 0.9594440478084751
Energy: 1.2713549737094074
Energy: 0.9594440478091314
Energy: 0.8628656890111184
Energy: 0.5775467529762578
Energy: 1.067905630774655
Energy: 0.5775467529788835
Energy: 1.072813405499736
Energy: 0.9641485381459459
Energy: 0.9697298279914405
Energy: 0.9641485381433202
Energy: 1.0681937707936284
Energy: 0.7640006407627208
Energy: 1.0674284549631452
Energy: 0.7640006407614081
Energy: 1.0656594156503354
Energy: 0.7629738608931503
Energy: 0.8652046541333931
Energy: 0.7629738608970889
Energy: 1.2757421704662455
Energy: 0.5253796180910237
Energy: 0.7589009808270502
Energy: 0.5253796180949624
Energy: 1.0704561068148981
Energy: 0.5276544659019196
Energy: 0.8730773465889182
Energy: 0.5276544658992939
Energy: 1.2687040146879525
Energy: 0.5279216507606613
Energy: 0.6450405287267342
Energy: 0.5279216507586921
Energy: 1.3745855824316555
Energy: 0.5254878468681097
Energy: 0.6463371067304722
Energy: 0.5254878468694225
Energy: 1.266993960117379
Energy: 0.5303248654922589
Energy: 0.5376226062400365
Energy: 0.5303248654975102
Energy: 1.3752728194666415
Energy: 0.5264320834936538
Energy: 0.527821116842868
Energy: 0.5264320834923409
Energy: 1.3687799330913515
Energy: 0.5269330238041948
Energy: 0.5291157726282809
Energy: 0.5269330238055077

minimum gb energy = 0.5233108220745155 eV
minimum distance =  2.28078519539587 Angstroms
sigma value = 85


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

Energy: 1.4354477229257394
Energy: 0.5087053325398843
Energy: 0.4991598751586986
Energy: 0.49864516223442706
Energy: 1.402021498133145
Energy: 0.4737968625497974
Energy: 0.5747411931221923
Energy: 0.4737968625469508
Energy: 1.2624788356854808
Energy: 0.47333752310809596
Energy: 0.5745446133075095
Energy: 0.47333752310980387
Energy: 1.0783078196940914
Energy: 0.47175894992903866
Energy: 0.7702226304273642
Energy: 0.47175894993188516
Energy: 1.3108903063825348
Energy: 0.4718531238721056
Energy: 0.7701286679479552
Energy: 0.4718531238703977
Energy: 1.0824270583883813
Energy: 0.472426705401323
Energy: 0.7721364261516196
Energy: 0.472426705401323
Energy: 1.0812207559181235
Energy: 0.6975011371424233
Energy: 0.9504128289291932
Energy: 0.6975011371424233
Energy: 1.1316552827152253
Energy: 0.6969852183583534
Energy: 0.8140476971455145
Energy: 0.6969852183600613
Energy: 1.0838023034564956
Energy: 0.8839649548418441
Energy: 0.951430213080744
Energy: 0.8839649548429828
Energy: 1.0860941762629213
Energy: 0.8910325102116626
Energy: 1.130991761837046
Energy: 0.8910325102139399
Energy: 0.951752342891986
Energy: 0.890515764208
Energy: 0.9923660652557171
Energy: 0.8905157642074308
Energy: 0.905998463486716
Energy: 0.4720821778037298
Energy: 1.1317035642882909
Energy: 0.47208217779860595
Energy: 0.951623392403071
Energy: 0.47199082295575034
Energy: 1.1735140503719441
Energy: 0.4719908229523345
Energy: 0.7720424547908877
Energy: 0.4728856293903385
Energy: 0.9892349012843326
Energy: 0.4728856293897692
Energy: 0.7185550475292125
Energy: 0.4724749173698856
Energy: 1.3105597648626066
Energy: 0.4724749173698856
Energy: 0.7722720177291402
Energy: 0.4729982773931423
Energy: 1.1726091935703022
Energy: 0.4729982773959888
Energy: 0.57227830119971
Energy: 0.473361557187995
Energy: 1.1705933849418713
Energy: 0.47336155718571776
Energy: 0.5729784273834333
Energy: 0.4723074870792553
Energy: 1.3619545061017977
Energy: 0.4723074870792553
Energy: 0.5722672728496844
Energy: 0.4721105278583832
Energy: 1.3497003952076503
Energy: 0.4721105278589525
Energy: 0.5197025648572825
Energy: 0.4729815339662102
Energy: 1.3496874301808854
Energy: 0.4729815339656409
Energy: 0.5209420431710939
Energy: 0.469775178337778
Energy: 1.3973484219790178
Energy: 0.4697751783400294
Energy: 0.5209232532218597
Energy: 0.4698325703602548
Energy: 1.214704717277974
Energy: 0.4698325703591162
Energy: 0.6242880743900924
Energy: 0.4696015237399508
Energy: 1.3949331394544608
Energy: 0.4696015237427974
Energy: 0.6206000044331057
Energy: 0.4720640282330813
Energy: 1.3974391456893842
Energy: 0.47206402823365057
Energy: 0.6236788093275434
Energy: 0.46930202222738804
Energy: 1.0783735845164115
Energy: 0.46930202222283357
Energy: 0.767262663957747
Energy: 0.4722266671828341
Energy: 1.40147048713395
Energy: 0.47222666717941825
Energy: 0.7665687892225092
Energy: 0.4717132494937068
Energy: 1.2635427610409924
Energy: 0.47171324949712273
Energy: 0.8787732681436272
Energy: 0.47186939859604154
Energy: 1.0812532097936083
Energy: 0.47186939859661087
Energy: 0.9545685676350381
Energy: 0.8018725590478797
Energy: 1.2723560248578216
Energy: 0.8018725590518648
Energy: 0.9529177953833872
Energy: 0.8075089250193345
Energy: 1.0838323143101214
Energy: 0.8075089250204731
Energy: 1.132077027902784
Energy: 0.8872094068738625
Energy: 0.9032055126417033
Energy: 0.8872094068738625
Energy: 0.9921950673633104
Energy: 0.8872491634851642
Energy: 1.1020651884067183
Energy: 0.8872491634840255
Energy: 1.1320772249464615
Energy: 0.7040101793082821
Energy: 0.9035565318875528
Energy: 0.7040101793054355
Energy: 1.3111093077759552
Energy: 0.6953960570206694
Energy: 0.9046323978537508
Energy: 0.695396057023516
Energy: 0.9893587299749745
Energy: 0.4717808172609061
Energy: 0.7698154983908407
Energy: 0.4717808172586288
Energy: 1.3101233840461157
Energy: 0.47176141015528067
Energy: 0.7702999686494187
Energy: 0.4717614101547114
Energy: 1.3519199885291557
Energy: 0.4722693765038053
Energy: 0.7714931056047395
Energy: 0.4722693765026667
Energy: 1.1705321837416123
Energy: 0.47180646723928527
Energy: 0.575605381955991
Energy: 0.4718064672364387
Energy: 1.4025047812926001
Energy: 0.4718172209339089
Energy: 0.5737583954438074
Energy: 0.4718172209350476
Energy: 1.3497173797900475
Energy: 0.4718026505095245
Energy: 0.5757262658059196
Energy: 0.47180265051294035
Energy: 1.1677245215332506
Energy: 0.4720112843362513
Energy: 0.4747851001739486
Energy: 0.4720112843402365
Energy: 1.403187146810037
Energy: 0.47186662999475787
Energy: 0.4724690906998349
Energy: 0.4718666299964658
Energy: 1.2594034381862838
Energy: 0.4721186802028509
Energy: 0.4736058038611843
Energy: 0.4721186802045588

minimum gb energy = 0.46930202222283357 eV
minimum distance =  2.27304292384101 Angstroms
sigma value = 113


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

Energy: 0.014137044979055638
Energy: 0.015272995216091913
Energy: 1.1055661768109084
Energy: 0.45022178942171465
Energy: 0.014809464154840688
Energy: 0.1117035973172034
Energy: 0.7644074418342679
Energy: 0.1117035973172034
Energy: 0.014746361191269174
Energy: 0.11023528020852205
Energy: 0.7626520261830894
Energy: 0.11023528020808439
Energy: 0.01571029288952931
Energy: 0.10955746737216454
Energy: 0.7611448589428657
Energy: 0.10955746737131354
Energy: 0.7621467813081129
Energy: 0.11141755774324404
Energy: 0.7623040957851046
Energy: 0.1114175577445327
Energy: 0.01471515574118259
Energy: 0.11006664687079079
Energy: 0.7624957860733789
Energy: 0.11006664686950214

minimum gb energy = 0.014137044979055638 eV
minimum distance =  2.54013994482076 Angstroms
sigma value = 1