Model name: model_name=EAM_Dynamo_AcklandTichyVitek_1987_Cu__MO_179025990738_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=3.615000084042549
cohesive_energy=3.5196298154797776
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: 0.013609531828073973
Energy: 0.013943874136272873
Energy: 1.3272304459430015
Energy: 0.013943874136272873
Energy: 0.013943874136272873
Energy: 1.130983319451462
Energy: 0.013943874136272873
Energy: 1.1309833194520893
Energy: 1.327230445938123
Energy: 0.013943874136272873
Energy: 0.013609531828073973
Energy: 0.013943874136272873
Energy: 0.013943874136272873
Energy: 1.1309833194520893
Energy: 0.013943874136272873
Energy: 1.1309833194527166

minimum gb energy = 0.013609531828073973 eV
minimum distance =  2.52277449119244 Angstroms
sigma value = 1


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

Energy: 1.028178872082286
Energy: 1.1342943319199947
Energy: 0.8939518457768784
Energy: 1.1342943319207552
Energy: 0.9449133526010551
Energy: 0.9535609527335809
Energy: 0.8989037974612969
Energy: 0.9535609527320595
Energy: 0.8693476797597478
Energy: 1.1306487225463207
Energy: 1.0120524971710565
Energy: 1.1306487225463207
Energy: 0.8948965517283748
Energy: 1.048214635512658
Energy: 0.9223708322954711
Energy: 1.0482146355118973
Energy: 0.8446987108494801
Energy: 1.137362626834273
Energy: 0.9555626861616415
Energy: 1.1373626268350336
Energy: 0.8969302670591908
Energy: 1.0612699395458047
Energy: 0.8906897259966189
Energy: 1.0612699395458047
Energy: 0.8966581842204451
Energy: 1.130184399475845
Energy: 0.8981462323407224
Energy: 1.130184399475845
Energy: 0.8458543561613461
Energy: 1.1347898865642991
Energy: 0.894844469689193
Energy: 1.1347898865642991
Energy: 0.9243005932650554
Energy: 0.9473196437745697
Energy: 0.9441271264673712
Energy: 0.9473196437745697
Energy: 0.8915169648000549
Energy: 1.1310193263347452
Energy: 0.8481132019457703
Energy: 1.1310193263355057
Energy: 0.8755099000227023
Energy: 0.9537798299996768
Energy: 0.9242466085845751
Energy: 0.9537798300004375
Energy: 0.9178933532550705
Energy: 1.1349598778018695
Energy: 0.8927844635443644
Energy: 1.1349598778018695
Energy: 0.9469419547809436
Energy: 1.1310650721030866
Energy: 0.9502336998653346
Energy: 1.1310650721030866
Energy: 0.8474014714744076
Energy: 1.1313419091657295
Energy: 0.9182103631726882
Energy: 1.131341909164969
Energy: 0.9785781406584468
Energy: 1.134957178287382
Energy: 0.9433221927819216
Energy: 1.134957178287382
Energy: 0.894794505279975
Energy: 1.1359333374403977
Energy: 0.9437899364462201
Energy: 1.135933337441919
Energy: 1.0121541811059331
Energy: 1.131008220825641
Energy: 0.8907654192981447
Energy: 1.1310082208264016
Energy: 0.8990567662580332
Energy: 1.0517012082355084
Energy: 0.9469076037946949
Energy: 1.0517012082370298
Energy: 0.893953511433815
Energy: 1.1354396575017678
Energy: 0.8919448885062721
Energy: 1.1354396575017678
Energy: 0.8984932170998654
Energy: 0.9473634347810267
Energy: 0.9254433478800458
Energy: 0.9473634347787446
Energy: 0.8937017397602098
Energy: 1.1306895869565727
Energy: 0.8707428079528752
Energy: 1.1306895869565727
Energy: 0.9224479510001431
Energy: 0.9477948986141489
Energy: 0.8940496644702342
Energy: 0.9477948986126276
Energy: 0.8955410362866095
Energy: 1.1372164067929484
Energy: 0.8982649609654355
Energy: 1.1372164067929484
Energy: 0.9199903747305145
Energy: 1.1308484233959386
Energy: 0.8970395511177108
Energy: 1.1308484233974603
Energy: 0.8978620702501495
Energy: 1.060711084054165
Energy: 0.8970265408055994
Energy: 1.0607110840549256
Energy: 1.0092750655175469
Energy: 1.1351013002069181
Energy: 0.8457756407230785
Energy: 1.1351013002084394
Energy: 0.9444056240538956
Energy: 0.9597667386585601
Energy: 0.9240382157329774
Energy: 0.9597667386570388
Energy: 0.8471146124269884
Energy: 1.1305125668618548
Energy: 1.022865873180772
Energy: 1.1305125668633762
Energy: 0.9438463235701434
Energy: 0.9082187467025336
Energy: 0.9415727141554099
Energy: 0.9082187467017729
Energy: 1.029039678003679
Energy: 1.135160821744765
Energy: 0.9153497566318136
Energy: 1.135160821744765
Energy: 0.9473945236184658
Energy: 1.1314803999920977
Energy: 0.9462013037375022
Energy: 1.1314803999913372
Energy: 0.9202221030447348
Energy: 1.13174959737667
Energy: 0.8474308015854357
Energy: 1.1317495973774305
Energy: 0.8445023189407427
Energy: 1.1370703809949747
Energy: 0.9218708136027676
Energy: 1.1370703809949747

minimum gb energy = 0.8445023189407427 eV
minimum distance =  2.27570733170729 Angstroms
sigma value = 1


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

Energy: 1.1146882183373226
Energy: 1.2143609298690303
Energy: 0.9674694225736289
Energy: 1.2143609298638658
Energy: 0.978994863993689
Energy: 1.1324819270195137
Energy: 0.9517478425308764
Energy: 1.1324819270177788
Energy: 0.8919152854023953
Energy: 1.2138940705029448
Energy: 0.9267825907481703
Energy: 1.2138940705029448
Energy: 0.9498497591636046
Energy: 0.9230241558704311
Energy: 0.94118229157117
Energy: 0.9230241558739003
Energy: 0.9498120026160459
Energy: 1.2054026834363238
Energy: 0.9520136486377855
Energy: 1.205402683439793
Energy: 0.9762980753315071
Energy: 1.2041061878192238
Energy: 0.9778483352912378
Energy: 1.2041061878131527
Energy: 0.9795062298356482
Energy: 0.9231821244593666
Energy: 0.968473913111296
Energy: 0.9231821244628359
Energy: 0.8917944043422406
Energy: 1.2137704604247346
Energy: 0.9380219436452338
Energy: 1.2137704604212651
Energy: 0.9650238562328375
Energy: 1.015588781287649
Energy: 0.8948697596865931
Energy: 1.0155887812859141
Energy: 0.9495200889437679
Energy: 1.2139997525259645
Energy: 0.9469448866671072
Energy: 1.2139997525190263
Energy: 0.9792433685503635
Energy: 1.0605922113884976
Energy: 0.9397507961542563
Energy: 1.0605922113858959
Energy: 0.9258900357159394
Energy: 1.2080765347291742
Energy: 0.9265861432616374
Energy: 1.2080765347265723
Energy: 0.9565587508294653
Energy: 1.206343005264638
Energy: 0.9781736963147563
Energy: 1.2063430052663726
Energy: 0.9564227317651565
Energy: 1.2062964947250316
Energy: 0.9654087143155082
Energy: 1.2062964947311028
Energy: 0.9258990785272025
Energy: 1.2080839298628332
Energy: 0.9138958576170553
Energy: 1.2080839298637003
Energy: 0.9794958017023497
Energy: 1.0604979314215977
Energy: 0.9516206284535498
Energy: 1.0604979314233323
Energy: 0.9496768245790143
Energy: 1.2139888608515437
Energy: 0.9292882978588913
Energy: 1.2139888608506764
Energy: 0.965237526036436
Energy: 1.0156945500131984
Energy: 0.894840979460895
Energy: 1.0156945500079946
Energy: 0.8918026054240238
Energy: 1.2138398014084746
Energy: 0.9212301700392562
Energy: 1.2138398014154133
Energy: 0.9795196747216512
Energy: 0.9233297634544522
Energy: 0.9413677026325666
Energy: 0.9233297634518502
Energy: 0.9747457799644978
Energy: 1.2037315966120095
Energy: 0.937788755217339
Energy: 1.2037315966111422
Energy: 0.9498141155113939
Energy: 1.2050055059083444
Energy: 0.9653641717436434
Energy: 1.2050055059092117
Energy: 0.9497320285752845
Energy: 0.922929443679975
Energy: 0.9516383094456756
Energy: 0.9229294436756385
Energy: 0.891915952934413
Energy: 1.2140502238895143
Energy: 0.8894948216813122
Energy: 1.2140502238947182
Energy: 0.9790841707372352
Energy: 1.1301706014869708
Energy: 0.9517124074737754
Energy: 1.1301706014852362
Energy: 1.1146882183373226
Energy: 1.2143609298690303
Energy: 0.9857076042496392
Energy: 1.2143609298646938
Energy: 0.9789948639928217
Energy: 1.132481927018646
Energy: 0.9517478425300091
Energy: 1.1324819270177788
Energy: 0.8919152854015281
Energy: 1.2138940705038122
Energy: 0.9267825907499049
Energy: 1.2138940705029448
Energy: 0.9498497591627373
Energy: 0.9230241558765022
Energy: 0.9411822915755066
Energy: 0.9230241558721658

minimum gb energy = 0.8894948216813122 eV
minimum distance =  2.27569336919397 Angstroms
sigma value = 25


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

Energy: 1.035740363002659
Energy: 1.2973110846240956
Energy: 1.0082835550352756
Energy: 1.2973110846251037
Energy: 0.9963960925158781
Energy: 1.0614547977184996
Energy: 1.0264648693235172
Energy: 1.0614547977184996
Energy: 0.9414667495061003
Energy: 1.3138842193323341
Energy: 1.023739053680569
Energy: 1.3138842193323341
Energy: 1.0276356054549725
Energy: 0.9877813935424637
Energy: 1.0131519906165694
Energy: 0.9877813935424637
Energy: 1.0147714651314101
Energy: 1.1373662534304323
Energy: 1.0073614745277206
Energy: 1.137366253428416
Energy: 1.0474958801760006
Energy: 1.314486887923591
Energy: 0.9960306496412643
Energy: 1.3144868879225826
Energy: 0.995777840686993
Energy: 1.0323416366752924
Energy: 1.0227679026497911
Energy: 1.0323416366752924
Energy: 1.0647183493150723
Energy: 1.2991878753270816
Energy: 0.9432855730260621
Energy: 1.2991878753260735
Energy: 1.010431995702981
Energy: 1.1401145427838972
Energy: 0.995909669723711
Energy: 1.1401145427838972
Energy: 1.0248522063566847
Energy: 1.314427296274814
Energy: 0.9877976461798215
Energy: 1.314427296274814
Energy: 0.9832553862047476
Energy: 1.2972496635925563
Energy: 0.9425108342787544
Energy: 1.297249663591548
Energy: 0.9420891733445008
Energy: 1.2963528167088485
Energy: 0.9431455019291288
Energy: 1.2963528167098568
Energy: 1.0237239682760104
Energy: 1.183471936966451
Energy: 0.9886975755073443
Energy: 1.1834719369654427
Energy: 1.0234542239527333
Energy: 1.0240792456933083
Energy: 0.9964333215371677
Energy: 1.0240792456953018
Energy: 0.9801324763216727
Energy: 1.2970217078007236
Energy: 0.9410225612970667
Energy: 1.2970217078017319
Energy: 0.9970925326585078
Energy: 0.9851709827008004
Energy: 0.995918447617203
Energy: 0.9851709827028169
Energy: 0.9410319866096939
Energy: 1.313474110779342
Energy: 0.9410240413867473
Energy: 1.313474110779342
Energy: 1.0131060748490597
Energy: 1.1382792541714264
Energy: 1.0003577957995806
Energy: 1.1382792541724345
Energy: 1.0276823700385993
Energy: 0.9874634964629294
Energy: 1.0148559906009391
Energy: 0.9874634964639377
Energy: 0.9957193687474074
Energy: 1.313765472377395
Energy: 1.0237991246878944
Energy: 1.313765472377395
Energy: 1.0560960968562485
Energy: 1.1794018989337969
Energy: 1.0246878532974557
Energy: 1.1794018989337969
Energy: 1.0367261102789447
Energy: 1.2988575799818296
Energy: 1.0539955070384825
Energy: 1.2988575799818296
Energy: 0.996193691010048
Energy: 1.19598182355307
Energy: 0.995768938492459
Energy: 1.1959818235520618
Energy: 0.9414690317609984
Energy: 1.3188819787360313
Energy: 1.02493976279084
Energy: 1.3188819787380477
Energy: 1.0091298228304195
Energy: 0.9885127585212328
Energy: 1.0138672513055123
Energy: 0.9885127585212328

minimum gb energy = 0.9410225612970667 eV
minimum distance =  2.27288953820754 Angstroms
sigma value = 9


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

Energy: 1.1913293881487488
Energy: 1.240618161118947
Energy: 1.121102370670682
Energy: 1.2406181611165412
Energy: 1.073667679715317
Energy: 1.214505031947191
Energy: 1.1225544133534484
Energy: 1.214505031948394
Energy: 0.9937503830931185
Energy: 1.1202621478011916
Energy: 1.0898308084883581
Energy: 1.1202621478011916
Energy: 1.1159682257223051
Energy: 1.2127921026109199
Energy: 1.0091109126750315
Energy: 1.2127921026109199
Energy: 1.1734337556393062
Energy: 1.207638746891607
Energy: 1.0535312465924944
Energy: 1.207638746890404
Energy: 1.027565685785781
Energy: 1.1194544622056108
Energy: 0.9986205663365293
Energy: 1.1194544622044083
Energy: 1.1550464932376934
Energy: 1.009300255063029
Energy: 1.009782088867997
Energy: 1.009300255063029
Energy: 1.043158357242526
Energy: 1.1195501747916297
Energy: 1.037354469642353
Energy: 1.1195501747940348
Energy: 1.1569227988292095
Energy: 1.2267491526181233
Energy: 1.0546271752436291
Energy: 1.2267491526181233
Energy: 1.1148122576243502
Energy: 1.2796549220487947
Energy: 1.009122034761581
Energy: 1.2796549220499975
Energy: 1.0391711921193711
Energy: 1.2681800322560783
Energy: 1.0895087207478562
Energy: 1.2681800322572812
Energy: 1.146686527598397
Energy: 1.1668957770023474
Energy: 1.0464906567151786
Energy: 1.166895777001145
Energy: 1.0277268156130062
Energy: 1.1159134506756374
Energy: 0.9936363981200674
Energy: 1.1159134506756374
Energy: 1.0384441406232137
Energy: 1.0942828066940058
Energy: 1.1623327107950208
Energy: 1.0942828066940058
Energy: 1.0277691466805794
Energy: 1.115835558014109
Energy: 1.0430264668430824
Energy: 1.1158355580153119
Energy: 1.141644877693062
Energy: 1.1666360256616402
Energy: 1.0090074225893233
Energy: 1.1666360256604376
Energy: 1.1307471568475496
Energy: 1.2051064477600326
Energy: 1.0898067950960253
Energy: 1.205106447757627
Energy: 1.1318841192468159
Energy: 1.1317694491295334
Energy: 1.0091055592385139
Energy: 1.1317694491295334
Energy: 1.1180524008562738
Energy: 1.2039726210984822
Energy: 1.1225430005776968
Energy: 1.203972621099685
Energy: 1.075588861323773
Energy: 1.1195092350654834
Energy: 1.037169096827166
Energy: 1.1195092350642808
Energy: 1.1553579889071428
Energy: 1.009518427035599
Energy: 1.0098433529575304
Energy: 1.0095184270368016

minimum gb energy = 0.9936363981200674 eV
minimum distance =  2.36433728643354 Angstroms
sigma value = 25


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

Energy: 1.0483880936187333
Energy: 1.2401487925716799
Energy: 1.206946426631096
Energy: 1.2401487925716799
Energy: 1.0382924330771284
Energy: 1.1645966431367711
Energy: 1.0318598621792077
Energy: 1.1645966431367711
Energy: 1.0319093670689594
Energy: 1.1238477647350928
Energy: 1.0315949676610623
Energy: 1.1238477647350928
Energy: 1.0462921606201658
Energy: 1.1117533122966872
Energy: 1.1495461999434315
Energy: 1.1117533122966872
Energy: 1.1516793479304694
Energy: 1.0385956263692293
Energy: 1.0659881462926772
Energy: 1.0385956263692293
Energy: 1.03202770324728
Energy: 1.2982100980314133
Energy: 1.0325283263401555
Energy: 1.2982100980314133
Energy: 1.0656907643190943
Energy: 1.112379671461828
Energy: 1.0316768875536046
Energy: 1.112379671461828
Energy: 1.1474287750624306
Energy: 1.0333432224560872
Energy: 1.046044808434682
Energy: 1.0333432224531123
Energy: 1.031477297551712
Energy: 1.1228541220769537
Energy: 1.040044844354855
Energy: 1.122854122075466
Energy: 1.1890121944173426
Energy: 1.1239558115696706
Energy: 1.0319380423049367
Energy: 1.1239558115696706
Energy: 1.0684759792515635
Energy: 1.1117273637090723
Energy: 1.26056858333822
Energy: 1.1117273637090723
Energy: 1.0317726187526395
Energy: 1.0595905665906202
Energy: 1.189147960255857
Energy: 1.0595905665906202
Energy: 1.1419254371635064
Energy: 1.1237714212503094
Energy: 1.0316475012162263
Energy: 1.1237714212503094
Energy: 1.0312921398720616
Energy: 1.111342041577028
Energy: 1.0465219066599418
Energy: 1.1113420415785153
Energy: 1.066256561112836
Energy: 1.2337176976704594
Energy: 1.1515512523572147
Energy: 1.2337176976704594
Energy: 1.0379634534384297
Energy: 1.1438775086034243
Energy: 1.0319658960061846
Energy: 1.1438775086019368
Energy: 1.0316747168842404
Energy: 1.1240533002635216
Energy: 1.189417946504655
Energy: 1.1240533002635216

minimum gb energy = 1.0312921398720616 eV
minimum distance =  2.34692397066394 Angstroms
sigma value = 17


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

Energy: 1.1649448501743391
Energy: 1.1626431040470504
Energy: 1.3272589596671835
Energy: 1.162643104046208
Energy: 1.2046147292779321
Energy: 1.1242953640001103
Energy: 1.0557997271105635
Energy: 1.1242953640001103
Energy: 1.1648958914848744
Energy: 1.1613669439682965
Energy: 1.0552035537691953
Energy: 1.161366943969139
Energy: 1.0573445971684619
Energy: 1.2329097737160586
Energy: 1.1345455911689073
Energy: 1.2329097737135315
Energy: 1.1840676224590156
Energy: 1.1179327939188892
Energy: 1.0773388797000023
Energy: 1.1179327939214163
Energy: 1.061501540093595
Energy: 1.0973851035026385
Energy: 1.1649164363603215
Energy: 1.0973851035043232
Energy: 1.0597051097654755
Energy: 1.1784545269094373
Energy: 1.0556698527609352
Energy: 1.1784545269077527
Energy: 1.1665192130901725
Energy: 1.1586661342397402
Energy: 1.058501296778431
Energy: 1.158666134237213
Energy: 1.0631983444914435
Energy: 1.2237809180688355
Energy: 1.202707988010825
Energy: 1.223780918069678
Energy: 1.260038475173379
Energy: 1.121649700271698
Energy: 1.0555933219148157
Energy: 1.1216497002742252
Energy: 1.060176321385126
Energy: 1.1586580683896779
Energy: 1.1673206750556067
Energy: 1.1586580683913625
Energy: 1.059938156237998
Energy: 1.1750098792226726
Energy: 1.0598062561111325
Energy: 1.1750098792226726
Energy: 1.2512737538323766
Energy: 1.1591326444206205
Energy: 1.1594209777005469
Energy: 1.1591326444206205
Energy: 1.0553917924054879
Energy: 1.2353964639264075
Energy: 1.1739862687646754
Energy: 1.2353964639255648
Energy: 1.147010281208237
Energy: 1.1747572277232596
Energy: 1.0632984638611966
Energy: 1.1747572277215745
Energy: 1.1659902705947836
Energy: 1.2445427420114887
Energy: 1.1669094550822197
Energy: 1.2445427420106463
Energy: 1.0560519761675324
Energy: 1.2258130631385853
Energy: 1.276907763781324
Energy: 1.2258130631377429
Energy: 1.1752022063102059
Energy: 1.1644453025660573
Energy: 1.0614798286702145
Energy: 1.1644453025660573
Energy: 1.0561111501840477
Energy: 1.2247932689235748
Energy: 1.1620654004685937
Energy: 1.2247932689235748
Energy: 1.055747912212813
Energy: 1.162480446530699
Energy: 1.0576790602598587
Energy: 1.1624804465323837
Energy: 1.1205446398339878
Energy: 1.1654858154975902
Energy: 1.1648610667394363
Energy: 1.1654858154984327
Energy: 1.055933585742552
Energy: 1.2267190412187245
Energy: 1.259140783439496
Energy: 1.22671904121704
Energy: 1.1926257925962092
Energy: 1.1625765690744523
Energy: 1.055555226481712
Energy: 1.1625765690736096
Energy: 1.0593532133808312
Energy: 1.1729825253779695
Energy: 1.1655586188430327
Energy: 1.1729825253754425
Energy: 1.0594161068777397
Energy: 1.161628599074681
Energy: 1.164676047464914
Energy: 1.161628599074681
Energy: 1.1946665577097202
Energy: 1.1625377110305113
Energy: 1.0567202326817489
Energy: 1.1625377110305113
Energy: 1.0768892006628064
Energy: 1.225306223427945
Energy: 1.275683452371736
Energy: 1.225306223427945
Energy: 1.1651365827113918
Energy: 1.0885011464396164
Energy: 1.1661101593655847
Energy: 1.0885011464370893
Energy: 1.2762062305193405
Energy: 1.2329645878862656
Energy: 1.059080095232801
Energy: 1.2329645878854234
Energy: 1.0585318564090835
Energy: 1.2228060288313851
Energy: 1.168264962464974
Energy: 1.2228060288305427

minimum gb energy = 1.0552035537691953 eV
minimum distance =  2.2678256224451 Angstroms
sigma value = 53


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

Energy: 0.9871931076902405
Energy: 0.9865028366849788
Energy: 1.2649650667014471
Energy: 0.9865028366811002
Energy: 1.161228824260314
Energy: 1.0903596457133395
Energy: 1.00217754325218
Energy: 1.0903596457133395
Energy: 0.9878056738032314
Energy: 0.9861419922303925
Energy: 1.1641283712091717
Energy: 0.9861419922284532
Energy: 0.9878153650337548
Energy: 0.9861341057852655
Energy: 1.1109104235574283
Energy: 0.9861341057813867
Energy: 1.1612256448338405
Energy: 1.0898047950461027
Energy: 1.0051930236049946
Energy: 1.089804795048042
Energy: 0.9871931076902405
Energy: 0.9865028366849788
Energy: 1.3198958771262053
Energy: 0.9865028366811002
Energy: 1.1612288242622533
Energy: 1.0903596457133395
Energy: 1.110819448577423
Energy: 1.0903596457133395
Energy: 0.987805673801292
Energy: 0.9861419922284532
Energy: 1.164128371211111
Energy: 0.9861419922303925
Energy: 0.9878153650337548
Energy: 0.986134105783326
Energy: 1.165560364725116
Energy: 0.9861341057813867
Energy: 1.1612256448338405
Energy: 1.0898047950441634
Energy: 1.1425930013936179
Energy: 1.0898047950461027
Energy: 0.9871931076883012
Energy: 0.9865028366849788
Energy: 1.3198958771262053
Energy: 0.9865028366811002
Energy: 1.1612288242622533
Energy: 1.0903596457133395
Energy: 1.1658097152513318
Energy: 1.0903596457133395
Energy: 0.987805673801292
Energy: 0.9861419922303925
Energy: 1.164128371211111
Energy: 0.9861419922303925

minimum gb energy = 0.9861341057813867 eV
minimum distance =  2.33372108814857 Angstroms
sigma value = 9


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

Energy: 1.0994252906743343
Energy: 1.2855082643547429
Energy: 1.4451672023537554
Energy: 1.2855082643554603
Energy: 1.2516859764307986
Energy: 1.1082648802690795
Energy: 1.048201470585448
Energy: 1.1082648802697974
Energy: 1.0476560756375606
Energy: 1.093228840242478
Energy: 1.0570991420305056
Energy: 1.093228840242478
Energy: 1.163060497241833
Energy: 1.2837889055262375
Energy: 1.0468253298631742
Energy: 1.2837889055269551
Energy: 1.187838650037819
Energy: 1.148792395597505
Energy: 1.0713394386413364
Energy: 1.1487923955960695
Energy: 1.093653172966023
Energy: 1.0928628596936385
Energy: 1.165148468456793
Energy: 1.0928628596922028
Energy: 1.343044636476039
Energy: 1.1474805674553612
Energy: 1.0540560814843112
Energy: 1.147480567456079
Energy: 1.047954283090943
Energy: 1.2819350410020995
Energy: 1.1753556062259414
Energy: 1.281935041000664
Energy: 1.0499975806505113
Energy: 1.176664717470193
Energy: 1.0917622734233536
Energy: 1.1766647174723461
Energy: 1.04855177666733
Energy: 1.126349138066424
Energy: 1.0522923061061897
Energy: 1.126349138066424
Energy: 1.049750961230261
Energy: 1.1693197832918314
Energy: 1.367694899384754
Energy: 1.169319782993362
Energy: 1.1888883122519507
Energy: 1.2315737833017815
Energy: 1.0524521955797976
Energy: 1.2315737833046525
Energy: 1.0504924248614984
Energy: 1.3128642967833564
Energy: 1.2868185111337949
Energy: 1.312864296784074
Energy: 1.1671695191084808
Energy: 1.1718382440768127
Energy: 1.0994172569314338
Energy: 1.1718382440782156
Energy: 1.0504564376436654
Energy: 1.2212942572255052
Energy: 1.168719523296975
Energy: 1.2212942572240695
Energy: 1.0527561359449062
Energy: 1.2498436291777548
Energy: 1.1705941050645732
Energy: 1.249843629177037
Energy: 1.1321400658918743
Energy: 1.221156361402553
Energy: 1.0501477441133427
Energy: 1.2211563614011174
Energy: 1.0528122082293117
Energy: 1.1473671817639794
Energy: 1.2131210755886794
Energy: 1.1473671817639794
Energy: 1.2019984080241615
Energy: 1.3139204558237327
Energy: 1.0944494917231937
Energy: 1.313920455821579
Energy: 1.0522406280185432
Energy: 1.1316315473000444
Energy: 1.1410350571361403
Energy: 1.1316315473000444
Energy: 1.1619427397469595
Energy: 1.24354650243867
Energy: 1.1646899139559896
Energy: 1.2435465024372343
Energy: 1.1561947757238418
Energy: 1.1906764950078945
Energy: 1.0485273413354872
Energy: 1.1906764950107656
Energy: 1.0918928450546281
Energy: 1.3116115229212333
Energy: 1.0500443076833954
Energy: 1.3116115229205156
Energy: 1.3775881783755328
Energy: 1.2914525583931578
Energy: 1.0475323131742367
Energy: 1.2914525583931578
Energy: 1.0547383575649958
Energy: 1.238094339070313
Energy: 1.2726973156449684
Energy: 1.2380943390731842
Energy: 1.1085956233444605
Energy: 1.0932757543741112
Energy: 1.0480239125525577
Energy: 1.0932757543726757
Energy: 1.1177888127265272
Energy: 1.225843996361909
Energy: 1.1624456663990348
Energy: 1.2258439963611911
Energy: 1.053784144430238
Energy: 1.1714961216931141
Energy: 1.162737812542821
Energy: 1.1714961216909605
Energy: 1.116025873746644
Energy: 1.092701000614908
Energy: 1.0472815923304688
Energy: 1.092701000614908
Energy: 1.0478920795179423
Energy: 1.2376221542834196
Energy: 1.3621980683656596
Energy: 1.2376221542812664
Energy: 1.3513132858819663
Energy: 1.1668348207452224
Energy: 1.0473119503418165
Energy: 1.1668348207459405
Energy: 1.0483929504629772
Energy: 1.1307375006888707
Energy: 1.0484992542878013
Energy: 1.1307375006895883
Energy: 1.0546537952384083
Energy: 1.1915748222396327
Energy: 1.047859377097801
Energy: 1.1915748222403506
Energy: 1.1632912095063408
Energy: 1.2860033351468256
Energy: 1.1634187217270116
Energy: 1.2860033351432365
Energy: 1.054815339717566
Energy: 1.2076986320529344
Energy: 1.3432341056569175
Energy: 1.2076986320507808

minimum gb energy = 1.0468253298631742 eV
minimum distance =  2.3307669748487 Angstroms
sigma value = 73


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

Energy: 1.1861977033617754
Energy: 1.1837632869900048
Energy: 1.428534130164125
Energy: 1.1837632869911436
Energy: 1.129937835342355
Energy: 1.2173083952619252
Energy: 1.0398394044173593
Energy: 1.2173083952607864
Energy: 1.0399427174859075
Energy: 1.1148884563630816
Energy: 1.0629303525087204
Energy: 1.1148884563642205
Energy: 1.0421506956080826
Energy: 1.234544343305
Energy: 1.0702277339286097
Energy: 1.2345443433084164
Energy: 1.108847297054747
Energy: 1.1556700540694855
Energy: 1.0565060984068373
Energy: 1.1556700540706244
Energy: 1.0663195100295368
Energy: 1.2867681938318916
Energy: 1.293962826280344
Energy: 1.2867681938318916
Energy: 1.3084495728850267
Energy: 1.2274121815062302
Energy: 1.0388735324945313
Energy: 1.227412181507369
Energy: 1.0615757152566265
Energy: 1.1054438185552304
Energy: 1.2557445800261668
Energy: 1.1054438185552304
Energy: 1.2934403878499008
Energy: 1.0387294952506272
Energy: 1.0385679653046962
Energy: 1.038729495252905
Energy: 1.039749258182634
Energy: 1.1469847306950243
Energy: 1.041448549390982
Energy: 1.1469847306950243
Energy: 1.062680761516906
Energy: 1.0391160508925223
Energy: 1.2271519231839165
Energy: 1.0391160508925223
Energy: 1.1868936652656497
Energy: 1.2444177045063702
Energy: 1.042254431273557
Energy: 1.244417704507509
Energy: 1.0665229436417396
Energy: 1.1521304288927752
Energy: 1.3301987382636453
Energy: 1.152130428893914
Energy: 1.3583161138727098
Energy: 1.2191108987493164
Energy: 1.0671007138472066
Energy: 1.2191108987504553
Energy: 1.0533797301977197
Energy: 1.2131623340696758
Energy: 1.2595461446957057
Energy: 1.2131623340708146
Energy: 1.2265128913783536
Energy: 1.1000388165012212
Energy: 1.0609443418875781
Energy: 1.1000388165012212
Energy: 1.1102666742888248
Energy: 1.1102167495480755
Energy: 1.0399209344427438
Energy: 1.1102167495492141
Energy: 1.109668135361527
Energy: 1.1097422743311838
Energy: 1.0401584342776489
Energy: 1.1097422743289065
Energy: 1.0412164030297701
Energy: 1.1055488232464408
Energy: 1.059676396714218
Energy: 1.1055488232464408
Energy: 1.0396444713995343
Energy: 1.129100670707664
Energy: 1.3362120933064991
Energy: 1.1291006707042734
Energy: 1.339521267127603
Energy: 1.0452570752841333
Energy: 1.0651014191062278
Energy: 1.045257075286411
Energy: 1.0708831266968264
Energy: 1.168038200404402
Energy: 1.2060200176275642
Energy: 1.168038200404402

minimum gb energy = 1.0385679653046962 eV
minimum distance =  2.28577420392406 Angstroms
sigma value = 7


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

Energy: 1.1447582598963342
Energy: 1.143581797573856
Energy: 1.4263462846507329
Energy: 1.1435817975730507
Energy: 1.280732398358257
Energy: 1.3102633420966636
Energy: 1.0788216129809591
Energy: 1.310263342098274
Energy: 1.076196532445607
Energy: 1.2624032901220195
Energy: 1.0690769051599178
Energy: 1.26240329012363
Energy: 1.0685468127002147
Energy: 1.1432197049316308
Energy: 1.0790149601588426
Energy: 1.1432197049316308
Energy: 1.0793467552716023
Energy: 1.175225307024782
Energy: 1.0688822197910544
Energy: 1.1752253070231715
Energy: 1.0800961263788704
Energy: 1.06367535487782
Energy: 1.2497325341471597
Energy: 1.0636753548842621
Energy: 1.1695735368401678
Energy: 1.2080648331781527
Energy: 1.0695225442685656
Energy: 1.208064833175737
Energy: 1.0805558215120077
Energy: 1.251060048613054
Energy: 1.2997576924498444
Energy: 1.2510600486146648
Energy: 1.2383075525424017
Energy: 1.1358212547872255
Energy: 1.083821736511699
Energy: 1.1358212547815882
Energy: 1.078690860745485
Energy: 1.1365361329130692
Energy: 1.1722416464284777
Energy: 1.1365361329090429
Energy: 1.0648249923216182
Energy: 1.2332757544565964
Energy: 1.061596653129563
Energy: 1.2332757544621966
Energy: 1.0656534488974456
Energy: 1.1757672195240243
Energy: 1.0579199406160549
Energy: 1.175767219523219
Energy: 1.0610769645448581
Energy: 1.0643093737082596
Energy: 1.0613818424439423
Energy: 1.0643093737074543
Energy: 1.0695953472610369
Energy: 1.1419678328148393
Energy: 1.057990552971067
Energy: 1.1419678328164502
Energy: 1.0729541060746315
Energy: 1.224956618960728
Energy: 1.2939698035680922
Energy: 1.2249566189615335
Energy: 1.4613384062336767
Energy: 1.1410126486517707
Energy: 1.0791525583943946
Energy: 1.1410126486501602
Energy: 1.0727950223837517
Energy: 1.1390142986855982
Energy: 1.2106737161335408
Energy: 1.1390142986920406
Energy: 1.0697095965700236
Energy: 1.317028194926605
Energy: 1.057797787533491
Energy: 1.317028194926605
Energy: 1.0730110287313623
Energy: 1.0642487025590113
Energy: 1.0614209014665799
Energy: 1.064248702561427
Energy: 1.078379875253812
Energy: 1.1697876123345994
Energy: 1.0579244211348158
Energy: 1.169787612333794
Energy: 1.0651525717805896
Energy: 1.2328367737398842
Energy: 1.0838267412023683
Energy: 1.232836773739079
Energy: 1.0789091513190325
Energy: 1.2303160243147193
Energy: 1.1658705017665514
Energy: 1.2303160243098874
Energy: 1.2550922547781271
Energy: 1.13869008788154
Energy: 1.0698746082130577
Energy: 1.13869008788154
Energy: 1.0606542881737213
Energy: 1.0622360905837502
Energy: 1.2500927599697085
Energy: 1.0622360905869714
Energy: 1.0795128653654054
Energy: 1.139922214484515
Energy: 1.07041671869515
Energy: 1.139922214484515
Energy: 1.068723180627202
Energy: 1.233350622266931
Energy: 1.0580612557560163
Energy: 1.233350622270152
Energy: 1.0794883182017674
Energy: 1.1723796670599498
Energy: 1.0701089856196482
Energy: 1.1723796670623656
Energy: 1.0685115913194267
Energy: 1.1389533439281552
Energy: 1.0801260605426062
Energy: 1.1389533439313764
Energy: 1.0746074235580745
Energy: 1.1146179376416445
Energy: 1.2074271672100634
Energy: 1.1146179376496972
Energy: 1.3183002197023093
Energy: 1.0965340598486046
Energy: 1.0795547981474707
Energy: 1.0965340598486046
Energy: 1.0746302979334448
Energy: 1.1149546836115711
Energy: 1.2758801802850843
Energy: 1.114954683614792

minimum gb energy = 1.057797787533491 eV
minimum distance =  2.25400145997682 Angstroms
sigma value = 29


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

Energy: 0.9944031426045629
Energy: 1.11167549271319
Energy: 1.1076666354293974
Energy: 1.11167549271266
Energy: 0.9795920208791223
Energy: 0.9920322934338235
Energy: 0.9915833243756744
Energy: 0.9920322934346338
Energy: 1.029117989061574
Energy: 0.9922503646278443
Energy: 1.1080948607433858
Energy: 0.9922503646273144
Energy: 0.9915999199549222
Energy: 0.9799992648439925
Energy: 0.9916125308636421
Energy: 0.9799992648439925
Energy: 0.9926928221509911
Energy: 1.0955032424435245
Energy: 1.108063388099726
Energy: 1.0955032424429634
Energy: 0.9960057678856323
Energy: 1.0850175890238973
Energy: 0.9960023368783206
Energy: 1.0850175890238973
Energy: 1.029230328521466
Energy: 1.0958171119605604
Energy: 0.9926927911660919
Energy: 1.0958171119600304
Energy: 0.9917335836785393
Energy: 0.9802982718726578
Energy: 0.9915610199565014
Energy: 0.9802982718734682
Energy: 1.108045512674241
Energy: 0.9921888907982175
Energy: 0.9794785431204283
Energy: 0.9921888907987473

minimum gb energy = 0.9794785431204283 eV
minimum distance =  2.38986025573656 Angstroms
sigma value = 5


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

Energy: 1.0373006624525165
Energy: 1.0810249285514386
Energy: 1.1961802585603742
Energy: 1.0810249285514386
Energy: 1.156941112299088
Energy: 1.2355363559384414
Energy: 1.013349571962173
Energy: 1.2355363559376809
Energy: 1.0002749315681
Energy: 1.0784238253437715
Energy: 1.1960143566444406
Energy: 1.0784238253430107
Energy: 1.004514610536532
Energy: 1.0816484888168882
Energy: 1.0234091385887734
Energy: 1.081648488814606
Energy: 1.0071624088218014
Energy: 1.1157683571706054
Energy: 1.1515165641606855
Energy: 1.1157683571698445
Energy: 1.0306279275456407
Energy: 1.034570891866087
Energy: 1.0199260033779165
Energy: 1.0345708918653262
Energy: 1.0006339464055585
Energy: 1.1128486235222808
Energy: 1.0022559528830992
Energy: 1.1128486235238018
Energy: 1.000810589125871
Energy: 1.0328197277795965
Energy: 1.004002508265714
Energy: 1.0328197277818785
Energy: 1.0073860207139629
Energy: 1.0967330208866504
Energy: 1.0100719514533585
Energy: 1.0967330208851291
Energy: 1.0079610835593313
Energy: 1.0958515177085488
Energy: 1.0090318309780657
Energy: 1.095851517707788
Energy: 1.041344796880175
Energy: 1.0824642254568768
Energy: 1.0022236654505599
Energy: 1.082464225458398
Energy: 1.0008192449645261
Energy: 1.1192151345970052
Energy: 1.0384941731719441
Energy: 1.1192151345962447
Energy: 1.0301784952692634
Energy: 1.0406873013507707
Energy: 1.0493592730016912
Energy: 1.0406873013515312
Energy: 1.0079324784122479
Energy: 1.106041728248061
Energy: 1.031518493070875
Energy: 1.1060417282473003
Energy: 1.0301760367356363
Energy: 1.204297113177725
Energy: 1.0022957343026389
Energy: 1.2042971131769642
Energy: 1.0225960534158407
Energy: 1.0748504612577094
Energy: 1.0451800756806473
Energy: 1.0748504612569487
Energy: 1.1561889371168337
Energy: 1.0983323717628388
Energy: 1.0138886350537246
Energy: 1.0983323717635993
Energy: 1.0074037788509405
Energy: 1.0417849590862667
Energy: 1.1027831104224315
Energy: 1.0417849590870274
Energy: 1.0154015349339482
Energy: 1.0952769984107074
Energy: 1.0113670245711617
Energy: 1.0952769984122288
Energy: 1.0007872885415456
Energy: 1.0729039948849926
Energy: 1.0166842866763526
Energy: 1.07290399488724
Energy: 1.0107185223412471
Energy: 1.0807843965808095
Energy: 1.017968202583461
Energy: 1.0807843965808095
Energy: 1.007385171987151
Energy: 1.1147739513748818
Energy: 1.0072483144074766
Energy: 1.1147739513748818
Energy: 1.0143478895361078
Energy: 1.0344341002063895
Energy: 1.0105489189685235
Energy: 1.0344341002086717
Energy: 1.0331916615476708
Energy: 1.04345094672459
Energy: 1.0009566397504737
Energy: 1.04345094672459
Energy: 1.0355940214888757
Energy: 1.0276154483672542
Energy: 1.0060812286374996
Energy: 1.027615448365733
Energy: 1.0293794376108096
Energy: 1.0407102841235079
Energy: 1.0073597083426462
Energy: 1.0407102841242688
Energy: 1.0215256119304648
Energy: 1.0850770878510325
Energy: 1.0215528259573994
Energy: 1.0850770878495113
Energy: 1.0446600273024036
Energy: 1.2352742047193808
Energy: 1.0225489940988057
Energy: 1.2352742047193808
Energy: 1.0116648553030878
Energy: 1.0902496396390307
Energy: 1.1655549536897012
Energy: 1.0902496396413126
Energy: 1.146204552758653
Energy: 1.1563668439637242
Energy: 1.0075862609497843
Energy: 1.156366843964485
Energy: 1.0118530713995877
Energy: 1.0283789185931589
Energy: 1.143620427518019
Energy: 1.0283789185916377
Energy: 1.1518382438556687
Energy: 1.331245824268584
Energy: 1.0009122262671204
Energy: 1.331245824268584
Energy: 1.023237421681369
Energy: 1.2290308225944218
Energy: 1.020013530117787
Energy: 1.2290308225929003

minimum gb energy = 1.0002749315681 eV
minimum distance =  2.26990185112344 Angstroms
sigma value = 1


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

Energy: 1.1504090236915454
Energy: 1.1191358946707373
Energy: 1.188335444663414
Energy: 1.119135894672841
Energy: 1.013015806168196
Energy: 1.1732175329535757
Energy: 0.9728676011364575
Energy: 1.1732175329546273
Energy: 0.9797206436334275
Energy: 1.0261336201330427
Energy: 1.1602471493028574
Energy: 1.026133620131991
Energy: 0.9845118856603962
Energy: 1.1732250824158892
Energy: 0.9875613690983154
Energy: 1.1732250824148374
Energy: 0.9628159773553088
Energy: 1.108156275447199
Energy: 1.1786324584968737
Energy: 1.108156275447199
Energy: 0.9703957729183309
Energy: 1.000431149538897
Energy: 0.9867158370870673
Energy: 1.0004311495420521
Energy: 0.9719207734817331
Energy: 1.105044313913189
Energy: 0.9925745356320338
Energy: 1.1050443139110853
Energy: 0.9717656773960264
Energy: 0.9999703446619322
Energy: 0.9844389392685855
Energy: 0.9999703446619322
Energy: 0.9999654823923729
Energy: 1.0002882926525862
Energy: 0.9934933991155346
Energy: 1.0002882926515346
Energy: 0.9998771779838979
Energy: 1.102201016968038
Energy: 0.9808109194383144
Energy: 1.10220101696909
Energy: 0.9720497155933462
Energy: 1.000254122337462
Energy: 0.9910370801137497
Energy: 1.0002541223385135
Energy: 0.9716631446562727
Energy: 1.1085493673011668
Energy: 0.9931455030248484
Energy: 1.1085493672990634
Energy: 0.9692434928188014
Energy: 0.999765415110903
Energy: 0.9936463439584963
Energy: 0.9997654151098513
Energy: 0.9626530009369354
Energy: 1.018303276443253
Energy: 1.0029317156791109
Energy: 1.0183032764422013
Energy: 1.0025725310826994
Energy: 1.0710687291259138
Energy: 0.9938105594181206
Energy: 1.0710687291259138
Energy: 0.9796757888466793
Energy: 1.0262543921420906
Energy: 1.0074566294711504
Energy: 1.0262543921420906
Energy: 1.0958876857027013
Energy: 0.9997060891980574
Energy: 0.9714026070258994
Energy: 0.9997060891970055
Energy: 1.150409023689442
Energy: 1.1191358946717893
Energy: 1.2095388470784574
Energy: 1.1191358946717893
Energy: 1.013015806168196
Energy: 1.1732175329525238
Energy: 0.9728676011364575
Energy: 1.1732175329546273
Energy: 0.9797206436323758
Energy: 1.026133620131991
Energy: 1.1602471493039095
Energy: 1.026133620130939
Energy: 0.9845118856614479
Energy: 1.1732250824179926
Energy: 0.9875613690983154
Energy: 1.1732250824158892
Energy: 0.9628159773563606
Energy: 1.108156275447199
Energy: 1.1786324584958219
Energy: 1.108156275447199
Energy: 0.9703957729183309
Energy: 1.000431149538897
Energy: 0.9867158370870673
Energy: 1.0004311495410003
Energy: 0.9719207734827848
Energy: 1.1050443139110853
Energy: 1.009464052273052
Energy: 1.1050443139110853

minimum gb energy = 0.9626530009369354 eV
minimum distance =  2.28062453785607 Angstroms
sigma value = 17


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

Energy: 1.0039072109821328
Energy: 1.0036785951407046
Energy: 1.1987316895567994
Energy: 1.0036785951400544
Energy: 1.1128440455144646
Energy: 0.982813306446662
Energy: 0.9613067128790855
Energy: 0.9828133064473121
Energy: 0.9563570315137856
Energy: 0.9974567644960921
Energy: 1.0887537621083896
Energy: 0.9974567644960921
Energy: 1.0130427544226213
Energy: 0.9608627658017399
Energy: 0.9636378624771851
Energy: 0.9608627658017399
Energy: 0.9542963694822378
Energy: 1.0572774147615356
Energy: 1.200165166231207
Energy: 1.0572774147615356
Energy: 0.9690144224121289
Energy: 1.095728292163016
Energy: 0.971757897783383
Energy: 1.095728292163016
Energy: 0.9587017119852581
Energy: 1.0468370104707685
Energy: 0.9881976486252408
Energy: 1.0468370104701183
Energy: 0.9643143315375798
Energy: 1.028828011565331
Energy: 0.9599176429692983
Energy: 1.028828011565331
Energy: 0.9832792300760118
Energy: 1.027624141446084
Energy: 0.9737257915050289
Energy: 1.027624141446734
Energy: 0.982826206804294
Energy: 1.0268885779926917
Energy: 0.9607764710602142
Energy: 1.0268885779907415
Energy: 0.9583214386204759
Energy: 1.008780852991629
Energy: 0.9606695568178812
Energy: 1.0087808529896787
Energy: 0.956674965266943
Energy: 1.0350544696654513
Energy: 0.9565502248384345
Energy: 1.0350544696667514
Energy: 0.9676807224979914
Energy: 1.149031866591841
Energy: 0.9625573679188238
Energy: 1.149031866591841
Energy: 0.9545391166627128
Energy: 1.0579980767916388
Energy: 0.9940160517728951
Energy: 1.0579980767916388
Energy: 0.9627322149362313
Energy: 0.9629127743086181
Energy: 0.9986281076206033
Energy: 0.9629127743079682
Energy: 0.9569808734048403
Energy: 0.9964825777253205
Energy: 1.2003993511759146
Energy: 0.9964825777240203
Energy: 0.9756231941870418
Energy: 0.9630896047817794
Energy: 0.962292218415309
Energy: 0.9630896047817794
Energy: 0.9620771614192122
Energy: 1.1006220187405031
Energy: 0.9836197193564772
Energy: 1.1006220187437536
Energy: 1.103644509270708
Energy: 1.164058386050361
Energy: 0.9614071158604147
Energy: 1.1640583860523115
Energy: 0.970151581120291
Energy: 0.9969282947897269
Energy: 1.0238011702366259
Energy: 0.9969282947864765
Energy: 0.9695338425920921
Energy: 1.1073290650713243
Energy: 0.9626434039179292
Energy: 1.1073290650713243
Energy: 0.9635932425812009
Energy: 1.0382373008740853
Energy: 1.1455116786984785
Energy: 1.0382373008747354
Energy: 0.9865094542068781
Energy: 0.9693656228489496
Energy: 0.9710255873856692
Energy: 0.9693656228482994
Energy: 0.9602137638616484
Energy: 1.0443673664027597
Energy: 1.1104716570421054
Energy: 1.0443673664040598
Energy: 1.0053573532581277
Energy: 1.0014564876195602
Energy: 0.9631762100093395
Energy: 1.0014564876182601
Energy: 0.9633281846089974
Energy: 1.0562984062118224
Energy: 0.9746602613488162
Energy: 1.0562984062111722
Energy: 1.0905916679472283
Energy: 1.160042732472996
Energy: 0.9594861603031826
Energy: 1.1600427324787876
Energy: 0.9937792362256231
Energy: 1.2202862321900267
Energy: 0.9620253763153479
Energy: 1.2202862321887267
Energy: 0.9922633112511497
Energy: 1.0581101615642912
Energy: 0.9560172084492723
Energy: 1.058110161563641
Energy: 0.9635416705523212
Energy: 1.0151230159719746
Energy: 0.9933701532319019
Energy: 1.0151230159674243
Energy: 0.9548849377873158
Energy: 1.0580129817627935
Energy: 0.9573338299511273
Energy: 1.0580129817621433
Energy: 0.9609242101993474
Energy: 1.0081017090665754
Energy: 0.9612297575259973
Energy: 1.0081017090665754
Energy: 0.9594851340808335
Energy: 1.0280702374410624
Energy: 1.1059142971062539
Energy: 1.0280702374384623
Energy: 0.9928501011718706
Energy: 1.2312087927753472
Energy: 0.9703149649744666
Energy: 1.2312087927746973
Energy: 0.9573665004158699
Energy: 1.0022493065899967
Energy: 0.9848869956868346
Energy: 1.0022493065906468
Energy: 0.9914126928759701
Energy: 1.0446252245797392
Energy: 0.9600026962121632
Energy: 1.0446252245784389
Energy: 0.9709648117428467
Energy: 1.0983436919853213
Energy: 0.9696296906057907
Energy: 1.0983436919853213
Energy: 1.2015368199177783
Energy: 1.055407277920545
Energy: 0.9631103627477949
Energy: 1.0554072779192447

minimum gb energy = 0.9542963694822378 eV
minimum distance =  2.28098946301057 Angstroms
sigma value = 89


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

Energy: 0.8832024792654227
Energy: 0.8828368935602986
Energy: 1.31656218931055
Energy: 0.8828368935619993
Energy: 0.8890560946692331
Energy: 0.9001315148630994
Energy: 0.8876113578381728
Energy: 0.9001315148613985
Energy: 0.8884458707540666
Energy: 1.0246061525734436
Energy: 0.893687071860963
Energy: 1.0246061525717427
Energy: 0.8904817395701972
Energy: 0.9002170533022014
Energy: 0.8873566264447199
Energy: 0.9002170533022014
Energy: 0.8889437254477058
Energy: 0.9760854254844054
Energy: 0.8890775434906939
Energy: 0.9760854254861062
Energy: 0.889759236631151
Energy: 0.8842411772939825
Energy: 0.8854416718630728
Energy: 0.8842411772922816
Energy: 0.8886757377830156
Energy: 1.0250809737249362
Energy: 0.8878790631296807
Energy: 1.0250809737266373
Energy: 0.9108976518370148
Energy: 1.0234232481412986
Energy: 0.8876778891739922
Energy: 1.0234232481174854
Energy: 0.888908488629449
Energy: 0.9755991701961573
Energy: 0.8882525554176695
Energy: 0.9755991701961573
Energy: 0.9024842779273299
Energy: 1.2223208132575938
Energy: 0.891578947669982
Energy: 1.2223208132558931
Energy: 0.888827431653172
Energy: 0.9011621704224491
Energy: 0.8892858605515465
Energy: 0.9011621704224491
Energy: 0.8895347768582819
Energy: 1.0221335664505053
Energy: 0.8877903080116208
Energy: 1.0221335664505053
Energy: 0.8891707933550126
Energy: 0.8861802365843018
Energy: 0.9110222093016979
Energy: 0.8861802365843018
Energy: 0.8912680334271149
Energy: 0.9752239268663591
Energy: 0.8918431423073986
Energy: 0.9752239268663591
Energy: 0.88984592848255
Energy: 0.8862245976763216
Energy: 0.8890631073099132
Energy: 0.8862245976746206

minimum gb energy = 0.8828368935602986 eV
minimum distance =  2.30877993847847 Angstroms
sigma value = 13


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

Energy: 0.8549590381622071
Energy: 1.1529572595729245
Energy: 1.255111202692397
Energy: 1.1529572595835538
Energy: 1.0017246210320723
Energy: 1.1596035579266235
Energy: 0.8283692527057229
Energy: 1.1596035579223463
Energy: 0.829174827940685
Energy: 1.1735786642487973
Energy: 1.2506442041203911
Energy: 1.1735786642545007
Energy: 0.8462027687355833
Energy: 1.1595885258461125
Energy: 0.8254317396273966
Energy: 1.1595885258404415
Energy: 0.8354771141550121
Energy: 0.9896253677764647
Energy: 0.8438224210459881
Energy: 0.9896253677729001
Energy: 0.8442905480276736
Energy: 1.000962852344124
Energy: 0.8426731174873391
Energy: 1.0009628523391336
Energy: 0.8355629751272521
Energy: 1.0508801378059982
Energy: 1.0264702761044027
Energy: 1.0508801378059982
Energy: 0.8370412559070103
Energy: 1.0007142429478721
Energy: 0.8425156441769688
Energy: 1.0007142429485851
Energy: 0.8355793964410257
Energy: 1.0506913511866178
Energy: 0.9941375381915987
Energy: 1.0506913511958857
Energy: 1.0170994310411727
Energy: 1.0006246870306874
Energy: 0.8254653493855871
Energy: 1.0006246870385296
Energy: 0.8355376884129934
Energy: 0.906540611693866
Energy: 0.8374215152288871
Energy: 0.9065406116831721
Energy: 1.117764384690348
Energy: 1.06345546552519
Energy: 0.8243123383450749
Energy: 1.063455465523764
Energy: 0.8608894973617092
Energy: 0.8411377427286441
Energy: 0.8444469457613492
Energy: 0.8411377427272183
Energy: 1.1372764090010261
Energy: 1.0632850947673307
Energy: 0.8244606229091092
Energy: 1.0632850947630532
Energy: 0.8355079038040932
Energy: 0.8289693386490598
Energy: 0.8381374964022553
Energy: 0.8289693386497726
Energy: 0.8558990131966312
Energy: 1.0635990215813427
Energy: 0.8269667606262987
Energy: 1.0635990215834814
Energy: 0.8453385006878614
Energy: 0.8294505108467607
Energy: 0.8274353071362721
Energy: 0.8294505108417702
Energy: 0.845104294451186
Energy: 0.8893555175488489
Energy: 0.8535301756802088
Energy: 0.8893555175495618
Energy: 0.8453851857333536
Energy: 0.8428245195790003
Energy: 0.8536614881495176
Energy: 0.8428245195868423
Energy: 0.8454758433733682
Energy: 0.8427275486205106
Energy: 0.8536694323049896
Energy: 0.8427275486197977
Energy: 0.8454140843427165
Energy: 0.8892607055167959
Energy: 0.853535656437341
Energy: 0.8892607055089539
Energy: 0.845373375489401
Energy: 0.8293219514296876
Energy: 0.8277439434771383
Energy: 0.8293219514325393
Energy: 0.8559213382228381
Energy: 1.0636175898911364
Energy: 0.8276544606889089
Energy: 1.063617589894701
Energy: 0.835483724350379
Energy: 0.829020963493299
Energy: 0.8310966510641707
Energy: 0.8290209634961506
Energy: 1.1371721778980006
Energy: 1.0633333268795395
Energy: 0.8243107570953947
Energy: 1.0633333268809653
Energy: 0.8609306059093841
Energy: 0.8412119262964937
Energy: 0.8308580102969888
Energy: 0.84121192630291
Energy: 1.1207983222439615
Energy: 1.0634629933711497
Energy: 0.8241678047253176
Energy: 1.0634629933740012
Energy: 0.8355536535755094
Energy: 0.9063051488731729
Energy: 0.8413566763006809
Energy: 0.9063051488753117
Energy: 1.0168406895471735
Energy: 1.0003957786875033
Energy: 0.8252745665980534
Energy: 1.00039577869891
Energy: 0.8356258447669755
Energy: 1.0506593494335965
Energy: 0.9938088688320751
Energy: 1.0506593494357352
Energy: 0.837543224798611
Energy: 1.0005608787420472
Energy: 0.8425690705257038
Energy: 1.0005608787413345
Energy: 0.835627463601551
Energy: 1.05116603629934
Energy: 1.1336066948225831
Energy: 1.0511660362943498
Energy: 0.8441775642760615
Energy: 1.0010537696859354
Energy: 0.8426240479602828
Energy: 1.0010537696873614
Energy: 0.8354867053763603
Energy: 0.9898961544110834
Energy: 1.1523050749649808
Energy: 0.9898961544160739
Energy: 0.8459200323682255
Energy: 1.1597873405214916
Energy: 0.8254362818453371
Energy: 1.1597873405136494

minimum gb energy = 0.8241678047253176 eV
minimum distance =  2.26063095537671 Angstroms
sigma value = 37


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

Energy: 0.9112145304953357
Energy: 0.9103249801713433
Energy: 1.1661954634772056
Energy: 0.9103249801725698
Energy: 0.9011058394711677
Energy: 1.0311604199630389
Energy: 0.7547927364809093
Energy: 1.0311604199605857
Energy: 0.7695114706102193
Energy: 1.1349182784612057
Energy: 1.0764109597046214
Energy: 1.1349182784599787
Energy: 0.884688131534778
Energy: 0.9028675567050198
Energy: 0.7616323587377687
Energy: 0.9028675567037933
Energy: 0.7595878269614623
Energy: 1.0306441222458704
Energy: 0.7766611379133744
Energy: 1.0306441222458704
Energy: 0.7776017979783235
Energy: 0.9022658941006548
Energy: 0.8865087735396939
Energy: 0.9022658941006548
Energy: 0.763885147219072
Energy: 1.3056010149475332
Energy: 1.1390789394126843
Energy: 1.3056010149475332
Energy: 0.7483325819203682
Energy: 0.774126382610756
Energy: 0.7753441533107015
Energy: 0.7741263826095295
Energy: 0.7562452789675819
Energy: 0.7731190957313084
Energy: 1.010931863572857
Energy: 0.7731190957313084
Energy: 1.08058591515423
Energy: 1.133166260647638
Energy: 0.886578790979527
Energy: 1.133166260647638
Energy: 0.7682525527541463
Energy: 0.9518437173942105
Energy: 0.8872391711209956
Energy: 0.9518437173929839
Energy: 1.0672445051762178
Energy: 0.7736847469078366
Energy: 0.7615791200124061
Energy: 0.7736847469053836
Energy: 0.8892841213731632
Energy: 0.9023136819783697
Energy: 0.8981792112153371
Energy: 0.9023136819795963
Energy: 1.145194577000914
Energy: 0.9258257588221057
Energy: 0.7526101790168986
Energy: 0.9258257588221057
Energy: 0.9108259781955346
Energy: 0.9267740264674394
Energy: 0.7484315283257685
Energy: 0.926774026468666
Energy: 0.912711960623171
Energy: 0.7738703690927886
Energy: 0.7598958682090768
Energy: 0.7738703690927886
Energy: 0.8893501708218379
Energy: 1.1279791467272438
Energy: 0.7670758936239113
Energy: 1.1279791467247906
Energy: 0.8904307942753
Energy: 0.9520209298793072
Energy: 0.7592173603391573
Energy: 0.9520209298780807
Energy: 0.7598439245654498
Energy: 0.7756549726988392
Energy: 0.7562637970153427
Energy: 0.7756549727000658
Energy: 0.7563725970953317
Energy: 0.7736444493607973
Energy: 0.8856411622743079
Energy: 0.7736444493620239

minimum gb energy = 0.7483325819203682 eV
minimum distance =  2.31116035074449 Angstroms
sigma value = 25


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

Energy: 0.7001418509016271
Energy: 1.0790442511675813
Energy: 0.9214945486662363
Energy: 1.0790442511675813
Energy: 0.8861781073072963
Energy: 1.0815784258455985
Energy: 0.6724227855616971
Energy: 1.0815784258455985
Energy: 0.6686048043699364
Energy: 0.6685145487197327
Energy: 0.9265306696640764
Energy: 0.6685145487187748
Energy: 0.6740185281719769
Energy: 1.0815469592046616
Energy: 0.6723428882941651
Energy: 1.081546959203704
Energy: 0.671818576825956
Energy: 1.0812286188071352
Energy: 0.660449710140717
Energy: 1.0812286188071352
Energy: 0.6589077166516316
Energy: 1.081361856128815
Energy: 0.6721459107356353
Energy: 1.0813618561297729
Energy: 0.6743287324305453
Energy: 0.87169218018405
Energy: 0.6744748711229597
Energy: 0.8716921801850078
Energy: 0.6636382048157884
Energy: 0.8911206428249625
Energy: 0.6694788301941414
Energy: 0.8911206428249625
Energy: 0.6718576722357812
Energy: 1.0812315535886883
Energy: 0.896639831932878
Energy: 1.0812315535886883
Energy: 0.6591462289629229
Energy: 0.8718176532482403
Energy: 0.7010374888770349
Energy: 0.8718176532472826
Energy: 0.6743380235439557
Energy: 0.6684425325194112
Energy: 1.0897560268151818
Energy: 0.6684425325212832
Energy: 0.9237965562594512
Energy: 1.1138006508089473
Energy: 0.669644249306245
Energy: 1.1138006508079894
Energy: 0.6718353258444527
Energy: 1.0815615261797216
Energy: 0.8788049737440558
Energy: 1.0815615261797216
Energy: 0.8989485337638393
Energy: 0.8712623396819591
Energy: 0.6723932285059185
Energy: 0.8712623396810012
Energy: 0.6742632713127268
Energy: 0.6682998954494672
Energy: 0.6590139590995875
Energy: 0.6682998954485094
Energy: 0.8978245143627155
Energy: 0.9698017743220426
Energy: 0.6752378518033143
Energy: 0.9698017743249159
Energy: 0.6718933617633146
Energy: 0.6996052131560483
Energy: 0.6637011984386959
Energy: 0.699605213157006
Energy: 0.8930276759167483
Energy: 0.8786543202485577
Energy: 0.6725541272995643
Energy: 0.8786543202485577
Energy: 0.7025622134917636
Energy: 0.8717234872703425
Energy: 0.6591936892696322
Energy: 0.8717234872722582
Energy: 1.0877165950652075
Energy: 0.9703341385321551
Energy: 0.6750681293522967
Energy: 0.9703341385311974
Energy: 0.6721792241314708
Energy: 0.8916586367167322
Energy: 0.6815672310024222
Energy: 0.89165863671769
Energy: 0.668874455615889
Energy: 0.6821982268326444
Energy: 0.6721392028488321
Energy: 0.6821982268326444
Energy: 0.6742108142887757
Energy: 0.8713413727753203
Energy: 0.9066021067925082
Energy: 0.8713413727743625
Energy: 0.6641615346443315
Energy: 0.970013085953306
Energy: 0.6751237295882032
Energy: 0.970013085953306
Energy: 0.6784428270116047
Energy: 0.9689292776571314
Energy: 0.9035437317607837
Energy: 0.9689292776571314
Energy: 0.6594740658981834
Energy: 0.7001056192989206
Energy: 0.6738486034808612
Energy: 0.7001056192989206

minimum gb energy = 0.6589077166516316 eV
minimum distance =  2.31594476865157 Angstroms
sigma value = 41


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

Energy: 0.9350315573665627
Energy: 0.9364525834906847
Energy: 1.0639247730600434
Energy: 0.9364525834898995
Energy: 0.9732778154860112
Energy: 0.933641310564059
Energy: 0.5989525193792264
Energy: 0.9336413105648442
Energy: 0.6126955585341183
Energy: 0.932373052938736
Energy: 1.0651206842075893
Energy: 0.9323730529395211
Energy: 0.7902644669275811
Energy: 0.9332701094404379
Energy: 0.5989479912796578
Energy: 0.9332701094412231
Energy: 0.5962365675142931
Energy: 0.9435882225030915
Energy: 0.5993731291003915
Energy: 0.9435882225015211
Energy: 0.606824382869762
Energy: 0.9334406129356864
Energy: 0.5988577276182944
Energy: 0.9334406129349011
Energy: 0.5984778418084793
Energy: 0.9333477821220184
Energy: 0.6074573634157255
Energy: 0.9333477821212331
Energy: 0.5928569896349126
Energy: 0.7739561877465093
Energy: 0.5967340332709213
Energy: 0.7739561877449388
Energy: 0.6002620340962648
Energy: 0.7739648512426941
Energy: 0.7897743753998906
Energy: 0.7739648512458349
Energy: 0.596421746772321
Energy: 0.9326348690225367
Energy: 0.6132375224587702
Energy: 0.932634869023322
Energy: 0.5982873457689232
Energy: 0.9335430482557362
Energy: 1.0986105180182766
Energy: 0.9335430482565213
Energy: 0.5932127800289609
Energy: 0.9367315854434187
Energy: 0.9357372097800739
Energy: 0.9367315854426335
Energy: 0.6002660103103307
Energy: 0.7739782906614959
Energy: 1.0979244047581804
Energy: 0.7739782906583549
Energy: 0.81056180904035
Energy: 0.91801569717873
Energy: 0.6131548728131063
Energy: 0.9180156971795153
Energy: 0.5986657266391916
Energy: 0.933807404151543
Energy: 0.9682175501415142
Energy: 0.9338074041507577
Energy: 0.7917636543218377
Energy: 0.7732286893558133
Energy: 0.5969325781783639
Energy: 0.7732286893565984
Energy: 0.600465605765697
Energy: 1.0649773300874756
Energy: 0.7639821046498472
Energy: 1.0649773300882608
Energy: 0.7957866085780819
Energy: 0.9165083731912653
Energy: 0.5988931994139927
Energy: 0.9165083731904802
Energy: 0.5984573769334669
Energy: 0.7747031416669785
Energy: 0.6043596801489016
Energy: 0.7747031416654081
Energy: 0.8005461557566067
Energy: 0.7742634612834735
Energy: 0.6026055410890601
Energy: 0.7742634612834735
Energy: 0.6147664148371981
Energy: 0.6137535722842559
Energy: 0.5964291755656428
Energy: 0.6137535722858262
Energy: 1.0974515758781032
Energy: 1.1859669447323986
Energy: 0.5990441790436406
Energy: 1.185966944733184
Energy: 0.9369076295009502
Energy: 0.7743666984030141
Energy: 0.6041660276707576
Energy: 0.7743666984006585
Energy: 0.9728061413945457
Energy: 0.7737584039130383
Energy: 0.602692342658485
Energy: 0.7737584039098975
Energy: 0.6146367471143204
Energy: 0.9115643894414194
Energy: 0.6135796388335053
Energy: 0.9115643894429898
Energy: 0.9661160031785512
Energy: 1.1825505807660015
Energy: 0.5991027187533853
Energy: 1.1825505807667864
Energy: 0.5985160043999421
Energy: 0.773148436200275
Energy: 0.8016191109437799
Energy: 0.7731484362010601
Energy: 0.596677907427665
Energy: 0.7741668963304251
Energy: 0.6027796945020293
Energy: 0.7741668963288547
Energy: 0.6005089966127252
Energy: 0.9090437974272354
Energy: 0.7987168037409041
Energy: 0.9090437974264501
Energy: 0.6030689935187244
Energy: 1.0856137653376488
Energy: 0.601156100058078
Energy: 1.0856137653376488
Energy: 0.6036106282517022
Energy: 0.7738501590141209
Energy: 0.799172685741417
Energy: 0.7738501590125505
Energy: 0.5931721729860657
Energy: 0.6138692592601429
Energy: 0.61670050948959
Energy: 0.6138692592585725

minimum gb energy = 0.5928569896349126 eV
minimum distance =  2.30030537051729 Angstroms
sigma value = 15


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

Energy: 0.907991234515733
Energy: 0.5605172650554505
Energy: 0.9750502670626788
Energy: 0.5605172650627677
Energy: 1.036781899325213
Energy: 0.689878691071237
Energy: 0.5535984118465281
Energy: 0.6898786910732327
Energy: 0.6395576485607385
Energy: 0.7645436417527423
Energy: 0.5639061733885968
Energy: 0.764543641754738
Energy: 0.9245481077300534
Energy: 0.7626651927829019
Energy: 0.5532959912227532
Energy: 0.762665192786893
Energy: 0.6228860254704893
Energy: 0.5553115338561504
Energy: 0.5605771489527341
Energy: 0.5553115338561504
Energy: 0.9220668689166681
Energy: 0.6900271173399032
Energy: 0.5531701179068332
Energy: 0.6900271173445596
Energy: 0.5572965932415231
Energy: 0.8327192464015859
Energy: 0.6321901810401136
Energy: 0.8327192464029164
Energy: 0.6316190286336135
Energy: 0.8306966123551908
Energy: 0.5578254838561539
Energy: 0.8306966123551908
Energy: 0.5543060626929176
Energy: 0.5614116407789318
Energy: 0.7804838185241965
Energy: 0.5614116407776014
Energy: 0.6320464097676365
Energy: 0.6215716278610587
Energy: 0.6231933586721738
Energy: 0.6215716278876664
Energy: 0.5533274799878118
Energy: 0.69164435699831
Energy: 0.9249653461390123
Energy: 0.69164435699831
Energy: 0.5624249423840779
Energy: 0.7649431866626871
Energy: 0.6400382753758311
Energy: 0.7649431866580306
Energy: 0.5544147052783205
Energy: 0.5643785339148748
Energy: 1.0498768814374164
Energy: 0.5643785339108837
Energy: 0.5573271136432727
Energy: 0.5552214617380661
Energy: 0.8369013701430646
Energy: 0.555221461734075
Energy: 0.5530345106088314
Energy: 0.6896731960759124
Energy: 1.1036358873243728
Energy: 0.689673196081899
Energy: 0.7282167951862015
Energy: 0.7650162968594152
Energy: 0.6400086562615026
Energy: 0.7650162968627412
Energy: 0.5543354042667537
Energy: 0.6325021493436782
Energy: 1.0472856592406008
Energy: 0.6325021493443433
Energy: 0.7267667314805502
Energy: 0.6091045218855052
Energy: 0.6232144361025654
Energy: 0.6091045218881659
Energy: 0.5535132879766967
Energy: 0.6214126410791038
Energy: 0.9207469931668866
Energy: 0.6214126410797689
Energy: 0.792223799526782
Energy: 0.6895069754232123
Energy: 0.5577717497135437
Energy: 0.6895069754218818
Energy: 0.5591995280129516
Energy: 0.6359926679648061
Energy: 0.7582177198729922
Energy: 0.6359926679721233
Energy: 0.790962960931048
Energy: 0.5620852287190429
Energy: 0.5557624884880688
Energy: 0.5620852287290209
Energy: 0.6242697578724085
Energy: 0.5536494847622802
Energy: 0.6293794769847555
Energy: 0.5536494847589543
Energy: 1.0868684210913557
Energy: 0.6897232708437055
Energy: 0.5536215056807943
Energy: 0.68972327084171
Energy: 0.6409163293838313
Energy: 0.5699077574557191
Energy: 0.6352433521529685
Energy: 0.5699077574510626
Energy: 1.05088347028475
Energy: 0.5600055548079546
Energy: 0.5559863791768304
Energy: 0.5600055548185976
Energy: 0.9091986847192722
Energy: 0.5577958772379715
Energy: 0.5542507109876449
Energy: 0.5577958772399672
Energy: 1.1579695666320082
Energy: 0.6899343181413958
Energy: 0.5535745277739591
Energy: 0.6899343181467175
Energy: 0.6408363650171071
Energy: 0.6221525483577464
Energy: 0.5590159536985045
Energy: 0.6221525483643984
Energy: 0.9184661640650612
Energy: 0.6325843220164714
Energy: 0.5558714183195023
Energy: 0.6325843220151411
Energy: 0.6243517164207022
Energy: 0.6057408482746544
Energy: 0.7243870102355597
Energy: 0.605740848278585
Energy: 0.9187901465767261
Energy: 0.621259271762971
Energy: 0.5546257490035582
Energy: 0.6212592717623059
Energy: 0.5590739534644578
Energy: 0.6221031337215821
Energy: 0.7899762879149493
Energy: 0.6221031337162606
Energy: 0.6292814894339351
Energy: 0.636040996338621
Energy: 0.5610257038205567
Energy: 0.6360409963379557
Energy: 0.5506655717576662
Energy: 0.6059261791750559
Energy: 0.790528034035067
Energy: 0.6059261791730601
Energy: 0.6271281851541927
Energy: 0.5531400112113174
Energy: 0.6257590686040849
Energy: 0.5531400112173043
Energy: 0.5543622719826315
Energy: 0.6225421206707965
Energy: 1.0851829942296716
Energy: 0.6225421206668053

minimum gb energy = 0.5506655717576662 eV
minimum distance =  2.30800767907375 Angstroms
sigma value = 85


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

Energy: 0.8284829929489509
Energy: 0.5320060914143133
Energy: 0.654017066986472
Energy: 0.5320060914148903
Energy: 1.0371272381242023
Energy: 0.6318744660741212
Energy: 0.49721166319733223
Energy: 0.6318744660735444
Energy: 0.8032343872432287
Energy: 0.6940388772475399
Energy: 0.4948853167396272
Energy: 0.6940388772504245
Energy: 0.9252327822094175
Energy: 0.62987644135705
Energy: 0.49718518121355115
Energy: 0.6298764413582039
Energy: 0.5833587887300007
Energy: 0.6742256746477792
Energy: 0.504665508513329
Energy: 0.6742256746443176
Energy: 0.8231901525181883
Energy: 0.6925789908933463
Energy: 0.49687495492331624
Energy: 0.6925789908921927
Energy: 0.5575145464450273
Energy: 0.7530537295588118
Energy: 0.5666783392415353
Energy: 0.7530537295588118
Energy: 0.7886977873805537
Energy: 0.6298087643223563
Energy: 0.503013736875098
Energy: 0.629808764324664
Energy: 0.502717963870786
Energy: 0.7331562995513449
Energy: 0.7001186959498596
Energy: 0.7331562995519219
Energy: 0.6671425038983277
Energy: 0.7476243203957942
Energy: 0.5576779875835325
Energy: 0.747624320396948
Energy: 0.4978180147491719
Energy: 0.6299955417857787
Energy: 0.8235807916385265
Energy: 0.6299955417857787
Energy: 0.5460500460486278
Energy: 0.577169217208082
Energy: 0.5834927935548975
Energy: 0.577169217208082
Energy: 0.49697719588181544
Energy: 0.7333203374628474
Energy: 0.933882458316597
Energy: 0.7333203374616936
Energy: 0.4920641665419382
Energy: 0.6943503648565874
Energy: 0.8033192462459671
Energy: 0.6943503648554336
Energy: 0.4978509754889449
Energy: 0.6298390610930326
Energy: 1.1301581888554646
Energy: 0.6298390610936095
Energy: 0.4819894409030917
Energy: 0.5229252822949237
Energy: 0.7666378427735241
Energy: 0.5229252822972313
Energy: 0.4970263091280339
Energy: 0.7334825429978094
Energy: 1.0805155184625668
Energy: 0.7334825429989632
Energy: 0.6396428757162071
Energy: 0.6942943490159146
Energy: 0.8034238895481658
Energy: 0.6942943490147607
Energy: 0.4977494413373588
Energy: 0.6298161080524659
Energy: 1.0277707490978596
Energy: 0.6298161080524659
Energy: 0.6273428243608236
Energy: 0.523569749684181
Energy: 0.5832636142121866
Energy: 0.5235697496836041
Energy: 0.49720653599711795
Energy: 0.5701803028654059
Energy: 0.9197918733550149
Energy: 0.5701803028648289
Energy: 0.6896709144275102
Energy: 0.6297581457456424
Energy: 0.5577518165582868
Energy: 0.6297581457433348
Energy: 0.5037533952154454
Energy: 0.5750016857113293
Energy: 0.7887143289334005
Energy: 0.5750016857113293
Energy: 0.6861536402982129
Energy: 0.5378256991167782
Energy: 0.5030280257548333
Energy: 0.5378256991173552
Energy: 0.5584348889754444
Energy: 0.575383692616487
Energy: 0.667805913127189
Energy: 0.5753836926170639
Energy: 0.9383669629785965
Energy: 0.6298357406324202
Energy: 0.4989701918854093
Energy: 0.6298357406324202
Energy: 0.5835954840037978
Energy: 0.520567002460118
Energy: 0.545865394065093
Energy: 0.520567002460695
Energy: 0.958819183572365
Energy: 0.5379350455644613
Energy: 0.49728791996066163
Energy: 0.5379350455633074
Energy: 0.8039386676267244
Energy: 0.5849052855143226
Energy: 0.5574167264275133
Energy: 0.5849052855166303
Energy: 1.1292963741212372
Energy: 0.6296625539743198
Energy: 0.49895540123634213
Energy: 0.629662553973166
Energy: 0.8284208238067039
Energy: 0.5289229348905001
Energy: 0.48187388719104723
Energy: 0.528922934891654
Energy: 1.036483666988655
Energy: 0.5365027934448731
Energy: 0.49733850715338596
Energy: 0.5365027934448731
Energy: 0.8039527771629064
Energy: 0.5848410580405127
Energy: 0.49309480684548784
Energy: 0.5848410580422435
Energy: 1.0303897052179625
Energy: 0.629694681069157
Energy: 0.4989863759903551
Energy: 0.6296946810680032
Energy: 0.583475060790394
Energy: 0.5205480739548188
Energy: 0.6277193043694606
Energy: 0.5205480739542419
Energy: 0.7894444413526555
Energy: 0.5981331456773336
Energy: 0.49760394611177644
Energy: 0.5981331456784872
Energy: 0.5586725163935801
Energy: 0.6298542513144463
Energy: 0.6884027936597319
Energy: 0.6298542513138694
Energy: 0.7887870200094333
Energy: 0.5751465962173961
Energy: 0.5044639057282019
Energy: 0.5751465962185499
Energy: 0.5039092075194356
Energy: 0.5203494240952344
Energy: 0.6862983064743186
Energy: 0.5203494240946576
Energy: 0.5448541983445094
Energy: 0.607008108254896
Energy: 0.5589892281816053
Energy: 0.6070081082531653
Energy: 0.49880514670768716
Energy: 0.6297990718745948
Energy: 0.9318961109251968
Energy: 0.629799071874018
Energy: 0.5458708007679418
Energy: 0.5203937392753539
Energy: 0.5843815565558491
Energy: 0.5203937392742001
Energy: 0.49816916117042537
Energy: 0.520347214964542
Energy: 0.9625503541992351
Energy: 0.5203472149605034

minimum gb energy = 0.48187388719104723 eV
minimum distance =  2.31632787047669 Angstroms
sigma value = 113


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

Energy: 0.015393125861671323
Energy: 0.015828885387609397
Energy: 1.5715201564340116
Energy: 0.015828885387609397
Energy: 0.5680217766217925
Energy: 0.2679762861642935
Energy: 0.2686780287284316
Energy: 0.26797628615564506
Energy: 0.015393125861671323
Energy: 0.015828885388028267
Energy: 1.5715201564340116
Energy: 0.015828885388028267
Energy: 0.5680217766217925
Energy: 0.26797628615564506
Energy: 0.268678029154964
Energy: 0.2679762861552016
Energy: 0.015393125861671323
Energy: 0.015828885387609397
Energy: 1.5715201564335677
Energy: 0.015828885387609397
Energy: 0.5680217766213737
Energy: 0.2679762861560639
Energy: 0.26867802863004653
Energy: 0.26797628615564506

minimum gb energy = 0.015393125861671323 eV
minimum distance =  2.54611406170291 Angstroms
sigma value = 1