Model name: model_name=EAM_MagneticCubic_DudarevDerlet_2005_Fe__MO_135034229282_002
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.8664998710155487
cohesive_energy=4.316339468704817
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: 0.013268192556763167
Energy: 0.013862609450619498
Energy: 0.013367568207225063
Energy: 0.013862609450619498
Energy: 0.013268192556763167
Energy: 0.013862609450619498
Energy: 0.013862609450619498
Energy: 2.7563779114588804
Energy: 0.013862609450619498
Energy: 2.7563779114179257
Energy: 0.013862609450619498
Energy: 2.756377911440841
Energy: 0.013367568205257693
Energy: 0.013862609450619498
Energy: 0.013268192556763167
Energy: 0.013862609450619498
Energy: 0.013367568205756464
Energy: 0.013862609450619498
Energy: 0.013862609450619498
Energy: 2.7563779114910507
Energy: 0.013862609450619498
Energy: 2.7563779113038738
Energy: 0.013862609450619498
Energy: 2.756377911412578
Energy: 0.013268192556763167
Energy: 0.013862609450619498
Energy: 0.013367568205756464
Energy: 0.013862609450619498
Energy: 0.013268192556763167
Energy: 0.013862609450619498
Energy: 0.013862609450619498
Energy: 2.7563779114549734
Energy: 0.013862609450619498
Energy: 2.756377911370155
Energy: 0.013862609450619498
Energy: 2.756377911417455

minimum gb energy = 0.013268192556763167 eV
minimum distance =  2.21925417653142 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.6082323812506163
Energy: 1.4474043129651746
Energy: 1.381217606761925
Energy: 1.447404308298115
Energy: 1.6082323812518171
Energy: 1.4474043070308267
Energy: 1.5647865699263315
Energy: 1.41230242182949
Energy: 1.6085336268171766
Energy: 1.4123024215954822
Energy: 1.5647865353272217
Energy: 1.4123024189589646
Energy: 1.2974709735059824
Energy: 1.3890513402367846
Energy: 1.5906323635898112
Energy: 1.3890513449506678
Energy: 1.2974709735059824
Energy: 1.389051344383057
Energy: 1.6931187694480805
Energy: 1.4284113309479174
Energy: 1.3339239521241915
Energy: 1.428411437509028
Energy: 1.6931187694480805
Energy: 1.4284115912172104
Energy: 1.6587673717274993
Energy: 1.4471033843373748
Energy: 1.5492609123629466
Energy: 1.4471025334334997
Energy: 1.658767371786329
Energy: 1.4470976261987505
Energy: 1.6159124645156393
Energy: 1.3924803564282373
Energy: 1.3674736533550482
Energy: 1.3924803513411312
Energy: 1.6159124801704812
Energy: 1.3924803820484961
Energy: 1.6742191483236517
Energy: 1.3851507630082636
Energy: 1.3251645789600963
Energy: 1.3851507487370585
Energy: 1.6742191483248525
Energy: 1.385150750851588
Energy: 1.690457242261619
Energy: 1.4500692349239543
Energy: 1.3255681600005582
Energy: 1.4500743424942617
Energy: 1.6904572422640203
Energy: 1.4500732939585246
Energy: 1.6148360777911444
Energy: 1.4968002490084118
Energy: 1.3250706004865822
Energy: 1.4968002490696422
Energy: 1.6148360777899438
Energy: 1.496800249043229
Energy: 1.587032891092883
Energy: 1.3844516433329654
Energy: 1.3547870085835874
Energy: 1.3844516433341658
Energy: 1.587032891092883
Energy: 1.3844516433329654
Energy: 1.5834715425484804
Energy: 1.6618038661377894
Energy: 1.6029827891054886
Energy: 1.6617983534489063
Energy: 1.5834715424416814
Energy: 1.6617986380351524
Energy: 1.3680257621252792
Energy: 1.4472199639557985
Energy: 1.3626483479003055
Energy: 1.4472348498783356
Energy: 1.3680257621240783
Energy: 1.44720031650104
Energy: 1.6895108424589318
Energy: 1.6618006100992242
Energy: 1.4303352160381029
Energy: 1.6618039616571454
Energy: 1.6895108424660807
Energy: 1.6618027660700072
Energy: 1.353850205595311
Energy: 1.3835941395604605
Energy: 1.5864067045623955
Energy: 1.3835941396096851
Energy: 1.3538502055941106
Energy: 1.3835941396432476
Energy: 1.3283571462779447
Energy: 1.4265136397660738
Energy: 1.615421753722675
Energy: 1.4265135736579801
Energy: 1.3283571462119663
Energy: 1.4265135793415116
Energy: 1.3210466619998602
Energy: 1.4529993246386805
Energy: 1.6618515281268413
Energy: 1.452952552441812
Energy: 1.321046662598687
Energy: 1.452994789728336
Energy: 1.3249027243286813
Energy: 1.386299773086199
Energy: 1.5976826545636005
Energy: 1.3862997775216521
Energy: 1.3249027242458942
Energy: 1.3862997494389082
Energy: 1.352067222915034
Energy: 1.4003406211917249
Energy: 1.647128046019136
Energy: 1.4003406212001288
Energy: 1.3520672228718669
Energy: 1.4003406211593084
Energy: 1.463626780013709
Energy: 1.4482715846301175
Energy: 1.6448027653527204
Energy: 1.448266993020236
Energy: 1.4636267809617465
Energy: 1.4482536928049716
Energy: 1.336883273052654
Energy: 1.4215843355183502
Energy: 1.6823999381991515
Energy: 1.4216120862214425
Energy: 1.336883272985475
Energy: 1.42161290787248
Energy: 1.5987659391830642
Energy: 1.3872755894818696
Energy: 1.2973820177675592
Energy: 1.3872756280232041
Energy: 1.5987659393414342
Energy: 1.3872754114435275
Energy: 1.6088172346465401
Energy: 1.4015850412527469
Energy: 1.4836100212748289
Energy: 1.401584345117893
Energy: 1.6088215369178733
Energy: 1.4015833109733669
Energy: 1.381217559389304
Energy: 1.4474043090409587
Energy: 1.6082323812518171
Energy: 1.4474043129003966
Energy: 1.3812175594049116
Energy: 1.447404308336534

minimum gb energy = 1.2973820177675592 eV
minimum distance =  2.23084093908023 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 2.15012219009184
Energy: 1.5729758794065756
Energy: 1.464246201548628
Energy: 1.5729758734707413
Energy: 2.1501221900911576
Energy: 1.5729758756229537
Energy: 1.567391098365434
Energy: 1.4732238851148427
Energy: 1.6205189807006266
Energy: 1.4732238548383847
Energy: 1.5673910978255106
Energy: 1.4732239043551254
Energy: 1.4350222475353795
Energy: 1.5450198945712903
Energy: 1.680505250234588
Energy: 1.5450198950593446
Energy: 1.4350222477237662
Energy: 1.5450198945460232
Energy: 1.629045871825211
Energy: 1.476009517272626
Energy: 1.7440896277606164
Energy: 1.476009307506769
Energy: 1.6290458718504781
Energy: 1.4760094004002915
Energy: 1.625130045551001
Energy: 1.511435517981348
Energy: 1.679049374744665
Energy: 1.5114355179007972
Energy: 1.6251300370226724
Energy: 1.5114355182229693
Energy: 1.6253898208299196
Energy: 1.5094615055156293
Energy: 1.4378113864883653
Energy: 1.5094615055879856
Energy: 1.6253898208299196
Energy: 1.5094615054726381
Energy: 1.5328044034906951
Energy: 1.5073349754917857
Energy: 1.540901449219572
Energy: 1.5073349752706202
Energy: 1.5328044035466617
Energy: 1.5073349754563061
Energy: 1.433840929723538
Energy: 1.5026544028751307
Energy: 1.7252602976719562
Energy: 1.5026544028314561
Energy: 1.433840929724221
Energy: 1.5026544029304143
Energy: 1.5661493525493646
Energy: 1.4819772744535753
Energy: 1.5407368112408044
Energy: 1.4819771821614367
Energy: 1.5661493535944142
Energy: 1.4819772427907745
Energy: 1.6080614675114613
Energy: 1.548123819485535
Energy: 1.58622222286913
Energy: 1.5481238058302325
Energy: 1.6080614674493485
Energy: 1.5481238311572076
Energy: 1.508183682293009
Energy: 1.5627106430042497
Energy: 1.6813072359307304
Energy: 1.562710644007674
Energy: 1.5081836822629615
Energy: 1.5627106441305332
Energy: 1.8014635631654914
Energy: 1.508720330400425
Energy: 1.5322863999247038
Energy: 1.508720330513041
Energy: 1.801463563166857
Energy: 1.5087203308120258
Energy: 1.7240176153667963
Energy: 1.5055119944425397
Energy: 1.5076033923245844
Energy: 1.5055115917094406
Energy: 1.7240176153667963
Energy: 1.5055114910384348
Energy: 1.5224493917956006
Energy: 1.5486521288090798
Energy: 1.579535650659993
Energy: 1.5486521288097628
Energy: 1.5224493917956006
Energy: 1.5486521288097628
Energy: 1.7249704758539632
Energy: 1.5102668124210423
Energy: 1.6179710436811245
Energy: 1.5102667854995335
Energy: 1.7249704758546458
Energy: 1.5102668111268283
Energy: 1.7056314594142832
Energy: 1.5237259119108244
Energy: 1.513683082362733
Energy: 1.5237259117647464
Energy: 1.7056314591698991
Energy: 1.5237259118084208
Energy: 1.7106406680548423
Energy: 1.4948890181110337
Energy: 1.58695990320483
Energy: 1.4948890148291234
Energy: 1.7106406680596222
Energy: 1.4948890134687305
Energy: 1.7046675296466216
Energy: 1.4859388188498421
Energy: 1.649022340726908
Energy: 1.4859388209105773
Energy: 1.7046675296445728
Energy: 1.4859388197679042
Energy: 1.408800548519644
Energy: 1.5045324401661309
Energy: 1.7257560442987114
Energy: 1.5045324399511115
Energy: 1.4088005485189612
Energy: 1.5045324401477238
Energy: 1.5488014236135605
Energy: 1.4633576358630114
Energy: 1.62121359924815
Energy: 1.4633576353804205
Energy: 1.548801423603317
Energy: 1.4633576298520894
Energy: 1.8342508323803521
Energy: 1.5652148498953828
Energy: 1.4787270678238615
Energy: 1.5652147719909226
Energy: 1.8342508323803521
Energy: 1.5652142777288227
Energy: 1.5277122362732418
Energy: 1.484799264238845
Energy: 1.7283365709486798
Energy: 1.4847992644087933
Energy: 1.5277122362820883
Energy: 1.4847992630005975
Energy: 1.5671187780851905
Energy: 1.4960069881701765
Energy: 1.6834995431383049
Energy: 1.4960069881981752
Energy: 1.5671187780851905
Energy: 1.496006988168128
Energy: 1.7807744574262008
Energy: 1.4793887917352908
Energy: 1.5385921222634156
Energy: 1.4793888053803497
Energy: 1.7807744574268833
Energy: 1.4793888344479245
Energy: 1.6139759221689707
Energy: 1.5085632881573312
Energy: 1.6813126401236118
Energy: 1.5085632874576718
Energy: 1.6139759223007075
Energy: 1.5085632873907793
Energy: 1.6574887724706597
Energy: 1.5799670156402184
Energy: 1.4320901439473994
Energy: 1.5799674116169826
Energy: 1.6574887739048056
Energy: 1.579967224077065
Energy: 1.6353380051033477
Energy: 1.5497704021880259
Energy: 1.4337692089784204
Energy: 1.5497703966337761
Energy: 1.635338005656929
Energy: 1.549770409603729
Energy: 1.6231633203504017
Energy: 1.512326103090182
Energy: 1.798804258246782
Energy: 1.5123261031488797
Energy: 1.6231633203265006
Energy: 1.5123261029837118
Energy: 1.778775333031902
Energy: 1.5086533692381723
Energy: 1.5230899341153379
Energy: 1.5086533483214704
Energy: 1.7787753330346336
Energy: 1.5086533501173653
Energy: 1.5668482910800843
Energy: 1.4978532275780345
Energy: 1.6715178128387018
Energy: 1.4978532284346977
Energy: 1.566848291080767
Energy: 1.4978532268749611
Energy: 1.4904580997467192
Energy: 1.4847992648709283
Energy: 1.6869391076710143
Energy: 1.4847992652832118
Energy: 1.4904580959460245
Energy: 1.4847992631596503
Energy: 1.8096677536176775
Energy: 1.5634663271239833
Energy: 1.4440039532738869
Energy: 1.563466327660523
Energy: 1.8096677536176775
Energy: 1.5634663275478762
Energy: 1.5319503629519473
Energy: 1.467520341764256
Energy: 1.642464132502956
Energy: 1.4675203565171602
Energy: 1.5319503628509408
Energy: 1.4675203420482168
Energy: 1.4084028908133397
Energy: 1.5019952994879195
Energy: 1.6129392251348802
Energy: 1.5019952684224054
Energy: 1.4084028908140227
Energy: 1.5019953317425438
Energy: 1.6979984219100348
Energy: 1.487609017993535
Energy: 1.6839681279978667
Energy: 1.487609017962805
Energy: 1.6979983968240293
Energy: 1.4876090175744228
Energy: 1.6973807613124108
Energy: 1.5019469579116436
Energy: 1.5814251238276618
Energy: 1.5019469580911835
Energy: 1.6973807613137766
Energy: 1.50194695946182
Energy: 1.7313146293399366
Energy: 1.5159444912358755
Energy: 1.5229409881507148
Energy: 1.5159445002734282
Energy: 1.7313146293433512
Energy: 1.515944500360125
Energy: 1.7018243169969456
Energy: 1.5210187544680864
Energy: 1.7118622684869538
Energy: 1.5210187544858107
Energy: 1.7018243162167668
Energy: 1.5210187544919567
Energy: 1.5351512933436027
Energy: 1.5445308853424764
Energy: 1.5793411630641425
Energy: 1.5445308860421356
Energy: 1.5351512933436027
Energy: 1.544530884090602
Energy: 1.711591860065511
Energy: 1.4942718959141255
Energy: 1.4956363118413287
Energy: 1.494271893901162
Energy: 1.711591860063462
Energy: 1.4942718957100323
Energy: 1.8015248169359008
Energy: 1.5073458689354486
Energy: 1.5285407889119278
Energy: 1.5073458690746977
Energy: 1.8015248169359008
Energy: 1.5073458693170019

minimum gb energy = 1.4084028908133397 eV
minimum distance =  2.2289728183897 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.810322795250354
Energy: 1.5908091046796538
Energy: 1.5755085266201436
Energy: 1.5908091046322217
Energy: 1.810322795250354
Energy: 1.5908091046733246
Energy: 1.5729288436590716
Energy: 1.7802703588687467
Energy: 1.9123287619839733
Energy: 1.7802703355518081
Energy: 1.572928843815644
Energy: 1.7802703507252733
Energy: 1.395054885790542
Energy: 1.5891946999955495
Energy: 1.7004174584841738
Energy: 1.5891946231143528
Energy: 1.39505488578896
Energy: 1.5891946380094837
Energy: 1.4553815844213807
Energy: 1.5089661334470141
Energy: 1.903654794204859
Energy: 1.5089661343737883
Energy: 1.4553815843343922
Energy: 1.5089661343152807
Energy: 1.4358908592287702
Energy: 1.4966720349065765
Energy: 1.663553008597022
Energy: 1.4966720354316358
Energy: 1.4358908592303525
Energy: 1.4966720350204274
Energy: 1.8564117357191416
Energy: 1.4901539217819346
Energy: 1.894403293725017
Energy: 1.490153921761401
Energy: 1.856411735715977
Energy: 1.4901539217550719
Energy: 1.9022331276195943
Energy: 1.492267812147094
Energy: 1.7287852936569421
Energy: 1.4922678047169335
Energy: 1.9022331276195943
Energy: 1.4922677598923377
Energy: 1.4143846992494982
Energy: 1.4917391374423115
Energy: 1.4545032272970861
Energy: 1.4917391374533875
Energy: 1.414384699254245
Energy: 1.4917391374565518
Energy: 1.8971042141154788
Energy: 1.4884309671195766
Energy: 1.4502605083804003
Energy: 1.4884090450901941
Energy: 1.8971042140885803
Energy: 1.4883983557614167
Energy: 1.4408946745718978
Energy: 1.5926540129869158
Energy: 1.4561491776447126
Energy: 1.5926540129869158
Energy: 1.4408946745718978
Energy: 1.5926540116236172
Energy: 1.9080992823310092
Energy: 1.4841813332923246
Energy: 1.8895835517320394
Energy: 1.4896233737479039
Energy: 1.9080992823199694
Energy: 1.4909657090726367
Energy: 1.8281234904395307
Energy: 1.5915764186088888
Energy: 1.894736192459652
Energy: 1.591580166880681
Energy: 1.8281234904395307
Energy: 1.5915758950825163
Energy: 1.6861427269061766
Energy: 1.5097257461646094
Energy: 1.89508880144525
Energy: 1.5097257462642202
Energy: 1.6861427269061766
Energy: 1.5097257465362615
Energy: 1.4035317227419164
Energy: 1.584159020075275
Energy: 1.8838563182164572
Energy: 1.5840892594744138
Energy: 1.4035317227419164
Energy: 1.5837406535783634
Energy: 1.442902992242298
Energy: 1.59488504122767
Energy: 1.8855703604088165
Energy: 1.5934652955607136
Energy: 1.4429029922438803
Energy: 1.594887008307082
Energy: 1.4560778150326588
Energy: 1.496885690122521
Energy: 1.9000767307936204
Energy: 1.496885692075752
Energy: 1.456077808532437
Energy: 1.4968856837203997
Energy: 1.8742649899965849
Energy: 1.5856920957275358
Energy: 1.8910690450018224
Energy: 1.585712298142596
Energy: 1.8742649899965849
Energy: 1.5856865623269103
Energy: 1.9087553495009735
Energy: 1.4975427221073199
Energy: 1.8907491365253073
Energy: 1.4975427860845554
Energy: 1.9087553554080987
Energy: 1.497543208879822

minimum gb energy = 1.39505488578896 eV
minimum distance =  2.22262529737956 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 1.91351756243489
Energy: 1.716859281394911
Energy: 1.5955761736405332
Energy: 1.7168594779014652
Energy: 1.9135175643120796
Energy: 1.7168595417481647
Energy: 1.5235307368016637
Energy: 1.7837556061422954
Energy: 1.7526452652901596
Energy: 1.783755614563007
Energy: 1.523506153084218
Energy: 1.783755721324708
Energy: 1.4808091129363812
Energy: 1.6415890735080372
Energy: 1.7438624336554538
Energy: 1.641589073454561
Energy: 1.4808091129363812
Energy: 1.6415890732153369
Energy: 1.6963318843923612
Energy: 1.587726221446015
Energy: 1.804730173348884
Energy: 1.5877261452459634
Energy: 1.6963318843923612
Energy: 1.5877283151421624
Energy: 1.5603073539468415
Energy: 1.659482654758166
Energy: 1.840141995075713
Energy: 1.659482654624934
Energy: 1.5603073539505958
Energy: 1.6594826542712704
Energy: 1.828699727191609
Energy: 1.6851772659833937
Energy: 1.553457412229227
Energy: 1.6851772669674874
Energy: 1.8286997272356997
Energy: 1.6851772686636433
Energy: 1.8070577886445387
Energy: 1.5926045156973316
Energy: 1.6349117387771088
Energy: 1.592604515824911
Energy: 1.8070577888162298
Energy: 1.592604515595072
Energy: 1.742574961961885
Energy: 1.6389568657396232
Energy: 1.4796888884596173
Energy: 1.6389568013591223
Energy: 1.7425749619600082
Energy: 1.638957153559586
Energy: 1.7400562124711432
Energy: 1.7868865829408191
Energy: 1.5431068495302913
Energy: 1.7886020625666905
Energy: 1.7398672646787643
Energy: 1.7892242142497206
Energy: 1.6775390646282313
Energy: 1.7168595133808295
Energy: 1.9135175608419321
Energy: 1.7168591645501308
Energy: 1.6775390646291697
Energy: 1.7168594703832567
Energy: 1.7526494264512424
Energy: 1.7837557737270857
Energy: 1.5460657189030116
Energy: 1.783755806650004
Energy: 1.7526494298135202
Energy: 1.7837556125985534
Energy: 1.7438624337230082
Energy: 1.6415890732500633
Energy: 1.4808091129363812
Energy: 1.6415890732641203
Energy: 1.7438624337230082
Energy: 1.6415890733026008
Energy: 1.8047301733479455
Energy: 1.5877279303893377
Energy: 1.6963318843932997
Energy: 1.5877246073388285
Energy: 1.8047301733498227
Energy: 1.5877275697775477
Energy: 1.8401419950785287
Energy: 1.659482653926971
Energy: 1.5603073539430872
Energy: 1.6594826549711106
Energy: 1.8401419950775901
Energy: 1.6594826538106333
Energy: 1.5534574122770717
Energy: 1.6851772664280757
Energy: 1.8828370169346762
Energy: 1.685177268980746
Energy: 1.5534574122517306
Energy: 1.6851772657338457
Energy: 1.5861214380453268
Energy: 1.5926045154065087
Energy: 1.8070577889522559
Energy: 1.5926045156532413
Energy: 1.5861214379946875
Energy: 1.5926045158774482
Energy: 1.4796888884596173
Energy: 1.6389569189403463
Energy: 1.7425749619815734
Energy: 1.6389570799919386
Energy: 1.4796888884596173
Energy: 1.6389571401949226
Energy: 1.543106816400038
Energy: 1.7884360161023807
Energy: 1.7411337941629876
Energy: 1.7884316180742896
Energy: 1.5431068163597015
Energy: 1.788579581283164
Energy: 1.91351756243489
Energy: 1.7168594893260987
Energy: 1.6775390665598569
Energy: 1.7168594521083866
Energy: 1.9135175643074083
Energy: 1.7168596202053705
Energy: 1.546065728427909
Energy: 1.7837558808415113
Energy: 1.740936732071545
Energy: 1.783755632000134
Energy: 1.546065728423216
Energy: 1.7837557613737123
Energy: 1.4808091129354424
Energy: 1.6415890733448144
Energy: 1.743862434269928
Energy: 1.6415890734498895
Energy: 1.4808091129354424
Energy: 1.6415890732397391
Energy: 1.696331884390484
Energy: 1.5877261819833501
Energy: 1.8047301733479455
Energy: 1.5877271828942094
Energy: 1.6963318843895454
Energy: 1.5877277358594173
Energy: 1.5603073539383947
Energy: 1.6594826541427314
Energy: 1.840141995075713
Energy: 1.6594826556390612
Energy: 1.5603073539383947
Energy: 1.659482654697181
Energy: 1.925059529122439
Energy: 1.6851772649007954
Energy: 1.5534574123521132
Energy: 1.6851772645874468
Energy: 1.925059529122439
Energy: 1.6851772662901725
Energy: 1.8070577889391164
Energy: 1.5926045154337265
Energy: 1.5402092228188082
Energy: 1.5926045156138433
Energy: 1.8070577889391164
Energy: 1.5926045155650597
Energy: 1.7425749619684547
Energy: 1.638957101899283
Energy: 1.4796888884596173
Energy: 1.638956655474363
Energy: 1.7425749619684547
Energy: 1.6389571326082208
Energy: 1.7410131270258529
Energy: 1.7883887663618674
Energy: 1.5431069458289695
Energy: 1.7870618328082015
Energy: 1.7411315325480963
Energy: 1.78922968155531
Energy: 1.6775390650851139
Energy: 1.7168598943332642
Energy: 1.9135175627228975
Energy: 1.7168593077199357
Energy: 1.6775390644790653
Energy: 1.7168596226970558
Energy: 1.740911940849761
Energy: 1.7837556999089514
Energy: 1.5460657397568311
Energy: 1.7837558146832644
Energy: 1.7408959977891652
Energy: 1.7837557186097324
Energy: 1.743862433553194
Energy: 1.6415890733701342
Energy: 1.4808091129373198
Energy: 1.6415890732678746
Energy: 1.7438624337061142
Energy: 1.6415890733945364

minimum gb energy = 1.4796888884596173 eV
minimum distance =  2.21510927710138 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 1.4960692755847287
Energy: 1.5137309094439926
Energy: 1.5607175237669502
Energy: 1.5137309094446718
Energy: 1.4960692755840233
Energy: 1.5137309094419025
Energy: 1.5082388117648842
Energy: 1.6127237367696998
Energy: 1.5616308147267957
Energy: 1.6127248466990733
Energy: 1.508238811757752
Energy: 1.6127252138607684
Energy: 1.5006645169274202
Energy: 1.738613056654905
Energy: 1.5476248425514336
Energy: 1.7386130585114314
Energy: 1.5006645169283346
Energy: 1.738613147593644
Energy: 1.588953911798655
Energy: 1.527659585848638
Energy: 1.5452961923958888
Energy: 1.5276595858389719
Energy: 1.588953911656406
Energy: 1.5276595858401214
Energy: 1.5160565034256899
Energy: 1.5126070172028954
Energy: 1.6236405157903204
Energy: 1.5126070171918706
Energy: 1.516056503805778
Energy: 1.5126070176703186
Energy: 1.492030055968322
Energy: 1.754464381391689
Energy: 1.5111053139677901
Energy: 1.754464382968106
Energy: 1.4920300559685309
Energy: 1.7544641408672275
Energy: 1.5746635211495146
Energy: 1.6718824717307095
Energy: 1.5466177377058388
Energy: 1.6571465570075945
Energy: 1.5746635211524926
Energy: 1.6809131105547543
Energy: 1.5766819761704103
Energy: 1.5231700331391664
Energy: 1.5450142977641868
Energy: 1.5231700331419096
Energy: 1.5766819761876525
Energy: 1.5231700331347775
Energy: 1.5382787914705447
Energy: 1.6250840134026767
Energy: 1.5477219569782272
Energy: 1.625084015731877
Energy: 1.5382787914703098
Energy: 1.6250840082637643
Energy: 1.4930499551440983
Energy: 1.8469941036998845
Energy: 1.4893036370046455
Energy: 1.8469940741079873
Energy: 1.4930499551443073
Energy: 1.8469941571047896
Energy: 1.5531142545119836
Energy: 1.6354574459240903
Energy: 1.5200837645449619
Energy: 1.6354574446193177
Energy: 1.5531142541688878
Energy: 1.6354574443745817
Energy: 1.540480042398866
Energy: 1.5229695206412526
Energy: 1.575145061231372
Energy: 1.5229695206212674
Energy: 1.5404800423839227
Energy: 1.5229695206653917

minimum gb energy = 1.4893036370046455 eV
minimum distance =  2.22583678249432 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.8824563617751064
Energy: 1.7866621927423358
Energy: 1.5955665948594768
Energy: 1.7866621520348096
Energy: 1.8824563617705845
Energy: 1.7866621703647192
Energy: 1.7249919147724297
Energy: 1.7221698944180461
Energy: 1.6471991535941821
Energy: 1.7221698944245059
Energy: 1.7249919147498505
Energy: 1.7221698944174002
Energy: 1.560704890826311
Energy: 1.798699558909128
Energy: 1.6023832728024316
Energy: 1.7986994980606366
Energy: 1.5607048908276027
Energy: 1.798699533316735
Energy: 1.5112162435490202
Energy: 1.6920695075256968
Energy: 1.5516819189391946
Energy: 1.6920703454247652
Energy: 1.5112162435509582
Energy: 1.6920693247690544
Energy: 1.5116433063811128
Energy: 1.6592694105727819
Energy: 1.6306080040341553
Energy: 1.6592694100426868
Energy: 1.5116433063798207
Energy: 1.6592694104753012
Energy: 1.495254618441691
Energy: 1.722089917011635
Energy: 1.6850906270166481
Energy: 1.722089915155334
Energy: 1.495254618441691
Energy: 1.7220899166720087
Energy: 1.7363451208007281
Energy: 1.7469265869294288
Energy: 1.675185898868467
Energy: 1.7469265937257368
Energy: 1.7363451208013736
Energy: 1.7469266036148232
Energy: 1.6964253216008687
Energy: 1.6891666700183117
Energy: 1.6137970878716792
Energy: 1.6891666661339437
Energy: 1.6964253215995768
Energy: 1.689166666469694
Energy: 1.7172720371864851
Energy: 1.7140199894198367
Energy: 1.6215199510027363
Energy: 1.7140199897394381
Energy: 1.717272037067042
Energy: 1.7140199891325036
Energy: 1.710294542698009
Energy: 1.7713227203706383
Energy: 1.5752937148472232
Energy: 1.7713249621332552
Energy: 1.710294542697363
Energy: 1.7713228571995494
Energy: 1.6189903780080377
Energy: 1.7740098615726672
Energy: 1.6303024904752874
Energy: 1.774009863098386
Energy: 1.6189903734844964
Energy: 1.7740098623674867
Energy: 1.5590866425622343
Energy: 1.6581456969577069
Energy: 1.5948926276242552
Energy: 1.658145696601286
Energy: 1.5590866425622343
Energy: 1.6581456844743443
Energy: 1.5017691955429888
Energy: 1.741736036709505
Energy: 1.5510664130026297
Energy: 1.7417360365222658
Energy: 1.5017691955410515
Energy: 1.7417360371401813
Energy: 1.7299791478386992
Energy: 1.782092203376982
Energy: 1.8627549985472587
Energy: 1.7820921898824924
Energy: 1.7299791478380535
Energy: 1.782092194501606
Energy: 1.5632198783209017
Energy: 1.688925411938173
Energy: 1.6443908010859514
Energy: 1.6889263327275692
Energy: 1.563219878320256
Energy: 1.6889253187371258
Energy: 1.6596330714032042
Energy: 1.6539862293751642
Energy: 1.5919914089992424
Energy: 1.6539862291911547
Energy: 1.6596330679036793
Energy: 1.6539862288114795
Energy: 1.7128232520036726
Energy: 1.7699370601724032
Energy: 1.578028298729619
Energy: 1.7699372666935589
Energy: 1.7128232520017348
Energy: 1.7699370169235393
Energy: 1.5114302524536378
Energy: 1.7844592666153996
Energy: 1.5887195538104133
Energy: 1.7844592665482495
Energy: 1.5114459008891221
Energy: 1.7844592665921448
Energy: 1.7006239227990285
Energy: 1.7897577351787184
Energy: 1.5019660157405026
Energy: 1.7897577351774265
Energy: 1.7006239227996744
Energy: 1.7897577351832399
Energy: 1.5117646194279581
Energy: 1.7936638825285662
Energy: 1.5134684289818678
Energy: 1.793663882477565
Energy: 1.5117646194253742
Energy: 1.7936638825272744
Energy: 1.552425375312296
Energy: 1.775799896118545
Energy: 1.6995022111082703
Energy: 1.7757998971193363
Energy: 1.552425375312296
Energy: 1.7757998955335732
Energy: 1.5893840410078226
Energy: 1.7856017841924967
Energy: 1.5095134498432647
Energy: 1.7856017842040945
Energy: 1.5893840409367965
Energy: 1.7856017841744098
Energy: 1.5850556127260313
Energy: 1.7736355372354404
Energy: 1.7084232855692036
Energy: 1.7736388000030834
Energy: 1.5850556127286153
Energy: 1.7736331963012641
Energy: 1.5899088545768172
Energy: 1.6782477688162163
Energy: 1.6318070905484394
Energy: 1.6782477688097566
Energy: 1.5899088547472908
Energy: 1.6782477688129864
Energy: 1.6421809634854054
Energy: 1.6879985052701765
Energy: 1.562679169077464
Energy: 1.6879984993242108
Energy: 1.6421809634834674
Energy: 1.687998502650678
Energy: 1.8669069110956678
Energy: 1.7989354478842259
Energy: 1.7380149756466527
Energy: 1.798935447948146
Energy: 1.8669069120364143
Energy: 1.798935447974601
Energy: 1.5413437901694642
Energy: 1.7355845541520225
Energy: 1.4988359225614958
Energy: 1.7355845429993582
Energy: 1.5413437903889717
Energy: 1.7355845423885776
Energy: 1.594096388970958
Energy: 1.6583957664866023
Energy: 1.5591568124587447
Energy: 1.6583957674912693
Energy: 1.594096388956747
Energy: 1.658395765976532
Energy: 1.6317637659305535
Energy: 1.771858851697063
Energy: 1.7394133859607737
Energy: 1.7718588516228073
Energy: 1.631763765975095
Energy: 1.7718588516912492
Energy: 1.5757183637186463
Energy: 1.7697681000620025
Energy: 1.710494492962647
Energy: 1.7697681093854662
Energy: 1.575718363722522
Energy: 1.7697680967367977
Energy: 1.6426765417817448
Energy: 1.714019989499906
Energy: 1.7169861930207007
Energy: 1.7140199896890829
Energy: 1.6426765417804527
Energy: 1.7140199896671204
Energy: 1.6138089904556787
Energy: 1.6911649201944532
Energy: 1.697314863925466
Energy: 1.6911649214354223
Energy: 1.6138089904259647
Energy: 1.6911649211778035
Energy: 1.6831749760366275
Energy: 1.7477414440879224
Energy: 1.7344953373712604
Energy: 1.7477414888024307
Energy: 1.6831764240284504
Energy: 1.7477415810020704
Energy: 1.6866546258975714
Energy: 1.7126003955980884
Energy: 1.4935660106590654
Energy: 1.712600045228301
Energy: 1.6866546258962796
Energy: 1.708499000836421
Energy: 1.5655994770322106
Energy: 1.6606255067410856
Energy: 1.5057053080089347
Energy: 1.6606254999925487
Energy: 1.5655994756330405
Energy: 1.6606255028289707
Energy: 1.5433280544609642
Energy: 1.6914877088488687
Energy: 1.5073018997808576
Energy: 1.691487709252415
Energy: 1.5433280355525423
Energy: 1.6914877087307174
Energy: 1.6028982559140295
Energy: 1.8009297201818628
Energy: 1.564106518229718
Energy: 1.800929720354245
Energy: 1.6028982557513072
Energy: 1.8009297202619319
Energy: 1.6466321880128119
Energy: 1.7126526460223912
Energy: 1.7242030108205448
Energy: 1.7126526460223912
Energy: 1.6466321879876198
Energy: 1.712652646054043
Energy: 1.6181086209908226
Energy: 1.7866621753234586
Energy: 1.882456361766063
Energy: 1.7866621717613054
Energy: 1.6181086209934066
Energy: 1.7866621618444725
Energy: 1.6471991537555828
Energy: 1.6930839262449036
Energy: 1.7249919147918082
Energy: 1.6930839262494253
Energy: 1.6471991537504154
Energy: 1.6930839262487793
Energy: 1.602383574881992
Energy: 1.7986995167269133
Energy: 1.560704890826311
Energy: 1.7986994936397436
Energy: 1.6023836726375866
Energy: 1.7986995326594457
Energy: 1.5516819191832483
Energy: 1.692070395766284
Energy: 1.5112162435541878
Energy: 1.6920693009031846
Energy: 1.5516819191838942
Energy: 1.6920693007411378
Energy: 1.6306071296534923
Energy: 1.6592694103448768
Energy: 1.5116433063804666
Energy: 1.6592694102376775
Energy: 1.6306071465177283
Energy: 1.659269409052231

minimum gb energy = 1.4935660106590654 eV
minimum distance =  2.21591794255486 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 1.5814232139766298
Energy: 1.725491465953599
Energy: 1.5768359382470138
Energy: 1.7254914648586306
Energy: 1.5814232139751594
Energy: 1.7254914647013615
Energy: 1.663933328754951
Energy: 1.656142667800674
Energy: 1.3808151455242865
Energy: 1.6561426678065558
Energy: 1.6639332634586919
Energy: 1.6561426676684023
Energy: 1.33720389048767
Energy: 1.626927297178193
Energy: 1.455141191310128
Energy: 1.6269272972605038
Energy: 1.3372038904920809
Energy: 1.6269272991888706
Energy: 1.3541559404254644
Energy: 1.6584267924345237
Energy: 1.4442309382593481
Energy: 1.6584268990785367
Energy: 1.354155940413701
Energy: 1.6584268316805004
Energy: 1.364306032191555
Energy: 1.781511545704967
Energy: 1.4501423177766595
Energy: 1.7815115456917332
Energy: 1.364306032191555
Energy: 1.7815115457005557
Energy: 1.353355199738841
Energy: 1.6249330424878285
Energy: 1.4045498372954601
Energy: 1.6249330421453525
Energy: 1.3533552000769058
Energy: 1.6249330418793384
Energy: 1.3609805054788706
Energy: 1.62476992282639
Energy: 1.368603600382127
Energy: 1.6247699233834487
Energy: 1.360980502818598
Energy: 1.6247699246974103
Energy: 1.3511265460228479
Energy: 1.6953012210938492
Energy: 1.4404903187213824
Energy: 1.6953029886184188
Energy: 1.3511265460184365
Energy: 1.6953018617956361
Energy: 1.3517275995750233
Energy: 1.6522690385728824
Energy: 1.4619742402172051
Energy: 1.6522692759534483
Energy: 1.351727599573553
Energy: 1.6522692655709517
Energy: 1.3440771235422988
Energy: 1.6294544651318923
Energy: 1.4478912040860223
Energy: 1.6294544650907539
Energy: 1.3440771235422988
Energy: 1.6294544651113398
Energy: 1.6638741506509134
Energy: 1.6561426678668099
Energy: 1.4474660551988459
Energy: 1.6561426677124818
Energy: 1.6638741610392918
Energy: 1.6561426678712212
Energy: 1.581423214026591
Energy: 1.7254914576581752
Energy: 1.5079412774162197
Energy: 1.7254914599789462
Energy: 1.5814232140280613
Energy: 1.7254914550199252
Energy: 1.6639411477231283
Energy: 1.6561426679094524
Energy: 1.3808151456418876
Energy: 1.6561426678609616
Energy: 1.6639949807695964
Energy: 1.656142667800674
Energy: 1.3372038904950219
Energy: 1.6269272964756623
Energy: 1.455141191310128
Energy: 1.6269272963051593
Energy: 1.3372038904979626
Energy: 1.626927297848408
Energy: 1.35415594041076
Energy: 1.6584267248366094
Energy: 1.389521587051565
Energy: 1.6584266656560642
Energy: 1.3541559404225234
Energy: 1.6584267203317504
Energy: 1.3643060321445346
Energy: 1.7815115457270234
Energy: 1.4501423837181693
Energy: 1.7815115457196713
Energy: 1.3643060321445346
Energy: 1.7815115457314348
Energy: 1.3533391662490724
Energy: 1.6249330423217372
Energy: 1.4045498520020199
Energy: 1.624933042646568
Energy: 1.3533415244956901
Energy: 1.6249330426539201
Energy: 1.360980503957645
Energy: 1.6247699212008313
Energy: 1.3443497850026562
Energy: 1.6247699239066875
Energy: 1.3609805039326812
Energy: 1.624769923471641
Energy: 1.3511265460434005
Energy: 1.6953035452416596
Energy: 1.3898847149904883
Energy: 1.6953059414231662
Energy: 1.35112654604193
Energy: 1.6953028386998223

minimum gb energy = 1.33720389048767 eV
minimum distance =  2.21188226417965 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 1.4189615595425353
Energy: 1.5919961794897262
Energy: 1.4122702037712516
Energy: 1.591996185470474
Energy: 1.4189615595414582
Energy: 1.591996153113107
Energy: 1.6981555361417642
Energy: 1.573116800484917
Energy: 1.2634015520727317
Energy: 1.5731167862786573
Energy: 1.6981555361622294
Energy: 1.5731167871356517
Energy: 1.389828089395832
Energy: 1.5610554429801442
Energy: 1.358828935118386
Energy: 1.55817059972547
Energy: 1.3898280893915236
Energy: 1.5659560892657163
Energy: 1.4625064479257563
Energy: 1.5327803239755247
Energy: 1.2649374072249182
Energy: 1.5327805571154718
Energy: 1.4625064479279106
Energy: 1.532780586362415
Energy: 1.2325529309920402
Energy: 1.5854134719567816
Energy: 1.3581371945451786
Energy: 1.585413435192728
Energy: 1.2325529309941943
Energy: 1.5854134704709952
Energy: 1.2276580896114058
Energy: 1.5447186280418401
Energy: 1.2563786096424843
Energy: 1.5447186279643366
Energy: 1.2276580896092515
Energy: 1.5447186281688912
Energy: 1.225230350473515
Energy: 1.5687881455262171
Energy: 1.2511279902157044
Energy: 1.5691296335616218
Energy: 1.2252303504724378
Energy: 1.568618764905718
Energy: 1.7139449332795145
Energy: 1.5763815796625946
Energy: 1.3235847466826225
Energy: 1.576382984701533
Energy: 1.7139449332773602
Energy: 1.5763822461512094
Energy: 1.7147279938535207
Energy: 1.7382802750279538
Energy: 1.5371359991717408
Energy: 1.7382802757159386
Energy: 1.7147279938276696
Energy: 1.7382802755770392
Energy: 1.2285621901209223
Energy: 1.564148662626514
Energy: 1.2582991156558458
Energy: 1.5604544420028037
Energy: 1.2285621901069195
Energy: 1.556482999012163
Energy: 1.2234650366367783
Energy: 1.557187672591507
Energy: 1.2548096493612817
Energy: 1.5571876769949624
Energy: 1.2234650366324697
Energy: 1.5571876754521374
Energy: 1.234970451104019
Energy: 1.5766372182420594
Energy: 1.3663025635988144
Energy: 1.5766393048910798
Energy: 1.2349704510997106
Energy: 1.5766324348358376
Energy: 1.7179995322020114
Energy: 1.5024116305338555
Energy: 1.274073273188491
Energy: 1.502411522669617
Energy: 1.7179995327381714
Energy: 1.502411552475291
Energy: 1.3888584312390624
Energy: 1.5861383365745239
Energy: 1.2740607223550284
Energy: 1.586138345330859
Energy: 1.3888584312390624
Energy: 1.5861384416373738
Energy: 1.7386229158078574
Energy: 1.5624153914073795
Energy: 1.251799385568232
Energy: 1.5624561896506524
Energy: 1.7386229157680533
Energy: 1.5624046112851049
Energy: 1.418716867551084
Energy: 1.5889258960209542
Energy: 1.5315512752832803
Energy: 1.5889258794837613
Energy: 1.4187168651760385
Energy: 1.5889258734244327
Energy: 1.7070551203823932
Energy: 1.5625022596748703
Energy: 1.2768390350741436
Energy: 1.5625022614297897
Energy: 1.7070551833906291
Energy: 1.5625022626657339
Energy: 1.3884435486901885
Energy: 1.6738946767159948
Energy: 1.2818113568611764
Energy: 1.673894585723786
Energy: 1.3884435486901885
Energy: 1.67389466947776
Energy: 1.4550914961149684
Energy: 1.5318396804272483
Energy: 1.2571717393008817
Energy: 1.5318396814489437
Energy: 1.4550916465980348
Energy: 1.5318396800924112
Energy: 1.23455052429301
Energy: 1.584417639072915
Energy: 1.244817186686759
Energy: 1.584185219762795
Energy: 1.2345505242973183
Energy: 1.5841806807301784
Energy: 1.7357162083439508
Energy: 1.5388079249134408
Energy: 1.344215509894628
Energy: 1.5388079249586308
Energy: 1.7357162083590305
Energy: 1.5388079249295976
Energy: 1.225673958634813
Energy: 1.6647484505563062
Energy: 1.2471734590223926
Energy: 1.6647483421580618
Energy: 1.2256739586369676
Energy: 1.6647483918449888
Energy: 1.713179747155792
Energy: 1.5706745355704708
Energy: 1.3287147034489581
Energy: 1.570674584000988
Energy: 1.7131797471245553
Energy: 1.570674427579181
Energy: 1.233699266506689
Energy: 1.5882390365019357
Energy: 1.777748337808391
Energy: 1.5881585525969395
Energy: 1.233699266506689
Energy: 1.5898183111875297
Energy: 1.2391202070096694
Energy: 1.5608569818069369
Energy: 1.3431794004200739
Energy: 1.560844850975129
Energy: 1.2391202070107463
Energy: 1.5608608888809514
Energy: 1.231088595099288
Energy: 1.5747869132101402
Energy: 1.2390376329997679
Energy: 1.5747870093950385
Energy: 1.231088595098211
Energy: 1.5747867294772162

minimum gb energy = 1.2234650366324697 eV
minimum distance =  2.22485219986518 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 1.8103481911146764
Energy: 1.6067487603696995
Energy: 1.296784201137353
Energy: 1.6066373931734932
Energy: 1.8103481907879841
Energy: 1.552642568771928
Energy: 1.9365085554156616
Energy: 1.3878270499483913
Energy: 1.1619545683093866
Energy: 1.3873506292099314
Energy: 1.9364943145137714
Energy: 1.3881532233987341
Energy: 1.2737216023844269
Energy: 1.5018598294335535
Energy: 1.2713207117631746
Energy: 1.5018595792463492
Energy: 1.2737216024540412
Energy: 1.5018587414274005
Energy: 1.7339050067254869
Energy: 1.3962082215550349
Energy: 1.1649392090467827
Energy: 1.396208107626122
Energy: 1.7339050067806303
Energy: 1.3962083710053133
Energy: 1.240092763239725
Energy: 1.5343303137918314
Energy: 1.1574647115986
Energy: 1.5343303137935291
Energy: 1.240092763237178
Energy: 1.5343303139462634
Energy: 1.488886708434911
Energy: 1.4288510949777202
Energy: 1.1630642153199604
Energy: 1.428851078314251
Energy: 1.488886708827783
Energy: 1.4288510733517767
Energy: 1.12614216845535
Energy: 1.4709960563141498
Energy: 1.1440437917630728
Energy: 1.4737127673443864
Energy: 1.126142168456199
Energy: 1.4704451721661922
Energy: 1.5249421766158286
Energy: 1.4775866682416576
Energy: 1.2009439672779878
Energy: 1.4775866774571902
Energy: 1.5249421766166773
Energy: 1.4775866727000468
Energy: 1.1232717671173453
Energy: 1.3922723737107694
Energy: 1.4738320004676746
Energy: 1.4050350011501582
Energy: 1.1232717671164962
Energy: 1.41552064815098
Energy: 1.5108874013510154
Energy: 1.466920825546512
Energy: 1.7310716559524302
Energy: 1.4671427317903163
Energy: 1.5108874012933253
Energy: 1.4671841722288754
Energy: 1.5032484552780994
Energy: 1.4915524564098805
Energy: 1.5693841603374856
Energy: 1.4915524679573315
Energy: 1.5032484557702601
Energy: 1.4915524261827755
Energy: 1.1340383645248548
Energy: 1.487360573665903
Energy: 1.1770167590660368
Energy: 1.4869339796790375
Energy: 1.1340383645401362
Energy: 1.507305232003877
Energy: 1.1254634725265824
Energy: 1.4530170615422524
Energy: 1.4629059895867011
Energy: 1.453011839556235
Energy: 1.1254634725274317
Energy: 1.453011279655946
Energy: 1.1306947530389928
Energy: 1.470244663588758
Energy: 1.1642591824183997
Energy: 1.4702446544046361
Energy: 1.130694753037295
Energy: 1.4702446600298336
Energy: 1.498114502951387
Energy: 1.4457962399471034
Energy: 1.1441053227019262
Energy: 1.4457962228797254
Energy: 1.4981145029115246
Energy: 1.4457962255680104
Energy: 1.2218463419515921
Energy: 1.4630477070358416
Energy: 1.1612593635444408
Energy: 1.4630478193465355
Energy: 1.2218463419490455
Energy: 1.4630493485932774
Energy: 1.525428362403213
Energy: 1.4468931103380656
Energy: 1.1587152749236804
Energy: 1.446893128528106
Energy: 1.5254283624049112
Energy: 1.446893069566547
Energy: 1.266251388389734
Energy: 1.4652057935407992
Energy: 1.1639723767507173
Energy: 1.4652056496258061
Energy: 1.266251388389734
Energy: 1.4652056843732741
Energy: 1.9433196652961555
Energy: 1.4423937055435418
Energy: 1.1436978421562087
Energy: 1.4109056126062052
Energy: 1.9433196681474008
Energy: 1.4423130706421328
Energy: 1.7509602355624272
Energy: 1.465937579970694
Energy: 1.3679800658949537
Energy: 1.465937708338088
Energy: 1.7509602355598803
Energy: 1.4659375448201277
Energy: 1.947530009410073
Energy: 1.481620100295257
Energy: 1.1435808972739963
Energy: 1.4816201003003506
Energy: 1.9475300094066772
Energy: 1.4816201002986527
Energy: 1.2661107375580072
Energy: 1.4645463192567574
Energy: 1.1568443441937657
Energy: 1.4645452394469702
Energy: 1.266110737560554
Energy: 1.464545944067561
Energy: 1.7357342503244666
Energy: 1.4298213954552677
Energy: 1.1425212321847258
Energy: 1.4298213728755258
Energy: 1.7357342502922064
Energy: 1.4298213885495799
Energy: 1.21412747578247
Energy: 1.4536144134328632
Energy: 1.13530231498901
Energy: 1.4536144177241246
Energy: 1.214127475783319
Energy: 1.4537458919911734
Energy: 1.3074145539337891
Energy: 1.428007996997826
Energy: 1.2069749227486442
Energy: 1.4280079967729695
Energy: 1.3074145539337891
Energy: 1.4280079979253455
Energy: 1.1324767068700115
Energy: 1.3991888075432504
Energy: 1.1284965255081079
Energy: 1.399261762535903
Energy: 1.132476706860673
Energy: 1.3993073717161884
Energy: 1.5311248152195978
Energy: 1.4733700825240124
Energy: 1.2313440307438541
Energy: 1.4733703274228989
Energy: 1.5311248152136554
Energy: 1.473370030275506
Energy: 1.1306845776520802
Energy: 1.4729258212315335
Energy: 1.5359873742688699
Energy: 1.472925813523933
Energy: 1.130684577656325
Energy: 1.4729258067370214
Energy: 1.5295470033169003
Energy: 1.4631889539511742
Energy: 1.7376986074267828
Energy: 1.463188953030447
Energy: 1.529547003303317
Energy: 1.463188953123793
Energy: 1.1296404673498481
Energy: 1.4270099801731357
Energy: 1.5695863895095172
Energy: 1.4175505473150545
Energy: 1.1296404673422078
Energy: 1.4187416716512053
Energy: 1.1429777849914737
Energy: 1.4965133001480033
Energy: 1.2393897653839565
Energy: 1.4965133197068252
Energy: 1.1429777852401395
Energy: 1.4965133538008701
Energy: 1.1333759065933293
Energy: 1.4910021187182405
Energy: 1.5215420436301994
Energy: 1.491002118772535
Energy: 1.1333759065941784
Energy: 1.4910021187521987
Energy: 1.1419776416272953
Energy: 1.4652500530082924
Energy: 1.2067671140653975
Energy: 1.46525004839713
Energy: 1.1419776416272953
Energy: 1.465250037374988

minimum gb energy = 1.1232717671164962 eV
minimum distance =  2.22659501477792 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 1.518133572478607
Energy: 1.397412936109608
Energy: 1.158399838364968
Energy: 1.3974129221441944
Energy: 1.51813357248099
Energy: 1.3974129326007054
Energy: 2.080310517780852
Energy: 1.238578585203084
Energy: 1.0299342106891585
Energy: 1.2388602058780909
Energy: 2.0803105177766814
Energy: 1.2375562926629966
Energy: 1.4839993936367786
Energy: 1.3511289276961695
Energy: 1.1549309351592905
Energy: 1.3509958341830637
Energy: 1.4839993886122065
Energy: 1.344846054115158
Energy: 1.9371097184615005
Energy: 1.2344832781419033
Energy: 1.0226893635252914
Energy: 1.234479817752402
Energy: 1.9371097184638837
Energy: 1.2344849940440363
Energy: 1.116695020091118
Energy: 1.3026196535734458
Energy: 1.0177343152417766
Energy: 1.30298351370727
Energy: 1.1166950200839687
Energy: 1.3025767785318978
Energy: 1.5676836796826175
Energy: 1.261184538382621
Energy: 1.028708043000653
Energy: 1.2611845278677758
Energy: 1.5676836797463143
Energy: 1.2611845593872877
Energy: 1.0930434719156443
Energy: 1.2829927345423655
Energy: 1.0099661933149142
Energy: 1.2814958686915447
Energy: 1.0930434719019408
Energy: 1.2763885791996474
Energy: 1.4228171205494873
Energy: 1.28496373819547
Energy: 1.048606817570217
Energy: 1.2849149460953617
Energy: 1.4228171205453168
Energy: 1.2849407254078744
Energy: 1.0185590864937815
Energy: 1.3123233562201975
Energy: 1.2415977510975684
Energy: 1.3123247773883397
Energy: 1.0185590850567037
Energy: 1.312343154835476
Energy: 1.257343997830534
Energy: 1.2961411120320414
Energy: 1.414641010525572
Energy: 1.2961459719817945
Energy: 1.2573439978287466
Energy: 1.2961421335514036
Energy: 1.0030323571737956
Energy: 1.3122996288092545
Energy: 1.3213235654928026
Energy: 1.2809613893826068
Energy: 1.0030323571696251
Energy: 1.282394829959554
Energy: 1.578878228902145
Energy: 1.3226580774144805
Energy: 1.4355175561830622
Energy: 1.3226646293393929
Energy: 1.578878228899166
Energy: 1.3226553880452812
Energy: 1.2785656836309174
Energy: 1.3093934294036944
Energy: 1.5656859717962053
Energy: 1.3093934257512576
Energy: 1.278565683629726
Energy: 1.3093934266743192
Energy: 1.293141232702997
Energy: 1.3261971347053123
Energy: 1.7094532865279826
Energy: 1.3261972605092918
Energy: 1.293141232700018
Energy: 1.3261970479197884
Energy: 1.2630655117860197
Energy: 1.2933292751338805
Energy: 1.6381670257165217
Energy: 1.2933466342406448
Energy: 1.2630655153526609
Energy: 1.2935994061753893
Energy: 1.2905215617887102
Energy: 1.3232070567579446
Energy: 1.4372153927366609
Energy: 1.3231862057493708
Energy: 1.2905215617857313
Energy: 1.3231812708272488
Energy: 1.283374068555201
Energy: 1.316998590852673
Energy: 1.5597431321089827
Energy: 1.3173436225568704
Energy: 1.2833740685611594
Energy: 1.317315235466361
Energy: 1.0107568094200812
Energy: 1.3230130385579875
Energy: 1.4169287951320424
Energy: 1.323004365999201
Energy: 1.0107568094266348
Energy: 1.3230078863231578
Energy: 1.2683123740696904
Energy: 1.2986192324756165
Energy: 1.315380825037815
Energy: 1.2986192326870183
Energy: 1.268312417524335
Energy: 1.2986192324850951
Energy: 1.0291017370413251
Energy: 1.3227861989736875
Energy: 1.0482443204877132
Energy: 1.3227135302396869
Energy: 1.0291017370931057
Energy: 1.3227346968528622
Energy: 1.284966122665516
Energy: 1.3008663903233244
Energy: 1.241908753663647
Energy: 1.3008663890601673
Energy: 1.284966122526748
Energy: 1.300866391246982
Energy: 1.0632208007266555
Energy: 1.325867547461249
Energy: 1.0324059430167405
Energy: 1.3258675965818745
Energy: 1.063220800785586
Energy: 1.325867596891584
Energy: 1.5877985907309073
Energy: 1.297202208718163
Energy: 1.0081836364772436
Energy: 1.2972022090237016
Energy: 1.5877985907297154
Energy: 1.2972022093256113
Energy: 1.0903833910401493
Energy: 1.382074725390744
Energy: 1.024629029581992
Energy: 1.3820746342315902
Energy: 1.0903833910264455
Energy: 1.3820746565291504
Energy: 1.5934714209910739
Energy: 1.3022317187408272
Energy: 1.2129056608577764
Energy: 1.3022317187348693
Energy: 1.5934714211548116
Energy: 1.3022317187592432
Energy: 1.4423820428089595
Energy: 1.451148487492284
Energy: 1.0281133661874735
Energy: 1.4511484873070972
Energy: 1.442382042810151
Energy: 1.4511484873237799
Energy: 1.9385384093223834
Energy: 1.2513769379567132
Energy: 1.0095546600036789
Energy: 1.25137446970865
Energy: 1.9385384087357878
Energy: 1.2511473499745962
Energy: 1.47387075128172
Energy: 1.3240846686366232
Energy: 1.3060742937737366
Energy: 1.3240845210335004
Energy: 1.4738707512751663
Energy: 1.3240845610382268
Energy: 1.609377973494882
Energy: 1.290871464182016
Energy: 1.2919179661436735
Energy: 1.2908714643850765
Energy: 1.609377971552834
Energy: 1.2908714630790759
Energy: 1.4434967357246167
Energy: 1.3226614194513895
Energy: 1.2989497410043416
Energy: 1.3226616425580673
Energy: 1.4434965582612398
Energy: 1.3226593972720098
Energy: 1.7484995565776222
Energy: 1.2444747667397886
Energy: 1.0112069442704237
Energy: 1.2444747253128798
Energy: 1.7484995565883468
Energy: 1.2444747509139527
Energy: 1.0886166432378597
Energy: 1.293450978060482
Energy: 1.2583959578814092
Energy: 1.2934514887939745
Energy: 1.088616643210453
Energy: 1.2934512690735178
Energy: 1.4292977233132085
Energy: 1.275198173894687
Energy: 1.0291007143642086
Energy: 1.2751981812728446
Energy: 1.4292977233132085
Energy: 1.2751981857429402
Energy: 1.0648231107428088
Energy: 1.2827394884908458
Energy: 1.5708926649309949
Energy: 1.2827394885075285
Energy: 1.0648231107440005
Energy: 1.2827394867477422
Energy: 1.5690194125767267
Energy: 1.2798692274321375
Energy: 1.0672242202580984
Energy: 1.2798696027758254
Energy: 1.569019412575535
Energy: 1.279868487137467
Energy: 1.0303008133226723
Energy: 1.2842524197779732
Energy: 1.4317253124112392
Energy: 1.284252526712916
Energy: 1.03030081326905
Energy: 1.28425257372651
Energy: 1.2577145228040199
Energy: 1.295356868866728
Energy: 1.0904489902766266
Energy: 1.2953564449265047
Energy: 1.2577145228034243
Energy: 1.295356676159344
Energy: 1.0112427265926351
Energy: 1.2421818463669259
Energy: 1.7497157258819749
Energy: 1.2421810649925913
Energy: 1.0112427265753567
Energy: 1.2421806742524788
Energy: 1.2989497409971917
Energy: 1.3231043551029715
Energy: 1.4417534635686695
Energy: 1.3237017368581325
Energy: 1.2989497409960002
Energy: 1.323710457933671
Energy: 1.1705299401463898
Energy: 1.3000898016622482
Energy: 1.7746371586119878
Energy: 1.3000897654225654
Energy: 1.1705299401511564
Energy: 1.3000898013329314
Energy: 1.3066633538645767
Energy: 1.3250494624148463
Energy: 1.4749735813706077
Energy: 1.3250494168406588
Energy: 1.3066633538508732
Energy: 1.3250495840036258
Energy: 1.0074994848674945
Energy: 1.2300504498198523
Energy: 1.9248737468159278
Energy: 1.2561381488186973
Energy: 1.007499484518462
Energy: 1.2564492008121317
Energy: 1.0278720328885507
Energy: 1.3230274518790812
Energy: 1.443747368647771
Energy: 1.3225447748967627
Energy: 1.0278720328825925
Energy: 1.3225534422040843
Energy: 1.1725599632505381
Energy: 1.2979533510004304
Energy: 1.6114279108494964
Energy: 1.2979533508116146
Energy: 1.1725599632493462
Energy: 1.2979533499778693
Energy: 1.027557995309676
Energy: 1.3230150885627359
Energy: 1.089629622668953
Energy: 1.3230183699695615
Energy: 1.0275579953317207
Energy: 1.3230195347225875
Energy: 1.008090729296312
Energy: 1.2972022087348454
Energy: 1.6012825385624259
Energy: 1.2972022094465054
Energy: 1.008090729301674
Energy: 1.297202209548388
Energy: 1.0315882359796498
Energy: 1.3226865867959505
Energy: 1.0628780779448053
Energy: 1.3226865657341407
Energy: 1.031588228538987
Energy: 1.32268660457158

minimum gb energy = 1.0030323571696251 eV
minimum distance =  2.23037785783568 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 0.34158370489035406
Energy: 0.342272760663978
Energy: 0.34263230400229155
Energy: 0.34227276066357076
Energy: 0.34158370489035406
Energy: 0.342272760663978
Energy: 0.34854283510607986
Energy: 0.7766507231289765
Energy: 0.8216108154176738
Energy: 0.7869544736360833
Energy: 0.3485428351064418
Energy: 0.7772150939237413
Energy: 0.34158370489035406
Energy: 0.342272760663978
Energy: 0.3426637394555113
Energy: 0.34227276066357076
Energy: 0.34158370489035406
Energy: 0.342272760663978
Energy: 0.3485428351068491
Energy: 0.8013446622173496
Energy: 0.8216108154168821
Energy: 0.7890915329068579
Energy: 0.3485428351064418
Energy: 0.79517839597221
Energy: 0.34158370489035406
Energy: 0.34227276066357076
Energy: 0.3428211666576095
Energy: 0.342272760663978
Energy: 0.34158370489035406
Energy: 0.342272760663978
Energy: 0.3485428351064418
Energy: 0.790963783879776
Energy: 0.8216108154176738
Energy: 0.8040345375767446
Energy: 0.3485428351064418
Energy: 0.7875541912598742
Energy: 0.34158370489035406
Energy: 0.342272760663978
Energy: 0.34267209108171803
Energy: 0.34227276066357076
Energy: 0.34158370489035406
Energy: 0.34227276066357076

minimum gb energy = 0.34158370489035406 eV
minimum distance =  2.43645131048211 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 1.7527811810482015
Energy: 1.3628516298782685
Energy: 1.3380715984697304
Energy: 1.362851625242936
Energy: 1.7527811843732846
Energy: 1.3628516226219929
Energy: 2.0627661409557323
Energy: 0.9635444307069763
Energy: 0.9822286290606341
Energy: 0.9643075769156824
Energy: 2.0627661409541065
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Energy: 1.610897848418598
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Energy: 1.7019676982084546
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Energy: 1.3316510777575388
Energy: 1.372431416465495
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Energy: 1.2797760845017598
Energy: 1.3316510778474406
Energy: 1.0478193122669164
Energy: 1.2356255655712112
Energy: 1.581790642877226
Energy: 1.2356254881610529
Energy: 1.047819312264798
Energy: 1.2356255290001774
Energy: 1.034346590810985
Energy: 1.3136993898741511
Energy: 1.3936776276046814
Energy: 1.3136994018713264
Energy: 1.0343465908126106
Energy: 1.3136993971910675
Energy: 0.9920220455051074
Energy: 1.1786747910540774
Energy: 1.5379005440250508
Energy: 1.1802166469578188
Energy: 0.9920220455045654
Energy: 1.1788801968528857
Energy: 1.0283065150141137
Energy: 1.338178311853279
Energy: 1.6514962198112335
Energy: 1.3381783118754957
Energy: 1.0283065148613548
Energy: 1.3381783118646582
Energy: 0.9731026066825585
Energy: 1.0525327530142157
Energy: 1.8372823281322477
Energy: 1.026520436821062
Energy: 0.9731026066874353
Energy: 1.05376775135955
Energy: 0.9938240500835391
Energy: 1.346772171100773
Energy: 1.6384596976028107
Energy: 1.3467721690886
Energy: 0.9938240500862487
Energy: 1.3467721663056862
Energy: 0.9905417486396975
Energy: 1.0538737144788712
Energy: 1.7087172783852378
Energy: 1.0538748210926243
Energy: 0.990541748633737
Energy: 1.0538793448904589
Energy: 1.0278320866164945
Energy: 1.3288817695649866
Energy: 1.635500684688148
Energy: 1.3288817693943948
Energy: 1.0278320866159527
Energy: 1.328881769799519
Energy: 0.982525851335886
Energy: 1.024258396185345
Energy: 1.7742514616150187
Energy: 1.0242584236932513
Energy: 0.9825258515314038
Energy: 1.024257718760328
Energy: 1.049569651650569
Energy: 1.318994286466908
Energy: 1.3997336150559083
Energy: 1.3189943215793665
Energy: 1.0495696516543622
Energy: 1.318994306466173
Energy: 1.0697854564589313
Energy: 1.2683807967333887
Energy: 1.5177372560690208
Energy: 1.2683807973102372
Energy: 1.0697854564621823
Energy: 1.2683807970908771
Energy: 1.3102137852815192
Energy: 1.301994186646717
Energy: 1.334977252774545
Energy: 1.3019941862388835
Energy: 1.310213785273391
Energy: 1.3019941865919877

minimum gb energy = 0.9635444307069763 eV
minimum distance =  2.23266953461379 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.610476955304415
Energy: 1.5264561597905209
Energy: 1.282025505584187
Energy: 1.526456169945905
Energy: 1.6104769638213627
Energy: 1.5264561644210883
Energy: 1.8513772688349885
Energy: 1.0687880143067436
Energy: 1.0932419996112093
Energy: 1.0687805983729546
Energy: 1.8513772685472727
Energy: 1.0687887231643067
Energy: 1.5443667815814497
Energy: 1.4807391742950837
Energy: 1.2747681908704525
Energy: 1.4807391734632396
Energy: 1.5443652021059426
Energy: 1.4807391715586888
Energy: 1.7092698546804046
Energy: 1.0681813839218157
Energy: 1.0913441445956447
Energy: 1.0697675274213851
Energy: 1.7092698547094094
Energy: 1.067147629210074
Energy: 1.1684367952347199
Energy: 1.4348924668184533
Energy: 1.0826196135902542
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Energy: 1.434892466692833
Energy: 1.471363947993468
Energy: 1.3942302253489873
Energy: 1.0928674718708369
Energy: 1.3942300581886664
Energy: 1.4713641150675516
Energy: 1.394230798703271
Energy: 1.1153668658585705
Energy: 1.405232609914294
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Energy: 1.5158203806512454
Energy: 1.5766506561983054
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Energy: 1.4303333515243362
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Energy: 1.4303333510106324
Energy: 1.0828408734552835
Energy: 1.4303333436556027
Energy: 1.0761443164003706
Energy: 1.4718856698292895
Energy: 1.5111332448198993
Energy: 1.4718856707853003
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Energy: 1.4718856733306285
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Energy: 1.4102475019758138
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Energy: 1.4102475019892005
Energy: 1.07487048041684
Energy: 1.4102475032470239
Energy: 1.0832426564772784
Energy: 1.5203017596256416
Energy: 1.1369310986294026
Energy: 1.520301712946316
Energy: 1.0832426564824844
Energy: 1.5203015445058943
Energy: 1.0821539638181525
Energy: 1.402103327678311
Energy: 1.2431136120902655
Energy: 1.4021033284871005
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Energy: 1.4021033294453422
Energy: 1.4117115735694346
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Energy: 1.4601836802405355
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Energy: 1.4116017275380042
Energy: 1.460183680134962
Energy: 1.5025343485060012
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Energy: 1.0936314353149181
Energy: 1.5101726030035798
Energy: 1.502534348507489
Energy: 1.5098731696844951
Energy: 1.5023731314942632
Energy: 1.4798565836023079
Energy: 1.245811897395287
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Energy: 1.5023731314942632
Energy: 1.4798565835472728
Energy: 1.8550275030017853
Energy: 1.4859006053494108
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Energy: 1.855027503028525
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Energy: 1.8570836570385438
Energy: 1.4759613932385274
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Energy: 1.8570836570356029
Energy: 1.4759614067086457
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Energy: 1.480292590571496
Energy: 1.4084735807802333
Energy: 1.480292590443645
Energy: 1.5045057877462884
Energy: 1.4802925907097595
Energy: 1.5027679963018605
Energy: 1.5225267084240528
Energy: 1.0922049010435506
Energy: 1.5225267068748622
Energy: 1.502767996301117
Energy: 1.522526704374123
Energy: 1.4107822213375378
Energy: 1.4595306597505309
Energy: 1.0772237848328596
Energy: 1.4595306596888364
Energy: 1.4107822230309752
Energy: 1.459530659834537
Energy: 1.4133914139697241
Energy: 1.4831032682636787
Energy: 1.0946984952382073
Energy: 1.483103268283759
Energy: 1.4133914139689807
Energy: 1.4831032682554979
Energy: 1.0815014623730377
Energy: 1.405644261066516
Energy: 1.4055742331590855
Energy: 1.405644260684416
Energy: 1.0815014623745252
Energy: 1.405644260958745
Energy: 1.0839686366207928
Energy: 1.54738806088258
Energy: 1.1374355074470945
Energy: 1.5473880613405053
Energy: 1.0839686366267425
Energy: 1.5473880622333342
Energy: 1.0752384519790152
Energy: 1.4102475031830644
Energy: 1.4071799586380263
Energy: 1.4102475016792069
Energy: 1.0752384519819902
Energy: 1.41024750202713
Energy: 1.0752918315042252
Energy: 1.471718714842787
Energy: 1.5229041790932623
Energy: 1.4717187152694762
Energy: 1.0752918315034816
Energy: 1.4717187190310137
Energy: 1.0816026997615276
Energy: 1.4506273132677108
Energy: 1.831283534614883
Energy: 1.4506273132253527
Energy: 1.0816026997652461
Energy: 1.4506273132372185
Energy: 1.10026768516913
Energy: 1.518952254176043
Energy: 1.582717224300915
Energy: 1.5189522541411222
Energy: 1.1002676851609494
Energy: 1.51895225429426
Energy: 1.075622146176872
Energy: 1.2397572196690847
Energy: 1.7262732770326632
Energy: 1.2397572058064545
Energy: 1.075622146176872
Energy: 1.239757125242968
Energy: 1.0573629401843814
Energy: 1.4732793259996972
Energy: 1.5128441619544104
Energy: 1.4732794419385935
Energy: 1.057362940174713
Energy: 1.4732796850861583
Energy: 1.0821946822590396
Energy: 1.2719855450404793
Energy: 1.6642189709363697
Energy: 1.2517828210648319
Energy: 1.0821946822724264
Energy: 1.2649904090014115
Energy: 1.0980594670774737
Energy: 1.4148221981579732
Energy: 1.13858545998173
Energy: 1.4148221983267288
Energy: 1.0980594670767299
Energy: 1.414822198155742
Energy: 1.1133942132051418
Energy: 1.3928238530972312
Energy: 1.3050966484136435
Energy: 1.3924042841697593
Energy: 1.1133952169847472
Energy: 1.3922582372169694

minimum gb energy = 1.057362940169507 eV
minimum distance =  2.22133900648299 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 1.9009379672749516
Energy: 1.5934819491775924
Energy: 1.5883253859493327
Energy: 1.593481835647385
Energy: 1.9010020687870919
Energy: 1.5934816281129962
Energy: 1.9891160314974639
Energy: 1.1497112368776825
Energy: 1.1711301304971296
Energy: 1.1496716680220722
Energy: 1.9891160314992908
Energy: 1.1496721815839015
Energy: 1.4360943803925754
Energy: 1.6029732320912022
Energy: 1.5263331559253404
Energy: 1.602973235615831
Energy: 1.4360943803934891
Energy: 1.602973190538121
Energy: 1.7546850721749843
Energy: 1.2486507543475116
Energy: 1.1943693702661695
Energy: 1.2540818324854737
Energy: 1.7546850722261205
Energy: 1.2455506288572606
Energy: 1.3380722719993738
Energy: 1.559300183843706
Energy: 1.4100584067469975
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Energy: 1.3380722719984808
Energy: 1.5593001825589652
Energy: 1.2887966066271617
Energy: 1.5385450803792682
Energy: 1.3106339315866695
Energy: 1.5385450812978745
Energy: 1.2887966216451545
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Energy: 1.188592972056975
Energy: 1.4846076724592685
Energy: 1.5704351130329537
Energy: 1.4846076650484445
Energy: 1.188592972056975
Energy: 1.4846076682826983
Energy: 1.260685864556091
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Energy: 1.3892444132845894
Energy: 1.5850702308865159
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Energy: 1.16344402176041
Energy: 1.4428102406685706
Energy: 1.7955071069662998
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Energy: 1.16344402176041
Energy: 1.442810240173671
Energy: 1.150679211415298
Energy: 1.6174924012257612
Energy: 1.7088035752767383
Energy: 1.6174924101834236
Energy: 1.1506792115120896
Energy: 1.6174924124579837
Energy: 1.1568491640563474
Energy: 1.499236884733427
Energy: 1.722568685006257
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Energy: 1.4992368852329145
Energy: 1.2521472418044848
Energy: 1.5838906239348853
Energy: 1.3844265217409615
Energy: 1.5838908262955766
Energy: 1.252147241806312
Energy: 1.5838907995130287
Energy: 1.2530230512092153
Energy: 1.2476084796606306
Energy: 1.6051068534606683
Energy: 1.2476041676730387
Energy: 1.2530230512083018
Energy: 1.2475919840980163
Energy: 1.2940873203883287
Energy: 1.6162414981993112
Energy: 1.2994303018010132
Energy: 1.6162414981892625
Energy: 1.294087320387415
Energy: 1.616241498186522
Energy: 1.2923850950806688
Energy: 1.5338070486055142
Energy: 1.2577372424952076
Energy: 1.5338070487570958
Energy: 1.292385095081582
Energy: 1.5338070494565406
Energy: 1.7252329439336795
Energy: 1.464742817582745
Energy: 1.1946256306557252
Energy: 1.4645521994657051
Energy: 1.725232943934593
Energy: 1.4645616515385356
Energy: 1.72944828873821
Energy: 1.5731793276610861
Energy: 1.36310938148345
Energy: 1.573179766437962
Energy: 1.7294482881702502
Energy: 1.5731796205899005
Energy: 1.8476563732297129
Energy: 1.5500772678918404
Energy: 1.1591164957687958
Energy: 1.550079642395642
Energy: 1.8476563732297129
Energy: 1.5500765619387047
Energy: 1.848026715612163
Energy: 1.62352432281775
Energy: 1.159893573185939
Energy: 1.623524324144492
Energy: 1.848026715602135
Energy: 1.6235243250685794
Energy: 1.7238171484996565
Energy: 1.4923414496490053
Energy: 1.1695545767050854
Energy: 1.492341452208459
Energy: 1.7238171485087916
Energy: 1.4923414631402578
Energy: 1.7279829310196253
Energy: 1.680225716632153
Energy: 1.1955811144891526
Energy: 1.6802257177616786
Energy: 1.727982967674767
Energy: 1.6802257156962106
Energy: 1.291996393748306
Energy: 1.5552821177526284
Energy: 1.254756183157909
Energy: 1.5552821177462337
Energy: 1.291996393748306
Energy: 1.5552821177380118
Energy: 1.2933303363885598
Energy: 1.6112080635845776
Energy: 1.300914723554263
Energy: 1.61120806354349
Energy: 1.2933303364643405
Energy: 1.611208063585491
Energy: 1.269275278461271
Energy: 1.5588595173561806
Energy: 1.2983180443283353
Energy: 1.5588595173790185
Energy: 1.269275278461271
Energy: 1.558859517261216
Energy: 1.255330590586903
Energy: 1.6852011746719546
Energy: 1.3770975192948227
Energy: 1.6852015676616277
Energy: 1.255330590834363
Energy: 1.685201378223336
Energy: 1.160355019656347
Energy: 1.5129919433138364
Energy: 1.6484960562837874
Energy: 1.5129911140619998
Energy: 1.160355019656347
Energy: 1.5129919553632853
Energy: 1.1721616689381043
Energy: 1.6100256431002415
Energy: 1.7050318343755433
Energy: 1.6100256430134987
Energy: 1.1721616689362773
Energy: 1.6100256431458968
Energy: 1.1547534172419076
Energy: 1.5811965528673932
Energy: 1.642351473426848
Energy: 1.581196349174479
Energy: 1.1547534172419076
Energy: 1.5811963078478468
Energy: 1.2558047015274056
Energy: 1.5794249078106193
Energy: 1.3856423651639946
Energy: 1.579424909400351
Energy: 1.255804701386786
Energy: 1.5794249295911285
Energy: 1.1891580095906664
Energy: 1.379346610087356
Energy: 1.550904265677612
Energy: 1.379332362453608
Energy: 1.1891580096253802
Energy: 1.3793412038293595
Energy: 1.265200605446245
Energy: 1.5636951073933936
Energy: 1.3022681456093455
Energy: 1.563695107741299
Energy: 1.2652006034912715
Energy: 1.563695108075502

minimum gb energy = 1.1496716680220722 eV
minimum distance =  2.22632411607792 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.4304175731710376
Energy: 1.7463242786531616
Energy: 1.4872447507952111
Energy: 1.7463242736650806
Energy: 1.430417573169855
Energy: 1.746324224148549
Energy: 1.589201231520262
Energy: 1.265567837816302
Energy: 1.260966983538463
Energy: 1.305874607464112
Energy: 1.5892012316242956
Energy: 1.2897521893698636
Energy: 1.3216991826525848
Energy: 1.6974515738510003
Energy: 1.483763998833099
Energy: 1.6974515746585117
Energy: 1.3216991826525848
Energy: 1.6974515739432328
Energy: 1.26135910707693
Energy: 1.3503505682056696
Energy: 1.267028711501234
Energy: 1.3503504559427693
Energy: 1.2613591411847227
Energy: 1.3503505928067152
Energy: 1.2556238643282671
Energy: 1.262301257183541
Energy: 1.2516010986492336
Energy: 1.267497491914648
Energy: 1.2556238643247186
Energy: 1.2657347299401587
Energy: 1.2531972458041796
Energy: 1.6797229524839001
Energy: 1.2863728070016502
Energy: 1.6797229522687087
Energy: 1.2531972461080279
Energy: 1.6797229524259691
Energy: 1.2313414512831988
Energy: 1.4839160871837
Energy: 1.6157712283826124
Energy: 1.4843057187894269
Energy: 1.2313414512831988
Energy: 1.4833209204691982
Energy: 1.3122713011838614
Energy: 1.746900873900456
Energy: 1.3975351032695558
Energy: 1.7469008506484076
Energy: 1.312271301185044
Energy: 1.7469008761491704
Energy: 1.2547584117530903
Energy: 1.276867868975033
Energy: 1.246229028362401
Energy: 1.2765198585595472
Energy: 1.2547584117530903
Energy: 1.2767499967772344
Energy: 1.2350691981727508
Energy: 1.7218018137452613
Energy: 1.2755395743268316
Energy: 1.72180181374053
Energy: 1.2350691981739337
Energy: 1.7218018137559066
Energy: 1.230801603826308
Energy: 1.2768437549110538
Energy: 1.2556546869288434
Energy: 1.2828212459735155
Energy: 1.230801603826308
Energy: 1.2826944246747622
Energy: 1.2594196821786523
Energy: 1.536697243873797
Energy: 1.2666910179629756
Energy: 1.5403118652785472
Energy: 1.259419682179835
Energy: 1.5371558880540892
Energy: 1.2545762225798844
Energy: 1.6920860980242638
Energy: 1.2328606791557077
Energy: 1.6920860980195325
Energy: 1.2545762225798844
Energy: 1.6920860980218981
Energy: 1.563070862206736
Energy: 1.7259729475851078
Energy: 1.2428698300371677
Energy: 1.725972947540188
Energy: 1.563065811647089
Energy: 1.7259729474444336
Energy: 1.867243419779402
Energy: 1.7307876372183406
Energy: 1.264570524318955
Energy: 1.7307875947222038
Energy: 1.8672434193277825
Energy: 1.730787667557021
Energy: 1.2589751532535478
Energy: 1.741627498612287
Energy: 1.2643878080892859
Energy: 1.7416274985224203
Energy: 1.258975153252365
Energy: 1.7416274972077244
Energy: 1.254869627593361
Energy: 1.5272566249733162
Energy: 1.2336386531207588
Energy: 1.5268710603978857
Energy: 1.2548696275921782
Energy: 1.5377263527672635
Energy: 1.2353712776808912
Energy: 1.5318140580700534
Energy: 1.2339192427849281
Energy: 1.5333537962722128
Energy: 1.2353712776797083
Energy: 1.533036750154489
Energy: 1.233615042267691
Energy: 1.551820935153837
Energy: 1.2548189982599358
Energy: 1.5517772781690342
Energy: 1.2336150422665084
Energy: 1.5517743023780743
Energy: 1.263335668833973
Energy: 1.7425218314143114
Energy: 1.259095769589659
Energy: 1.7425218314202255
Energy: 1.2633356688292419
Energy: 1.7425218314154942
Energy: 1.2776766341191426
Energy: 1.7301960536688452
Energy: 1.8696491085443772
Energy: 1.730195998576644
Energy: 1.2776766341191426
Energy: 1.7301959970964078
Energy: 1.2426131274946652
Energy: 1.490722938546548
Energy: 1.5620676106231968
Energy: 1.4909930915737102
Energy: 1.242613127495848
Energy: 1.490939033262075
Energy: 1.2330226927118584
Energy: 1.6842492653877468
Energy: 1.2567246112767556
Energy: 1.6842492653440095
Energy: 1.2330226927106758
Energy: 1.6842492653641175
Energy: 1.2720493282139833
Energy: 1.5235212634375106
Energy: 1.259221223437278
Energy: 1.523486241506278
Energy: 1.2720493282151664
Energy: 1.5235693164594524

minimum gb energy = 1.230801603826308 eV
minimum distance =  2.22211683294486 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.4583287613797111
Energy: 1.4307521252425477
Energy: 1.350794752376164
Energy: 1.4374442389731024
Energy: 1.4583287613797111
Energy: 1.436631597033298
Energy: 1.3793938830406474
Energy: 1.360830532565114
Energy: 1.345993042718737
Energy: 1.3607991846341934
Energy: 1.3795736333622073
Energy: 1.3607918909249193
Energy: 1.4081537821230519
Energy: 1.4143341187770568
Energy: 1.620018843099374
Energy: 1.4106729580752513
Energy: 1.4081537821230519
Energy: 1.4085074296377211
Energy: 1.4033160142645789
Energy: 1.357779352270452
Energy: 1.350978901065038
Energy: 1.3667407715988973
Energy: 1.4033160142612333
Energy: 1.3701421352746312
Energy: 1.3457469118690946
Energy: 1.355510519597947
Energy: 1.3872654674298455
Energy: 1.3541867928642883
Energy: 1.3457469118690946
Energy: 1.3604756558881015
Energy: 1.3433601552515917
Energy: 1.4072659214516376
Energy: 1.4158914892697847
Energy: 1.4084120992544338
Energy: 1.3433601552265382
Energy: 1.4084493634203634
Energy: 1.357179986410224
Energy: 1.469458587887777
Energy: 1.4101525963532127
Energy: 1.498807221513269
Energy: 1.3571791661388264
Energy: 1.4632887354644692
Energy: 1.3685779863784868
Energy: 1.5782541716854819
Energy: 1.3512248623196468
Energy: 1.5716383376016643
Energy: 1.3685779977581622
Energy: 1.5748178554749295
Energy: 1.3431134784416676
Energy: 1.361447028432676
Energy: 1.370600247431946
Energy: 1.361450207766676
Energy: 1.343113478439995
Energy: 1.3614509884131898
Energy: 1.4096349306398883
Energy: 1.378266664549224
Energy: 1.3470032577315443
Energy: 1.3783116484901745
Energy: 1.4096349301199294
Energy: 1.3782513727108534
Energy: 1.4085217406620854
Energy: 1.6815772271106597
Energy: 1.37856640503138
Energy: 1.681576959295323
Energy: 1.4085217406838313
Energy: 1.6815770129917917
Energy: 1.3828842773064378
Energy: 1.3786146379821935
Energy: 1.3704066273605189
Energy: 1.3948669425431428
Energy: 1.382884277252948
Energy: 1.3817233192625291
Energy: 1.3511791494389922
Energy: 1.5721096212103733
Energy: 1.3502885995153266
Energy: 1.5815163105013361
Energy: 1.3511791494440106
Energy: 1.5709383144903148
Energy: 1.3415718245506698
Energy: 1.3505131425086487
Energy: 1.3441990096842926
Energy: 1.350515424913066
Energy: 1.341571824548997
Energy: 1.35051427749015
Energy: 1.3544915946460903
Energy: 1.6530643770485456
Energy: 1.418263135357986
Energy: 1.6530635059982954
Energy: 1.3544915946360538
Energy: 1.6530665489751324
Energy: 1.3941266010164068
Energy: 1.6567646202017294
Energy: 1.4101519978234014
Energy: 1.6622347134583209
Energy: 1.3941266010147342
Energy: 1.6675878641960327
Energy: 1.3444278339292108
Energy: 1.3582693783312467
Energy: 1.3547373465420578
Energy: 1.35826675540092
Energy: 1.3444278338707027
Energy: 1.3582735457442692

minimum gb energy = 1.341571824548997 eV
minimum distance =  2.22381212986575 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.98680465180967
Energy: 2.0128331620374436
Energy: 1.7734998180321035
Energy: 2.0128331563794273
Energy: 1.9868046518051483
Energy: 2.0128331547775447
Energy: 1.734300754995974
Energy: 1.484429254231853
Energy: 1.4130042420365352
Energy: 1.4844292717882304
Energy: 1.7343007549482026
Energy: 1.4844292560268177
Energy: 1.453734784258351
Energy: 1.499008480438512
Energy: 1.6560576875071793
Energy: 1.498253383999459
Energy: 1.4537347842570592
Energy: 1.4983296007044162
Energy: 1.5386197071619585
Energy: 1.8184606384195214
Energy: 1.4946009010373218
Energy: 1.818460638502791
Energy: 1.5386197069953607
Energy: 1.8184606384634172
Energy: 1.421741544007182
Energy: 1.5218158211084485
Energy: 1.743583030163889
Energy: 1.4294872059693737
Energy: 1.4217415440039518
Energy: 1.5216483873366622
Energy: 1.4814740822913643
Energy: 1.8382148098460185
Energy: 1.5476658235252991
Energy: 1.8382148132021998
Energy: 1.481474082353993
Energy: 1.8382148029806227
Energy: 1.4142674082139084
Energy: 1.495802556796999
Energy: 1.6452961858379338
Energy: 1.5318411404802514
Energy: 1.4142674082132622
Energy: 1.5330481739750872
Energy: 1.6998036805119403
Energy: 1.6683744178486788
Energy: 1.4106925817821123
Energy: 1.6683701000066495
Energy: 1.6998036930443667
Energy: 1.6683713627527856
Energy: 1.5415806724858503
Energy: 1.8832445449296626
Energy: 1.4223082164437364
Energy: 1.8832447400295833
Energy: 1.5415806724852044
Energy: 1.883246147574112
Energy: 1.8724642774523104
Energy: 1.5513265223631185
Energy: 1.4092308365741255
Energy: 1.55130398076253
Energy: 1.8724642775084792
Energy: 1.5512825125758973
Energy: 1.4906955946078544
Energy: 1.9593352842614187
Energy: 1.4779964440127185
Energy: 1.9593349508100981
Energy: 1.4906955946059166
Energy: 1.9593349289335378
Energy: 1.4452611259992005
Energy: 1.7935448400590228
Energy: 1.4388693316711385
Energy: 1.7935446730928613
Energy: 1.4452611260030763
Energy: 1.7935449714036211
Energy: 1.41634119028864
Energy: 1.6688603601974026
Energy: 1.9488041062221388
Energy: 1.6688603641631021
Energy: 1.416341190278305
Energy: 1.6688603601205927
Energy: 1.4086946467060066
Energy: 2.024529526546163
Energy: 1.9372870685365404
Energy: 2.0245295261787897
Energy: 1.4086946467066523
Energy: 2.024529526668865
Energy: 1.429495478781638
Energy: 1.8759102094605449
Energy: 1.4957803293280696
Energy: 1.8759102094566693
Energy: 1.42949547878293
Energy: 1.8759102094650668
Energy: 1.504179693813421
Energy: 1.9380644473905915
Energy: 1.4408193396491074
Energy: 1.9380644475145856
Energy: 1.5041796938108374
Energy: 1.9380644474215973
Energy: 1.4942107101084088
Energy: 1.9017077448346773
Energy: 1.4236567477063198
Energy: 1.9017077448224335
Energy: 1.4942107101155142
Energy: 1.9017077448450124
Energy: 1.8925368915619853
Energy: 1.7996788555293182
Energy: 1.4245857881642834
Energy: 1.7996782377530942
Energy: 1.892536894756766
Energy: 1.7996816070309725
Energy: 1.7211109371202282
Energy: 1.7794644929153793
Energy: 1.4134098062916476
Energy: 1.779464503369413
Energy: 1.7211109407695564
Energy: 1.779464370526872
Energy: 1.421142599187782
Energy: 1.8143166775251551
Energy: 1.4202104801315525
Energy: 1.8143166775425963
Energy: 1.421142599185198
Energy: 1.889814390589235
Energy: 1.4151155312966635
Energy: 1.7733165683887386
Energy: 1.8978918324323573
Energy: 1.7734297962734893
Energy: 1.4151155312998933
Energy: 1.7771307310580682
Energy: 1.4218872530595685
Energy: 1.791856447098938
Energy: 1.8903431993123263
Energy: 1.791856390643564
Energy: 1.4218872530582767
Energy: 1.7918562999128576
Energy: 1.415042192777475
Energy: 1.902225756964252
Energy: 1.4992601625306567
Energy: 1.9022257572496468
Energy: 1.4150421930518886
Energy: 1.9022257571114711
Energy: 1.439911787906814
Energy: 1.8168235086104738
Energy: 1.5054300539252001
Energy: 1.8168235073585233
Energy: 1.439911787904876
Energy: 1.8168235079112267
Energy: 1.4952773089200306
Energy: 1.8748922581394036
Energy: 1.4066904227521102
Energy: 1.8748922579979976
Energy: 1.4952773089161548
Energy: 1.874892258267244
Energy: 1.9392664314625692
Energy: 2.0229129785536726
Energy: 1.4144100495320393
Energy: 2.022912978098479
Energy: 1.9392664310971048
Energy: 2.0229129785233124
Energy: 1.9455355362567304
Energy: 1.6612172626460124
Energy: 1.4191014154826076
Energy: 1.6612180920260966
Energy: 1.9455355356065465
Energy: 1.661217328371236
Energy: 1.4393240547156638
Energy: 1.797016359158198
Energy: 1.4451964842218226
Energy: 1.79699771036404
Energy: 1.4393240547098503
Energy: 1.7930159024565944
Energy: 1.4774109570102756
Energy: 1.9588212736489297
Energy: 1.4905377809189477
Energy: 1.9588212730717092
Energy: 1.4774109570109215
Energy: 1.9588212727882521
Energy: 1.4093899551254956
Energy: 1.5987329894354663
Energy: 1.8734813920940658
Energy: 1.5985827840793396
Energy: 1.4093899551158062
Energy: 1.5985712991554728
Energy: 1.4204812769771997
Energy: 1.885726440691229
Energy: 1.5401040883094033
Energy: 1.8857263864524232
Energy: 1.4204812769830133
Energy: 1.885726466259075
Energy: 1.4134080142976069
Energy: 1.6265071974415273
Energy: 1.6956290529516973
Energy: 1.6265160433974555
Energy: 1.4134080142956689
Energy: 1.626512555362311
Energy: 1.6461033333168313
Energy: 1.5426549524267552
Energy: 1.4135286311736066
Energy: 1.542655671530446
Energy: 1.6461033333148936
Energy: 1.5426590536390352
Energy: 1.5477153159455497
Energy: 1.8403977300486625
Energy: 1.4853032016663088
Energy: 1.8403979131507444
Energy: 1.5477153159468418
Energy: 1.840397817234656
Energy: 1.719274407826243
Energy: 1.5220973089509646
Energy: 1.4217547506330162
Energy: 1.5052515379609923
Energy: 1.719274364825955
Energy: 1.5160575825670843
Energy: 1.5008036548490649
Energy: 1.818228465281331
Energy: 1.5379475196833188
Energy: 1.8182284640526347
Energy: 1.500803654848419
Energy: 1.818228466355732
Energy: 1.6390829621342835
Energy: 1.5366353124233278
Energy: 1.4464327765634166
Energy: 1.5366342708828047
Energy: 1.639082959514785
Energy: 1.5366426327056533
Energy: 1.4133653968843163
Energy: 1.481811231912486
Energy: 1.7361877757896123
Energy: 1.4818112281676152
Energy: 1.4133653968836701
Energy: 1.4818112302828275
Energy: 1.6820250376741837
Energy: 2.0128331576824086
Energy: 1.9868046515933924
Energy: 2.0128331582150873
Energy: 1.6820250376728916
Energy: 2.012833155941675
Energy: 1.4130042420358895
Energy: 1.4844292415237859
Energy: 1.7343007626116476
Energy: 1.4844292592086499
Energy: 1.4130042420352436
Energy: 1.4844293324695073
Energy: 1.6560576847120692
Energy: 1.5010021098104527
Energy: 1.453734784245432
Energy: 1.4975581933920559
Energy: 1.6560576846991502
Energy: 1.4979494659368626
Energy: 1.4946009016778166
Energy: 1.8184606382800539
Energy: 1.538619707398907
Energy: 1.8184606385040831
Energy: 1.4946009016784623
Energy: 1.818460638154797
Energy: 1.7435830296531731
Energy: 1.522074451811208
Energy: 1.4217415440504606
Energy: 1.5219529424732696
Energy: 1.743583030334363
Energy: 1.5217469137314024

minimum gb energy = 1.4066904227521102 eV
minimum distance =  2.20918868626684 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 1.7902014968342579
Energy: 2.0442015886646954
Energy: 1.9851804015498937
Energy: 2.0442015882925118
Energy: 1.7902014968363613
Energy: 2.044201588477576
Energy: 1.6192701602372093
Energy: 1.5235753906630214
Energy: 1.439347485960266
Energy: 1.523574181929634
Energy: 1.6192701624996162
Energy: 1.523565398408393
Energy: 1.4673387891084628
Energy: 1.7219716200995456
Energy: 1.6901533164051765
Energy: 1.7219594989273845
Energy: 1.467338789107411
Energy: 1.7219617863268337
Energy: 1.6439637666593692
Energy: 1.7558267401250904
Energy: 1.7001168567165852
Energy: 1.755827726214434
Energy: 1.643963766628868
Energy: 1.7558323681727195
Energy: 1.4222451935032074
Energy: 1.5927194849809414
Energy: 1.770441697957555
Energy: 1.567203514570992
Energy: 1.4222451934990004
Energy: 1.5372224457452461
Energy: 1.6816302129128944
Energy: 1.8076232964325911
Energy: 1.7024225800863524
Energy: 1.8076232796590468
Energy: 1.681630212859254
Energy: 1.807623323343867
Energy: 1.4711467858573997
Energy: 1.7117327673078901
Energy: 1.499202501153574
Energy: 1.711727128297272
Energy: 1.4711467858595033
Energy: 1.7117064627439822
Energy: 1.8658810178379852
Energy: 1.5375819333580543
Energy: 1.440757260436095
Energy: 1.5380799160640646
Energy: 1.8658810178674348
Energy: 1.554079680062827
Energy: 1.5720295909495274
Energy: 2.028084855441462
Energy: 1.467938009901324
Energy: 2.0280846754487776
Energy: 1.5720295908769553
Energy: 2.028084210817717
Energy: 1.6800538450153402
Energy: 1.5376137066686797
Energy: 1.4380495503153596
Energy: 1.5376137159664287
Energy: 1.6800538449732692
Energy: 1.5376137091613287
Energy: 1.4717424783307527
Energy: 1.8732539333353466
Energy: 1.7048606706262723
Energy: 1.8732538658626754
Energy: 1.4717424783307527
Energy: 1.873254041993927
Energy: 1.4634900734159388
Energy: 1.749479182465908
Energy: 1.6974469609483365
Energy: 1.7494791829631566
Energy: 1.463490073414887
Energy: 1.7494791827970722
Energy: 1.4349081199957634
Energy: 1.725596593411327
Energy: 1.7082716691731643
Energy: 1.725596593490162
Energy: 1.4349081199957634
Energy: 1.7255965913224147
Energy: 1.6761855613544097
Energy: 2.006412955455638
Energy: 1.6929175942815267
Energy: 2.0064130792225217
Energy: 1.6761855613565133
Energy: 2.0064137241910562
Energy: 1.4767444365112996
Energy: 1.76078297008086
Energy: 1.464766044870381
Energy: 1.7607802946378102
Energy: 1.476744436509196
Energy: 1.7608165921575911
Energy: 1.7270302905742516
Energy: 1.8634987311842786
Energy: 1.438176439601919
Energy: 1.8634839134946413
Energy: 1.7028643417757334
Energy: 1.8634980031143324
Energy: 1.7628714691867842
Energy: 2.067347540618316
Energy: 1.4499131218179997
Energy: 2.0673475380626085
Energy: 1.7628714691867842
Energy: 2.067347538283385
Energy: 1.6700844661074783
Energy: 1.7707758939400478
Energy: 1.4419799931814494
Energy: 1.7707759124640257
Energy: 1.67008446593298
Energy: 1.7707759198399982
Energy: 1.4682782571203485
Energy: 1.881846884633759
Energy: 1.7147073229500707
Energy: 1.8818468767973497
Energy: 1.4682782571340214
Energy: 1.8818468713074412
Energy: 1.5015756526812758
Energy: 1.6751441254416046
Energy: 1.700911629245644
Energy: 1.6751441774748075
Energy: 1.5015756526791724
Energy: 1.6751441335292916
Energy: 1.4391674816568751
Energy: 1.7446576663457793
Energy: 1.7167579264470463
Energy: 1.7446597478179806
Energy: 1.4391674816568751
Energy: 1.7446605118908525
Energy: 1.481154736504274
Energy: 1.7904502401640863
Energy: 1.699917210117488
Energy: 1.790450241815701
Energy: 1.481154736504274
Energy: 1.7904502398623714
Energy: 1.4802443644046266
Energy: 1.689220400683083
Energy: 1.4549078340973998
Energy: 1.6763343265487598
Energy: 1.4802443644056305
Energy: 1.6784190533158039
Energy: 1.5798255487039987
Energy: 2.0303549365616953
Energy: 1.4425799353054658
Energy: 2.0303549365585396
Energy: 1.579825548693481
Energy: 2.0303549365585396
Energy: 1.5943637788457907
Energy: 1.8179895676461066
Energy: 1.4406116597428968
Energy: 1.7862904441621221
Energy: 1.5943637788951763
Energy: 1.8190433296533055
Energy: 1.4819745458415858
Energy: 1.7611544820947924
Energy: 1.4564187175484788
Energy: 1.7611544760329598
Energy: 1.4819745458415858
Energy: 1.7611544859088957
Energy: 1.4773622791471657
Energy: 1.9192078708357247
Energy: 1.712993751495888
Energy: 1.9192078380918063
Energy: 1.4773622791503211
Energy: 1.9192078790337996

minimum gb energy = 1.4222451934990004 eV
minimum distance =  2.21684220525173 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 1.667437012911867
Energy: 1.941621273676396
Energy: 1.6962004817870702
Energy: 1.9416210802622489
Energy: 1.667437012911867
Energy: 1.9416203936797536
Energy: 1.5590818617114044
Energy: 1.4716373028380498
Energy: 1.4562002975844603
Energy: 1.4698923968389692
Energy: 1.559081850083751
Energy: 1.463048904041743
Energy: 1.4568978322510036
Energy: 1.5802028646347954
Energy: 1.8589616611387492
Energy: 1.5800140699968612
Energy: 1.4568978322540687
Energy: 1.5800164272197765
Energy: 1.6433504388737528
Energy: 1.8920789706906873
Energy: 1.598224440790796
Energy: 1.892078970724371
Energy: 1.6433503836746204
Energy: 1.892078970689921
Energy: 1.4583358098833403
Energy: 1.5803353090724312
Energy: 1.5802252959868053
Energy: 1.5803378488646413
Energy: 1.4583358098825738
Energy: 1.5803351890572097
Energy: 1.6016053182176337
Energy: 1.5634686218862148
Energy: 1.4978684092017691
Energy: 1.5647263790615293
Energy: 1.6016053182130359
Energy: 1.5856895945681557
Energy: 1.4998734130556817
Energy: 1.5590485540298589
Energy: 1.4678851221085054
Energy: 1.5600735345394179
Energy: 1.4998734130556817
Energy: 1.551154362082221
Energy: 1.6464572591078368
Energy: 1.5704573410000588
Energy: 1.4537064702036215
Energy: 1.5704564057698343
Energy: 1.6464785116809821
Energy: 1.5704538269123778
Energy: 1.5924733055909592
Energy: 1.893183933060753
Energy: 1.5681509722056854
Energy: 1.893183933750132
Energy: 1.5924733055924918
Energy: 1.8931839337455336
Energy: 1.7076048443944485
Energy: 1.6119465541139475
Energy: 1.4635521575896149
Energy: 1.614447811923061
Energy: 1.707604840125637
Energy: 1.6121481811958214
Energy: 1.4573874758393441
Energy: 1.5325215369210183
Energy: 1.8570847529845411
Energy: 1.5346512703467625
Energy: 1.4573874758401104
Energy: 1.530433637631518
Energy: 1.4773271221535378
Energy: 1.9475196359642333
Energy: 1.6686781356059297
Energy: 1.9501159765032552
Energy: 1.4773271221581357
Energy: 1.949975131455156
Energy: 1.4654420668591326
Energy: 1.4797340198632898
Energy: 1.5546877553229077
Energy: 1.48188034746955
Energy: 1.465442066855301
Energy: 1.4644994521766124
Energy: 1.6195091291446186
Energy: 1.7115947728342755
Energy: 1.463553985988349
Energy: 1.7115926743831444
Energy: 1.619509130112835
Energy: 1.7115932824108817
Energy: 1.5905204223955727
Energy: 1.9537395466628158
Energy: 1.4720234848377616
Energy: 1.953739578448117
Energy: 1.5905204218999696
Energy: 1.9537395534325976
Energy: 1.5672902896046566
Energy: 1.7478571700961318
Energy: 1.466162921283278
Energy: 1.7478497130361244
Energy: 1.567291543136682
Energy: 1.7478532648914549
Energy: 1.5062951672222258
Energy: 1.7398363618536885
Energy: 1.5707971681145823
Energy: 1.750065929184261
Energy: 1.5062951672222258
Energy: 1.7334616962545706
Energy: 1.477807429264723
Energy: 1.5553514924203324
Energy: 1.5131348235741273
Energy: 1.5573459094990592
Energy: 1.4778074292624241
Energy: 1.5636006047638882
Energy: 1.4515961071739911
Energy: 1.652311361593411
Energy: 1.6465444801387346
Energy: 1.652311443690853
Energy: 1.4515961071701595
Energy: 1.6523112630740144
Energy: 1.4830847102009788
Energy: 1.8103728486826598
Energy: 1.5983531173571486
Energy: 1.8104412453004004
Energy: 1.4830847101986802
Energy: 1.8104296622169278
Energy: 1.4727764186337848
Energy: 1.5406518961569124
Energy: 1.4800656297371058
Energy: 1.5813094297039803
Energy: 1.4727764186337848
Energy: 1.5761178619996872
Energy: 2.0984074062113294
Energy: 1.731793099614341
Energy: 1.4680234204452491
Energy: 1.7329028524580048
Energy: 2.098407406208264
Energy: 1.7461786456013295
Energy: 2.0757943534670344
Energy: 1.8027925259900655
Energy: 1.4674804860682231
Energy: 1.8027925610698312
Energy: 2.0757943533329968
Energy: 1.8027924946681817
Energy: 1.4827530452919193
Energy: 1.5670935754175486
Energy: 1.4609234443028438
Energy: 1.5590291945512245
Energy: 1.4827530452896203
Energy: 1.5596661592077425
Energy: 1.4740355053421053
Energy: 1.8551779871020948
Energy: 1.617918202557272
Energy: 1.8551779898037029
Energy: 1.4740355053421053
Energy: 1.8551779976788034
Energy: 1.4666735046128496
Energy: 1.7848949209381413
Energy: 1.6109233972648682
Energy: 1.7837927758848704
Energy: 1.4666735046174475
Energy: 1.7846031426790054
Energy: 1.4642163999088735
Energy: 1.7592771703786083
Energy: 1.562152761020593
Energy: 1.7592771684643989
Energy: 1.4642163994622803
Energy: 1.7592771648504815
Energy: 1.553214421788909
Energy: 2.012117778491842
Energy: 1.5529284126250935
Energy: 2.012117778485711
Energy: 1.5532144217896753
Energy: 2.012117778491842
Energy: 1.562396883085655
Energy: 1.7057621288168103
Energy: 1.4666412870229617
Energy: 1.7246818444635856
Energy: 1.5623968821090437
Energy: 1.7215285182707187
Energy: 1.6146333879442474
Energy: 1.7892630825211506
Energy: 1.4603689104725355
Energy: 1.789263185465654
Energy: 1.61463338794578
Energy: 1.7892628605564975
Energy: 1.6159298232857864
Energy: 1.8462410391853834
Energy: 1.4707677755364286
Energy: 1.846241153811148
Energy: 1.6159298227181838
Energy: 1.8462410774011238
Energy: 1.4616578051169744
Energy: 1.5759989858213284
Energy: 1.482410626733405
Energy: 1.5759339519848166
Energy: 1.4616578051154419
Energy: 1.5727766612586955
Energy: 1.4651779914216518
Energy: 1.7942134650129227
Energy: 1.8656644375113274
Energy: 1.7940991945588476
Energy: 1.4651779914193526
Energy: 1.7942462701580797
Energy: 1.468293448761447
Energy: 1.7423064215261561
Energy: 2.0982381544110567
Energy: 1.74228371906241
Energy: 1.4682934487622132
Energy: 1.7422800308825528
Energy: 1.4725221862909446
Energy: 1.570880669435403
Energy: 1.4724483178112944
Energy: 1.5709926159508996
Energy: 1.4725221862786833
Energy: 1.5701476774814338
Energy: 1.5968871219801515
Energy: 1.814642669612479
Energy: 1.482022299809464
Energy: 1.8049769818156751
Energy: 1.5968871219809178
Energy: 1.8058315196328374

minimum gb energy = 1.4515961071701595 eV
minimum distance =  2.19983590633598 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 1.4014509663556465
Energy: 1.4026245688115144
Energy: 1.7866784275601935
Energy: 1.455905503197691
Energy: 1.4014509663553587
Energy: 1.4400702850215663
Energy: 1.8008843974993565
Energy: 1.4949333973473968
Energy: 1.4021357661723826
Energy: 1.4949091677827526
Energy: 1.8008841704119452
Energy: 1.4949244793139616
Energy: 1.4018433345656163
Energy: 1.4590759469209102
Energy: 2.0967910744664437
Energy: 1.4575869895554574
Energy: 1.4018433345630887
Energy: 1.4592959996008328
Energy: 1.784216025265392
Energy: 1.4177165199182007
Energy: 1.4014509663561903
Energy: 1.417858057658746
Energy: 1.7833231551057989
Energy: 1.4245806482292949
Energy: 1.4021357661735026
Energy: 1.494935591023629
Energy: 1.8008139106322143
Energy: 1.4949102521147775
Energy: 1.40213576617491
Energy: 1.4949238681968053
Energy: 2.0967910744734506
Energy: 1.4547368863183925
Energy: 1.4018433345636325
Energy: 1.4585565315659705
Energy: 2.096791074472331
Energy: 1.4578800822229536
Energy: 1.4014509663556465
Energy: 1.4123792216535982
Energy: 1.78528704325817
Energy: 1.4129250705583334
Energy: 1.4014509663556465
Energy: 1.4182974231654222
Energy: 1.8008994958395714
Energy: 1.4949439498840054
Energy: 1.4021357661718066
Energy: 1.4949262416010722
Energy: 1.8008994147770727
Energy: 1.4949350915888855
Energy: 1.401843334566448
Energy: 1.4057693150085588
Energy: 1.8085958291847797
Energy: 1.4584937903205153
Energy: 1.4018433345653283
Energy: 1.4592722747929714
Energy: 1.7835147427865663
Energy: 1.4170715360170845
Energy: 1.4014509663559347
Energy: 1.4182211356622243
Energy: 1.7835105698262932
Energy: 1.4102433296942538

minimum gb energy = 1.4014509663553587 eV
minimum distance =  2.23639227662946 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 1.920435924096861
Energy: 1.9281635192261708
Energy: 1.9492453182789438
Energy: 1.9264841215539905
Energy: 1.9204359241119893
Energy: 1.9255820950567129
Energy: 1.7745879723258375
Energy: 1.4827751484357232
Energy: 1.4331553866251314
Energy: 1.4827751721281783
Energy: 1.774587917306191
Energy: 1.482775181310069
Energy: 1.432193097936802
Energy: 1.520487856595907
Energy: 1.84288998967255
Energy: 1.5204878568165896
Energy: 1.432193097936802
Energy: 1.520487855200343
Energy: 2.0228482931179625
Energy: 1.9075876512630219
Energy: 1.5350739199279497
Energy: 1.9101016181228998
Energy: 2.0228482931188054
Energy: 1.9073944083427403
Energy: 1.474817942585347
Energy: 1.4943728587735434
Energy: 1.918399450096593
Energy: 1.4946929419000703
Energy: 1.474817942585347
Energy: 1.494238317389631
Energy: 1.7157668042512018
Energy: 1.4988328752159756
Energy: 1.440093478850533
Energy: 1.5009980976161617
Energy: 1.715750884718597
Energy: 1.5019257252167386
Energy: 1.4727645425696505
Energy: 1.568486065762663
Energy: 1.620469731039763
Energy: 1.5684861286233664
Energy: 1.4727645425704932
Energy: 1.5684868122129727
Energy: 1.495168896541836
Energy: 1.9216120042220513
Energy: 1.538868160183538
Energy: 1.921589853274945
Energy: 1.4951690142671874
Energy: 1.92156286808741
Energy: 1.4390631720222884
Energy: 1.7249790658814876
Energy: 1.8458160154345227
Energy: 1.7249790660516147
Energy: 1.439063172027344
Energy: 1.7249790660768924
Energy: 1.4574470138797917
Energy: 1.4960788381226828
Energy: 1.4420380602146634
Energy: 1.4960586629498915
Energy: 1.4574470159802997
Energy: 1.496044829465021
Energy: 1.8900091526870317
Energy: 1.802005332296537
Energy: 1.479496637847648
Energy: 1.8020172170743627
Energy: 1.8900091561982704
Energy: 1.8020029128942934
Energy: 1.9128327298707286
Energy: 1.7581382214729344
Energy: 1.4453700883402223
Energy: 1.758138227355843
Energy: 1.9128327299920236
Energy: 1.7581382219193171
Energy: 1.4374948957329956
Energy: 1.5481859606024018
Energy: 1.444476892207287
Energy: 1.5481117857655053
Energy: 1.4374948957355234
Energy: 1.5439387392432777
Energy: 1.4740099222946332
Energy: 1.762746460384712
Energy: 1.5404580677875797
Energy: 1.7627464634722796
Energy: 1.4740099223274943
Energy: 1.7627464680674378
Energy: 1.4792349890922336
Energy: 1.7653002516428862
Energy: 1.5468045431744866
Energy: 1.7653002523714227
Energy: 1.4792349890930379
Energy: 1.765300252236646
Energy: 1.4906387824245393
Energy: 1.4933250415022152
Energy: 1.4368144323845986
Energy: 1.5189988943077093
Energy: 1.4906387824245393
Energy: 1.5184999202048939
Energy: 1.4855230645186124
Energy: 1.6842763284729478
Energy: 1.4516648438791822
Energy: 1.6842765643784972
Energy: 1.4855230645194548
Energy: 1.6842768282591727
Energy: 1.4864577391082732
Energy: 1.6452813018383046
Energy: 1.5465798519643124
Energy: 1.6460170663673495
Energy: 1.4864577391074307
Energy: 1.646008046197988
Energy: 1.4329435352068394
Energy: 1.7056589981393182
Energy: 1.5340499776893073
Energy: 1.705618097715195
Energy: 1.4329435352009412
Energy: 1.705650121885822
Energy: 1.4457935049906605
Energy: 1.7480331374425118
Energy: 1.4444249328272318
Energy: 1.7480328164113481
Energy: 1.4457935049864474
Energy: 1.748032757545302
Energy: 1.9131734886182818
Energy: 1.8008392779678408
Energy: 1.4417758002170256
Energy: 1.8008392964831736
Energy: 1.9131734888894818
Energy: 1.8008393005494134
Energy: 1.8932258185637743
Energy: 1.8026902560522193
Energy: 1.446267143317814
Energy: 1.8026902487771173
Energy: 1.8932258188037985
Energy: 1.8026902532787858
Energy: 1.459004757066107
Energy: 1.4851720998347402
Energy: 1.447509543390649
Energy: 1.4862493064103648
Energy: 1.4590047563931814
Energy: 1.501928269674281
Energy: 1.4398963309470711
Energy: 1.7187776902228418
Energy: 1.8330829390318817
Energy: 1.7187779671377437
Energy: 1.4398963308872472
Energy: 1.7187792726808473
Energy: 1.4938941505336567
Energy: 1.647820414406051
Energy: 1.5387293838914815
Energy: 1.6536053128923651
Energy: 1.4938940980499475
Energy: 1.6536834611485838
Energy: 1.4687660615080038
Energy: 1.8287214151418
Energy: 1.456304598036329
Energy: 1.8286670124876503
Energy: 1.4687660615442353
Energy: 1.8287501378777524
Energy: 1.4653090382869547
Energy: 1.7351292249715373
Energy: 1.445152979856355
Energy: 1.7351292438507175
Energy: 1.465315555854626
Energy: 1.7351292456421088
Energy: 1.4685871698571045
Energy: 1.790227223251174
Energy: 1.9055480252033354
Energy: 1.7902272686459175
Energy: 1.468587169856262
Energy: 1.7902271408375225
Energy: 1.5081651888741003
Energy: 1.8888610012484786
Energy: 1.5389107446153365
Energy: 1.8986462652935978
Energy: 1.5081652653551687
Energy: 1.8947647255353477
Energy: 1.435634158860734
Energy: 1.5192916723988066
Energy: 1.70444108228378
Energy: 1.5192963962370143
Energy: 1.435634158860734
Energy: 1.519297722207295
Energy: 1.766893537054053
Energy: 1.5138347504119127
Energy: 1.4383863967047739
Energy: 1.5256728615323198
Energy: 1.7668935138618682
Energy: 1.5256737402884806
Energy: 1.9217384540892901
Energy: 1.9645582688573076
Energy: 1.4470271060010285
Energy: 1.9645437394181977
Energy: 1.9217384537279707
Energy: 1.9645294511754712
Energy: 1.7678795538877599
Energy: 1.4787203824993402
Energy: 1.43258613690105
Energy: 1.4827726501133722
Energy: 1.7678793863476516
Energy: 1.4927072856503034

minimum gb energy = 1.432193097936802 eV
minimum distance =  2.21568043646093 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 1.6806755215105413
Energy: 2.0656223007192738
Energy: 1.8429195721073095
Energy: 2.0656199176490473
Energy: 1.6806755215093407
Energy: 2.065635587586158
Energy: 1.838826577072024
Energy: 1.6008199269076877
Energy: 1.4468192452978368
Energy: 1.6008199266124488
Energy: 1.8417295655707802
Energy: 1.6008199270372976
Energy: 1.4092464970432945
Energy: 1.5333873433690213
Energy: 1.7189230936039503
Energy: 1.533387346449597
Energy: 1.409246497037292
Energy: 1.5333873436642051
Energy: 1.8473641926075939
Energy: 1.925485328950714
Energy: 1.580750307410906
Energy: 1.925485071679155
Energy: 1.8473641926087947
Energy: 1.925485086526375
Energy: 1.5771658992025115
Energy: 1.9163748144000023
Energy: 1.8859966320342751
Energy: 1.9163067419200845
Energy: 1.5771658992181192
Energy: 1.9166344058287155
Energy: 1.6157640444684502
Energy: 1.6695698429335413
Energy: 1.4230018956763475
Energy: 1.6695701072230982
Energy: 1.6157640444780552
Energy: 1.6695699500275545
Energy: 1.4275316974391172
Energy: 1.6109003915990117
Energy: 1.4340115466417154
Energy: 1.610900397562119
Energy: 1.4275316969039225
Energy: 1.610900405308554
Energy: 1.5500545176523042
Energy: 1.7742563229177333
Energy: 1.9158464846566254
Energy: 1.7740679769748235
Energy: 1.550054517667912
Energy: 1.7740735771294376
Energy: 1.5343345810064521
Energy: 1.6671965640002662
Energy: 1.9088102296447327
Energy: 1.6671965658399674
Energy: 1.5343345810004492
Energy: 1.6671965611392907
Energy: 1.5440319124668132
Energy: 1.6723274748807189
Energy: 1.4109603411527434
Energy: 1.6723275316678448
Energy: 1.5440319124692143
Energy: 1.6723275027186497
Energy: 1.5837170779700247
Energy: 1.6589675149859675
Energy: 1.430607582293943
Energy: 1.650047537896096
Energy: 1.5837170779712253
Energy: 1.656445933862296
Energy: 1.5971839443612164
Energy: 1.7021179201512053
Energy: 1.584752872608547
Energy: 1.702441439912875
Energy: 1.5971839443612164
Energy: 1.702541140173901
Energy: 1.429169196485504
Energy: 1.665281571276247
Energy: 1.5827516722527109
Energy: 1.6652523136454356
Energy: 1.429169196485504
Energy: 1.6652551530459405
Energy: 1.4131289804196299
Energy: 1.7762698085963105
Energy: 1.5344989232490407
Energy: 1.7762700922957495
Energy: 1.4131289804196299
Energy: 1.7762698619980717
Energy: 1.9804229036438492
Energy: 1.9269301372417245
Energy: 1.5346254477997825
Energy: 1.9269301376113455
Energy: 1.9804229036246397
Energy: 1.9269301366812626
Energy: 2.1238860889655755
Energy: 1.8752512168942834
Energy: 1.5606138185408664
Energy: 1.8752512511982096
Energy: 2.1238860889619735
Energy: 1.8752512276385076
Energy: 1.4350513051878846
Energy: 1.6060992359527018
Energy: 1.425856376617097
Energy: 1.6060992332621569
Energy: 1.4350513051866838
Energy: 1.6060992590155734
Energy: 1.4192592704272549
Energy: 1.773854532571063
Energy: 1.6254674719571032
Energy: 1.7738545303989592
Energy: 1.419259270456069
Energy: 1.7738545330594888
Energy: 2.0203991141490003
Energy: 2.0503524102746495
Energy: 1.5776373868543223
Energy: 2.050352409776619
Energy: 2.0203991141490003
Energy: 2.0503524092821896
Energy: 1.5860879578673852
Energy: 2.081574425771689
Energy: 1.7671309872230465
Energy: 2.081574425756136
Energy: 1.5860879578446285
Energy: 2.081574425714115
Energy: 1.9070133837882215
Energy: 1.629016880005827
Energy: 1.4120862510530396
Energy: 1.6290168934741582
Energy: 1.9070133837582612
Energy: 1.6290168827023745
Energy: 1.444915257801313
Energy: 1.6007891738302222
Energy: 2.0280477781417217
Energy: 1.600789173575804
Energy: 1.4449152578025137
Energy: 1.6007891735866093
Energy: 1.7904675149330043
Energy: 2.0061558772677435
Energy: 1.513620553504743
Energy: 2.0061559718750255
Energy: 1.7904674865105994
Energy: 2.0061559775549545

minimum gb energy = 1.409246497037292 eV
minimum distance =  2.21719632575162 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 1.773227678621266
Energy: 2.0681817079354206
Energy: 1.9149878256864632
Energy: 2.0663038622864236
Energy: 1.7732276786509351
Energy: 2.068115813993881
Energy: 2.040447001763296
Energy: 1.7292779930427014
Energy: 1.360158894922783
Energy: 1.7292779614974711
Energy: 2.0404470017678658
Energy: 1.7292779622405177
Energy: 1.3677390046325355
Energy: 1.4127876586856003
Energy: 1.84821994856298
Energy: 1.4127880518739286
Energy: 1.3677390046378668
Energy: 1.41278845373956
Energy: 1.399671240651988
Energy: 1.72427097382185
Energy: 1.4021506800993708
Energy: 1.724270926092928
Energy: 1.399671241605143
Energy: 1.7242709794097777
Energy: 1.684222955105266
Energy: 1.7568907055288114
Energy: 1.6461943919020168
Energy: 1.7568893762001803
Energy: 1.6842229551075512
Energy: 1.7568840561693795
Energy: 1.6987539013566497
Energy: 1.6036694922174959
Energy: 1.366322075393408
Energy: 1.606818162694218
Energy: 1.6987539014731454
Energy: 1.6030462658867297
Energy: 1.3568029670742345
Energy: 1.3855635315831305
Energy: 1.3507700682357986
Energy: 1.3905616708066897
Energy: 1.3568029670757578
Energy: 1.3857956191531942
Energy: 1.3450494218339932
Energy: 1.6504234455819793
Energy: 1.6750436909425774
Energy: 1.65042347512573
Energy: 1.3450494213993058
Energy: 1.6504234412014551
Energy: 1.6350058959015847
Energy: 1.6425512970294238
Energy: 1.674690004271014
Energy: 1.6425493286850228
Energy: 1.6350058954722289
Energy: 1.6425507775940156
Energy: 1.3980673107289772
Energy: 1.6229629211645091
Energy: 1.3722585711024213
Energy: 1.6229629235565015
Energy: 1.398067310740402
Energy: 1.6229629221397168
Energy: 1.3627129010641439
Energy: 1.6678648272580694
Energy: 1.3436956417632693
Energy: 1.6678648275070214
Energy: 1.3627129010649055
Energy: 1.667864826756358
Energy: 1.3584591613738133
Energy: 1.4833638746715674
Energy: 1.9655668579487298
Energy: 1.4833541617524544
Energy: 1.358459161396628
Energy: 1.4841762828398573
Energy: 1.599048071299027
Energy: 1.7949042981774745
Energy: 1.7699091381208925
Energy: 1.7949043593280787
Energy: 1.5990479901582044
Energy: 1.7949042808883697
Energy: 1.3616972099092541
Energy: 1.7246292129005993
Energy: 1.3680167829581928
Energy: 1.724629215767646
Energy: 1.3616972099084925
Energy: 1.7246292081165804
Energy: 1.6541350623266269
Energy: 1.4186818953897367
Energy: 1.3505386603448533
Energy: 1.4186962599872603
Energy: 1.6541350623220572
Energy: 1.4188854348695439
Energy: 1.4039081277673053
Energy: 1.7349423109272146
Energy: 1.9877769020246931
Energy: 1.7349423115811842
Energy: 1.4039081277673053
Energy: 1.7349423130702895
Energy: 1.9535985454239926
Energy: 2.0434886012188933
Energy: 1.7118027310564439
Energy: 2.0434883881304104
Energy: 1.9535985454186608
Energy: 2.0434885002941874
Energy: 1.3593630423506196
Energy: 1.4042437667268777
Energy: 1.875628955689731
Energy: 1.4042438189703028
Energy: 1.3593630421130927
Energy: 1.404243818742677
Energy: 1.7046196419406308
Energy: 1.4285798422240283
Energy: 1.3581046578773284
Energy: 1.4285768753843635
Energy: 1.7046196420669932
Energy: 1.4285725359461185
Energy: 1.7077409674749449
Energy: 1.7593965684659272
Energy: 1.3726733835735114
Energy: 1.7505960567328103
Energy: 1.7077409674772297
Energy: 1.7595084456071215
Energy: 1.9576721210626122
Energy: 1.6227715640115745
Energy: 1.397284206852037
Energy: 1.6227771557516832
Energy: 1.9576721215589923
Energy: 1.6228055707363476
Energy: 1.3596859548427749
Energy: 1.637809938211227
Energy: 1.64268530365431
Energy: 1.6378099397010943
Energy: 1.3596859548412517
Energy: 1.6378099396500645
Energy: 1.3674260415860242
Energy: 1.6601888409747834
Energy: 1.3499983509789442
Energy: 1.6601888400216287
Energy: 1.3674260282777568
Energy: 1.6601888434254217
Energy: 1.76464977239555
Energy: 1.8256068023989938
Energy: 1.3541583747862556
Energy: 1.8256067454477134
Energy: 1.764649757681888
Energy: 1.8256068051975276
Energy: 1.96396663140951
Energy: 1.487685269106951
Energy: 1.3652782638981136
Energy: 1.4876947156123537
Energy: 1.963966631412522
Energy: 1.4876882951300139
Energy: 1.3577056481714145
Energy: 1.6462349700549401
Energy: 1.3577286414302099
Energy: 1.6462349701105399
Energy: 1.357705648185124
Energy: 1.646234969755755
Energy: 1.3640262230174542
Energy: 1.6405966328985349
Energy: 1.63079132364283
Energy: 1.6405964446695231
Energy: 1.3640262230311637
Energy: 1.6405966400753078
Energy: 1.6865599861229241
Energy: 1.6170152767153017
Energy: 1.4005317495396148
Energy: 1.6170156375476712
Energy: 1.6865599861229241
Energy: 1.617015719379749
Energy: 1.6801359335597528
Energy: 1.682704300555985
Energy: 1.3667265849017372
Energy: 1.6886702245453455
Energy: 1.6801359335521364
Energy: 1.68868263736741
Energy: 1.3522438762435194
Energy: 1.401336196151218
Energy: 1.3652858668506012
Energy: 1.401544286450924
Energy: 1.3522438762283213
Energy: 1.4011048334646434
Energy: 1.3560232077152992
Energy: 1.5992057884067885
Energy: 1.8973510832119989
Energy: 1.5992061529953816
Energy: 1.3560232077152992
Energy: 1.599205869320747
Energy: 1.656345831192813
Energy: 2.041941931316247
Energy: 1.7060664320244066
Energy: 2.041941883789089
Energy: 1.6563456863372985
Energy: 2.0419418441794317
Energy: 1.4018647165275868
Energy: 1.711679708362855
Energy: 1.6913625637445295
Energy: 1.7109248701050968
Energy: 1.4018647165230171
Energy: 1.7117022777977637
Energy: 2.0187409831826613
Energy: 1.4259654315625605
Energy: 1.3584850155487325
Energy: 1.4259595789684885
Energy: 2.0187409831826613
Energy: 1.4259201904136722
Energy: 1.3579046523337306
Energy: 1.7413988854679303
Energy: 1.7635042636134506
Energy: 1.7413989013577686
Energy: 1.3579046519173226
Energy: 1.7413989249915571
Energy: 1.6276024946001848
Energy: 1.8006631132887276
Energy: 1.7713399171234305
Energy: 1.7963176184147378
Energy: 1.6275945195336396
Energy: 1.802724559624014
Energy: 1.349674170697059
Energy: 1.879597484116745
Energy: 2.0031465115843843
Energy: 1.8795974872624468
Energy: 1.349674170592749
Energy: 1.8795974417420662

minimum gb energy = 1.3436956417632693 eV
minimum distance =  2.21407117166778 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 1.2725624364358934
Energy: 2.12895124408905
Energy: 1.8942574979722213
Energy: 2.1289512434030984
Energy: 1.2725624364358934
Energy: 2.1289512436379874
Energy: 1.8585906309256304
Energy: 1.2305055158829539
Energy: 1.1491699545861025
Energy: 1.2305055117902137
Energy: 1.8585906309276627
Energy: 1.2305054935486484
Energy: 1.2679497804518705
Energy: 1.3531710990445087
Energy: 1.5170392772471444
Energy: 1.3531711564027968
Energy: 1.2679497804518705
Energy: 1.3531710935071777
Energy: 1.875099488575727
Energy: 1.2018244683177939
Energy: 1.1490757480036895
Energy: 1.2042892505671297
Energy: 1.875099488608999
Energy: 1.2055780735253916
Energy: 1.2717081626305715
Energy: 1.6509907196772728
Energy: 1.1538944062623715
Energy: 1.6506518122103666
Energy: 1.2717081626284923
Energy: 1.650523326176753
Energy: 1.2828560098093749
Energy: 1.276474219268135
Energy: 1.149238407616184
Energy: 1.2764733355070927
Energy: 1.2828560098093749
Energy: 1.2764743966393446
Energy: 1.7979329823478725
Energy: 1.1933845264561689
Energy: 1.1552281315576052
Energy: 1.193389119302744
Energy: 1.7979329823956534
Energy: 1.1933695569271041
Energy: 1.2794781422851211
Energy: 1.1775492994770613
Energy: 1.1473373011125902
Energy: 1.1652242579603245
Energy: 1.2794781422975507
Energy: 1.177477224291694
Energy: 1.8023394612052939
Energy: 1.3030952141532905
Energy: 1.15357433903402
Energy: 1.303095220100094
Energy: 1.8023394612052939
Energy: 1.303095214174038
Energy: 1.2800589112192093
Energy: 1.679246590731983
Energy: 1.1669374233106264
Energy: 1.6792465380130601
Energy: 1.2800589112192093
Energy: 1.6792465156018133
Energy: 1.849907601234287
Energy: 1.2094720115123256
Energy: 1.151558550522043
Energy: 1.2094720144160642
Energy: 1.849907601234287
Energy: 1.2094720040896916
Energy: 1.2977737403200784
Energy: 1.3460198664741496
Energy: 1.9389235056687355
Energy: 1.3460183399589116
Energy: 1.2977737403200784
Energy: 1.3460189728024452
Energy: 1.8495431293322686
Energy: 1.2504495115967555
Energy: 1.1521386678409964
Energy: 1.2504495132076594
Energy: 1.849543129330189
Energy: 1.250449512114315
Energy: 1.2800369460002265
Energy: 1.651909993069182
Energy: 1.1622164846498146
Energy: 1.6529983780639395
Energy: 1.2800369460002265
Energy: 1.6519118517181817

minimum gb energy = 1.1473373011125902 eV
minimum distance =  2.21975285067633 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 2.050525668945893
Energy: 1.5352126093978828
Energy: 1.9738915578632186
Energy: 1.5351144528064011
Energy: 2.05052566894772
Energy: 1.5353060228138158
Energy: 1.7397280728408808
Energy: 1.9219498098863612
Energy: 1.4932898836018318
Energy: 1.921947072496411
Energy: 1.7397280728372269
Energy: 1.921949146593908
Energy: 1.4053984568041002
Energy: 1.5517899273894304
Energy: 1.4963975876520799
Energy: 1.55178992216825
Energy: 1.4053984568031868
Energy: 1.5517899257010799
Energy: 1.396519660891945
Energy: 1.5710491602801582
Energy: 1.4269069402751307
Energy: 1.5710491601851937
Energy: 1.396519659630935
Energy: 1.5710491603212458
Energy: 1.7556620305847923
Energy: 1.6769296377390581
Energy: 1.4544592359550421
Energy: 1.676930176209724
Energy: 1.7556620305847923
Energy: 1.6769307894899872
Energy: 1.5800391297138519
Energy: 1.850798338367865
Energy: 1.7438280643749344
Energy: 1.8507982698249497
Energy: 1.5800391297239007
Energy: 1.8507982203323448
Energy: 1.4595052135784854
Energy: 1.9945338449488763
Energy: 1.6114443883497958
Energy: 1.9945338401111878
Energy: 1.4595052137245659
Energy: 1.9945338361044491
Energy: 1.4386658354569402
Energy: 1.5592809754739965
Energy: 1.5921799914779828
Energy: 1.5592809723611991
Energy: 1.4386658354560267
Energy: 1.559280979837776
Energy: 1.756512387862268
Energy: 1.5577063536421938
Energy: 1.409475711789779
Energy: 1.5577071830839595
Energy: 1.7565123878558733
Energy: 1.5577057132981222
Energy: 1.560986141327683
Energy: 1.7451010055361718
Energy: 1.5816843329825074
Energy: 1.7451010061607493
Energy: 1.560986141663692
Energy: 1.7451010065004124
Energy: 1.631628939538081
Energy: 1.8767553590487598
Energy: 1.7469984848561408
Energy: 1.8767592570377412
Energy: 1.6316289395983525
Energy: 1.8768795915946968
Energy: 1.4911667814665939
Energy: 1.7407603546083463
Energy: 1.7345268559783276
Energy: 1.7407603545654315
Energy: 1.4911667814656804
Energy: 1.7407603546074328
Energy: 1.4884065056195572
Energy: 1.4536362039140658
Energy: 1.5761292434854446
Energy: 1.4536343863276524
Energy: 1.4884065056186437
Energy: 1.4536242548404286
Energy: 1.4577342309608337
Energy: 1.581100093970346
Energy: 1.416542533637958
Energy: 1.5811000937676274
Energy: 1.4577342301837608
Energy: 1.581100093764887
Energy: 1.4591579520916746
Energy: 1.8017120999307263
Energy: 1.6912423949006652
Energy: 1.801719326921734
Energy: 1.4591579520916746
Energy: 1.8017087047124158
Energy: 1.7890733005060684
Energy: 1.9736280645425148
Energy: 1.640459515023861
Energy: 1.973628064562612
Energy: 1.7890732710234467
Energy: 1.9736280645333795
Energy: 1.6152574190901188
Energy: 1.8805616069819702
Energy: 1.73588838848642
Energy: 1.8805552218748245
Energy: 1.615257419066367
Energy: 1.880533012655269
Energy: 1.7236469087956763
Energy: 1.682338452649021
Energy: 1.4519303898627582
Energy: 1.682325870256818
Energy: 1.7236469074871839
Energy: 1.682330399523542
Energy: 1.4005348421571269
Energy: 1.5619953859732738
Energy: 1.4570129402802625
Energy: 1.561995372920303
Energy: 1.4005348421461647
Energy: 1.5619953322611633
Energy: 1.4091438009857535
Energy: 1.580518963398969
Energy: 1.4887679824269127
Energy: 1.5826799133460077
Energy: 1.409143800791257
Energy: 1.580502835089916
Energy: 1.8336536193436423
Energy: 1.778519434719299
Energy: 1.4891851749880802
Energy: 1.7785081426494875
Energy: 1.8336536250332505
Energy: 1.7785112816425217
Energy: 1.8445423023884708
Energy: 1.869323095910353
Energy: 1.7061045550350178
Energy: 1.8693242948546827
Energy: 1.8444907156889458
Energy: 1.8693251949669094
Energy: 1.6240872748025394
Energy: 1.7360277523102716
Energy: 1.5591048093466267
Energy: 1.736027744887551
Energy: 1.6240872754727724
Energy: 1.7360277399147446
Energy: 1.4045639149530407
Energy: 1.4796531265667796
Energy: 1.699628628180499
Energy: 1.4796538643008486
Energy: 1.4045640362711898
Energy: 1.4796531318263277
Energy: 1.587186301422072
Energy: 1.562034643665159
Energy: 1.4390688520574086
Energy: 1.5620345455957945
Energy: 1.5871863014111098
Energy: 1.5620345927481072
Energy: 1.6092980750002552
Energy: 1.7354128930179338
Energy: 1.459299450245692
Energy: 1.7354134078663517
Energy: 1.6092980749993415
Energy: 1.7354129865536874
Energy: 1.7566153763789984
Energy: 1.694104405935953
Energy: 1.7529778784923038
Energy: 1.689326903756725
Energy: 1.7566153763799117
Energy: 1.6917404790227653
Energy: 1.45448516682846
Energy: 1.745282436501306
Energy: 1.5896461682744412
Energy: 1.7452830849355698
Energy: 1.45448516682846
Energy: 1.7452819970405153
Energy: 1.4427633343028305
Energy: 1.5638715655219397
Energy: 1.3998628372007695
Energy: 1.5638721616557507
Energy: 1.4427633343101385
Energy: 1.5638718717539253
Energy: 1.4997169910481418
Energy: 1.6182100324268243
Energy: 1.4021018365617977
Energy: 1.6182100322378088
Energy: 1.499716991081008
Energy: 1.6182100325537414
Energy: 1.5091884278311756
Energy: 1.931305298621995
Energy: 1.8509384189209792
Energy: 1.9313052989251591
Energy: 1.5091884278531003
Energy: 1.9313052977344487

minimum gb energy = 1.396519659630935 eV
minimum distance =  2.21433904655452 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.537148359007868
Energy: 1.6114380491767122
Energy: 1.575047388051171
Energy: 1.6114380491961824
Energy: 1.5371482052681333
Energy: 1.6114380491832145
Energy: 1.5098655664207417
Energy: 1.563959822006675
Energy: 1.4476187957769815
Energy: 1.5639599232475991
Energy: 1.5098655664256182
Energy: 1.563960057473981
Energy: 1.536280585107889
Energy: 1.554713503215063
Energy: 1.4464797330382282
Energy: 1.5547135184257317
Energy: 1.5362805851095147
Energy: 1.5547134831069176
Energy: 1.4573167584625073
Energy: 1.8495289291664219
Energy: 1.460381121046708
Energy: 1.8495289488602185
Energy: 1.4573167590198735
Energy: 1.8495289466860991
Energy: 1.4454397647680777
Energy: 1.5597870830115783
Energy: 1.4910788988600299
Energy: 1.5597870829254574
Energy: 1.4454397647680777
Energy: 1.559787082948179
Energy: 1.4480162567193209
Energy: 1.5487418793467276
Energy: 1.5498769897948672
Energy: 1.5487418759961769
Energy: 1.4480162558548975
Energy: 1.5487418771206256
Energy: 1.575047515581328
Energy: 1.6114380492368232
Energy: 1.5375324209357981
Energy: 1.6114380492433256
Energy: 1.5750475146405005
Energy: 1.611438049262833
Energy: 1.447618795851723
Energy: 1.7099019868850567
Energy: 1.5098656872189469
Energy: 1.7099019868753031
Energy: 1.4476187958533488
Energy: 1.7099019868720517
Energy: 1.446479733054484
Energy: 1.554713494339842
Energy: 1.53628058511114
Energy: 1.5547134692335431
Energy: 1.446479733054484
Energy: 1.5547134743584954
Energy: 1.4603810930220884
Energy: 1.7137742546876378
Energy: 1.4573152460135905
Energy: 1.7137135574582778
Energy: 1.4603811309488401
Energy: 1.713807813907318
Energy: 1.4910790823468023
Energy: 1.5597870828718121
Energy: 1.4454397649549504
Energy: 1.5597870828848168
Energy: 1.4910790796169797
Energy: 1.559787082892945
Energy: 1.549876988873547
Energy: 1.5487418721630384
Energy: 1.4480162570703072
Energy: 1.5487418797529477
Energy: 1.5498769888751727
Energy: 1.548741871482236
Energy: 1.5371498054940342
Energy: 1.611438049194557
Energy: 1.697849212265034
Energy: 1.6114380491978082
Energy: 1.5371497885365997
Energy: 1.611438049202685
Energy: 1.5098656804431037
Energy: 1.536702618436261
Energy: 1.4476187958679794
Energy: 1.536702619299096
Energy: 1.509865680483744
Energy: 1.5367026255370806
Energy: 1.5362805851095147
Energy: 1.5547135204194809
Energy: 1.4464797330154693
Energy: 1.5547134866134544
Energy: 1.53628058511114
Energy: 1.5547134749678073
Energy: 1.457314603772498
Energy: 1.7137093923984856
Energy: 1.4603811144382666
Energy: 1.7137319519173397
Energy: 1.4573146035450222
Energy: 1.713705767402948
Energy: 1.4454397648265631
Energy: 1.55978708293196
Energy: 1.491078974539703
Energy: 1.5597870828669351
Energy: 1.4454397648265631
Energy: 1.5597870829449278

minimum gb energy = 1.4454397647680777 eV
minimum distance =  2.21924446558787 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 1.667741587504157
Energy: 1.6809559918245622
Energy: 1.5873237352957077
Energy: 1.680955991334995
Energy: 1.6677415892036909
Energy: 1.6809559905416234
Energy: 1.568955829275614
Energy: 1.6487051766735357
Energy: 1.4963402405869701
Energy: 1.6672842633855258
Energy: 1.568955829258359
Energy: 1.6489235159990487
Energy: 1.4915016551778815
Energy: 1.6549484603603888
Energy: 1.4884429304104156
Energy: 1.6549484559171777
Energy: 1.491501655171245
Energy: 1.6549484680407966
Energy: 1.471700665918853
Energy: 1.5745682529909328
Energy: 1.5868427691642
Energy: 1.5745731799608342
Energy: 1.4717006670717752
Energy: 1.5745697167455808
Energy: 1.5997333501528823
Energy: 1.637835567077679
Energy: 1.4946058826800117
Energy: 1.6378355670936064
Energy: 1.5997333433043381
Energy: 1.637835567082988
Energy: 1.4787556488850113
Energy: 1.578743867682982
Energy: 1.7638040522176235
Energy: 1.578743867684279
Energy: 1.4787556186861004
Energy: 1.5787438676816545
Energy: 1.4824100917985052
Energy: 1.6961421799522007
Energy: 1.4990576893509175
Energy: 1.6961421798128933
Energy: 1.4824100916286995
Energy: 1.6961421798526826
Energy: 1.5845849627620672
Energy: 1.7332021985274455
Energy: 1.5010343213087816
Energy: 1.732843045265853
Energy: 1.5845849626413422
Energy: 1.7338459369727175
Energy: 1.6343597666003788
Energy: 1.7904573236519483
Energy: 1.5197783075134175
Energy: 1.7904573241043509
Energy: 1.6343597642030097
Energy: 1.790457323548448
Energy: 1.6671420216476427
Energy: 1.6715390615216763
Energy: 1.5544452390279124
Energy: 1.6715390615084031
Energy: 1.6671420216436608
Energy: 1.6715390615030938
Energy: 1.4597032822855331
Energy: 1.5863204551055468
Energy: 1.4977797409308962
Energy: 1.5863204547831604
Energy: 1.4597032822868603
Energy: 1.5863204561868243
Energy: 1.4524516906340312
Energy: 1.5855145291027577
Energy: 1.5409133598652252
Energy: 1.5875989967674493
Energy: 1.4524516906340312
Energy: 1.5856832476381255
Energy: 1.462548332868525
Energy: 1.6319731640966288
Energy: 1.5624907920159592
Energy: 1.63197313161311
Energy: 1.4625483328671975
Energy: 1.6319731219916878
Energy: 1.4538780200305903
Energy: 1.5855532060930981
Energy: 1.4849573069812811
Energy: 1.5855532061063713
Energy: 1.4538780200305903
Energy: 1.585553206105044
Energy: 1.6878946680905487
Energy: 1.6683896771502007
Energy: 1.6253227667385801
Energy: 1.6683896771661286
Energy: 1.6878946680905487
Energy: 1.6683896771117388
Energy: 1.6207110531738742
Energy: 1.6593691382832174
Energy: 1.505513587318406
Energy: 1.6593694121495444
Energy: 1.620711053176529
Energy: 1.6593675674287482
Energy: 1.617840276988454
Energy: 1.6729111832811883
Energy: 1.5187246402518426
Energy: 1.672911194178913
Energy: 1.617840276989781
Energy: 1.672911140523541
Energy: 1.5709421446917469
Energy: 1.700149855812606
Energy: 1.559469046741906
Energy: 1.7001498553256933
Energy: 1.5709421449557615
Energy: 1.7001498664821233
Energy: 1.461039752342161
Energy: 1.580737458176959
Energy: 1.7852991863771843
Energy: 1.5807374582074571
Energy: 1.4610397523142873
Energy: 1.5807374581756317
Energy: 1.4675174808217266
Energy: 1.6205508734816012
Energy: 1.5516513950788235
Energy: 1.6205508734789464
Energy: 1.467517480819072
Energy: 1.6205508734789464
Energy: 1.4614293307437602
Energy: 1.5822198739791185
Energy: 1.5361497574644254
Energy: 1.5822198740056648
Energy: 1.4614293308008046
Energy: 1.5822198739910642

minimum gb energy = 1.4524516906340312 eV
minimum distance =  2.22765875750046 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.7369854009580983
Energy: 1.7309714178139095
Energy: 1.5261184339344418
Energy: 1.7309714177904139
Energy: 1.7369854008820436
Energy: 1.7309714176047648
Energy: 1.4640821899335619
Energy: 1.625029294572747
Energy: 1.5005406752401012
Energy: 1.619064462883641
Energy: 1.4640821899302057
Energy: 1.6273111178806547
Energy: 1.4891268425444208
Energy: 1.6868498960484322
Energy: 1.5006705293713878
Energy: 1.6868498960786151
Energy: 1.4891268444701788
Energy: 1.6868498973378567
Energy: 1.5354395915871513
Energy: 1.5801304984606566
Energy: 1.6533049800531545
Energy: 1.5801304984818887
Energy: 1.5354395915849135
Energy: 1.5801304984684885
Energy: 1.4902258813900764
Energy: 1.6625867302580029
Energy: 1.5064864874485815
Energy: 1.6625867300801855
Energy: 1.4902258813453488
Energy: 1.6625867300086314
Energy: 1.477785724285723
Energy: 1.6260468975827331
Energy: 1.4719338890921236
Energy: 1.626046897527936
Energy: 1.477757831703615
Energy: 1.6260468975872087
Energy: 1.5284659484921408
Energy: 1.5919544758322597
Energy: 1.4999793845053997
Energy: 1.591954475880344
Energy: 1.5284659484921408
Energy: 1.5919544758344977
Energy: 1.4917481151790917
Energy: 1.626151929630373
Energy: 1.5068219591062506
Energy: 1.628548403625409
Energy: 1.4917481151790917
Energy: 1.6252726788249454
Energy: 1.5492074090975414
Energy: 1.6022075054177665
Energy: 1.5251699382459523
Energy: 1.6022075054311924
Energy: 1.5492074089241992
Energy: 1.6022075054278357
Energy: 1.5643632039470912
Energy: 1.749656113749667
Energy: 1.60898858920298
Energy: 1.749657998903623
Energy: 1.5643632039470912
Energy: 1.7496523337044123
Energy: 1.4939379227721938
Energy: 1.7509282112365212
Energy: 1.6104323689487745
Energy: 1.7509282151708052
Energy: 1.4939379227118024
Energy: 1.750928212158029
Energy: 1.547348455648524
Energy: 1.604484190876944
Energy: 1.5189190130512138
Energy: 1.6044841908478542
Energy: 1.547348455695489
Energy: 1.6044841907371414
Energy: 1.4898003830187272
Energy: 1.627381824009575
Energy: 1.5083938912927874
Energy: 1.6274315694105819
Energy: 1.489800383020965
Energy: 1.6287348344134758
Energy: 1.5205926079765713
Energy: 1.5907200327962734
Energy: 1.500328838147371
Energy: 1.5907200323768906
Energy: 1.5205926079709773
Energy: 1.5907200323366382
Energy: 1.5047158280001036
Energy: 1.6253768190319617
Energy: 1.4723642827941497
Energy: 1.6253768191113733
Energy: 1.5047158280001036
Energy: 1.6253768190140605
Energy: 1.490978784007475
Energy: 1.6625867303944493
Energy: 1.5041522499292428
Energy: 1.6625867304827857
Energy: 1.490978784007475
Energy: 1.6625867303284636
Energy: 1.52887737901144
Energy: 1.5799898548814506
Energy: 1.5365865300942534
Energy: 1.5799898548714069
Energy: 1.5288773790226284
Energy: 1.5799898548769755
Energy: 1.4903065598498986
Energy: 1.682939437523469
Energy: 1.4998515572140438
Energy: 1.682939435216343
Energy: 1.4903065307319037
Energy: 1.6829395362196025
Energy: 1.4638170153604022
Energy: 1.6249881671917672
Energy: 1.500090274558185
Energy: 1.6302070935993709
Energy: 1.4638170178240881
Energy: 1.625110613865824
Energy: 1.7369854005689243
Energy: 1.7309714172111155
Energy: 1.57722084626744
Energy: 1.7309714175410424
Energy: 1.7369854005476666
Energy: 1.7309714178317854
Energy: 1.4640821968224684
Energy: 1.6273230682117499
Energy: 1.5005406752524082
Energy: 1.6217633660443078
Energy: 1.4640821968146622
Energy: 1.62242342178706
Energy: 1.4891268398067237
Energy: 1.6868498970884849
Energy: 1.5006705294955014
Energy: 1.6868498977147492
Energy: 1.489126839309074
Energy: 1.6868498975291
Energy: 1.5354395924717374
Energy: 1.580130498471845
Energy: 1.4935230655981648
Energy: 1.5801304984684885
Energy: 1.5354395924695001
Energy: 1.580130498465132
Energy: 1.490225883539524
Energy: 1.6625867301607158
Energy: 1.5064864881631823
Energy: 1.662586730158478
Energy: 1.4902258835171476
Energy: 1.6625867303239883
Energy: 1.477640507107587
Energy: 1.6260468975189855
Energy: 1.4719338890954803
Energy: 1.626046897688971
Energy: 1.477670496147966
Energy: 1.6260468975256985

minimum gb energy = 1.4638170153604022 eV
minimum distance =  2.22635008286919 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.7508644879487194
Energy: 1.7184281523975138
Energy: 1.6239609782301099
Energy: 1.716482257270623
Energy: 1.7508644678041259
Energy: 1.7183185940522827
Energy: 1.5360193958877386
Energy: 1.7171394342900326
Energy: 1.4330291766127803
Energy: 1.7127262084723796
Energy: 1.5360193989787265
Energy: 1.71708606732646
Energy: 1.3937537961152784
Energy: 1.6621149899924754
Energy: 1.576829141873369
Energy: 1.662115010674757
Energy: 1.3937537959926705
Energy: 1.6621150162292728
Energy: 1.4891305730570878
Energy: 1.6150554180895549
Energy: 1.4556742236352245
Energy: 1.6150554101139831
Energy: 1.4891305729431719
Energy: 1.6150554151539889
Energy: 1.4498986616442813
Energy: 1.6474672563824608
Energy: 1.412627607949166
Energy: 1.6474670962568172
Energy: 1.4498986616442813
Energy: 1.6474670655833301
Energy: 1.4208755908488828
Energy: 1.6410299242260276
Energy: 1.4165562997696597
Energy: 1.6410299257840655
Energy: 1.4208756019608337
Energy: 1.6410299251102707
Energy: 1.4400387904300733
Energy: 1.5996156134336719
Energy: 1.4101473138761225
Energy: 1.599615610052121
Energy: 1.4400387904300733
Energy: 1.5996156116767746
Energy: 1.4227645695471767
Energy: 1.5730897914247948
Energy: 1.424398806875389
Energy: 1.5730897914247948
Energy: 1.4227645695346218
Energy: 1.5730897914247948
Energy: 1.481446435976922
Energy: 1.6345654481352991
Energy: 1.448829633593226
Energy: 1.6345654471641815
Energy: 1.4814464359798194
Energy: 1.6345654475503109
Energy: 1.4649516106340685
Energy: 1.7185057357699922
Energy: 1.4734766088966278
Energy: 1.7185057323546398
Energy: 1.4649516106369658
Energy: 1.718505738184288
Energy: 1.4215994236503469
Energy: 1.6506002321413875
Energy: 1.5121895598461879
Energy: 1.6506002321172435
Energy: 1.4215994236493812
Energy: 1.6506002320776694
Energy: 1.487462377019949
Energy: 1.7581077074044291
Energy: 1.4790570945968307
Energy: 1.758107708795478
Energy: 1.4874623765054393
Energy: 1.7581077001818006
Energy: 1.4862275558040594
Energy: 1.7639566703177236
Energy: 1.4708049686846567
Energy: 1.7639520788103655
Energy: 1.486227555969139
Energy: 1.7639455055486437
Energy: 1.4371517470887767
Energy: 1.704962859236179
Energy: 1.6610311112628433
Energy: 1.7049628587409622
Energy: 1.437151747083948
Energy: 1.7049628588664456
Energy: 1.477449942683844
Energy: 1.64477837052157
Energy: 1.4688968559284792
Energy: 1.6447783677723082
Energy: 1.47744994268481
Energy: 1.644778366133168
Energy: 1.4752669044944389
Energy: 1.6247478584066408
Energy: 1.4008751843562928
Energy: 1.6247478870567684
Energy: 1.4752669044944389
Energy: 1.6247479543733392
Energy: 1.4335482190144353
Energy: 1.5633684700095147
Energy: 1.4402421717112124
Energy: 1.5633684700017887
Energy: 1.4335482190134696
Energy: 1.5633684700037203
Energy: 1.436818425363936
Energy: 1.6302806933794642
Energy: 1.405948182785421
Energy: 1.6302806935638374
Energy: 1.436818425363936
Energy: 1.630280693022286
Energy: 1.4303712278356346
Energy: 1.560192420761605
Energy: 1.4655253163428117
Energy: 1.560192422130463
Energy: 1.4303712278346687
Energy: 1.5601924209730191
Energy: 1.4756155376368016
Energy: 1.6421680548617434
Energy: 1.4308167405661862
Energy: 1.642167833047421
Energy: 1.4756155376358358
Energy: 1.64216792433803
Energy: 1.4772224665654887
Energy: 1.6247469653940008
Energy: 1.4434356988663375
Energy: 1.624746963932495
Energy: 1.47722246656066
Energy: 1.624746968418395
Energy: 1.4179444786762743
Energy: 1.68814245033811
Energy: 1.648898751607916
Energy: 1.6881424498718662
Energy: 1.4179444783557948
Energy: 1.6881424384297565
Energy: 1.567370698172291
Energy: 1.638249854810799
Energy: 1.4717370197164017
Energy: 1.6806563778592156
Energy: 1.5673706981558946
Energy: 1.640760007903507
Energy: 1.5641525797470683
Energy: 1.5914152469834022
Energy: 1.4636600959240786
Energy: 1.588772557654597
Energy: 1.564152592701847
Energy: 1.5913175868454346
Energy: 1.5487771595723316
Energy: 1.6674100710992
Energy: 1.432576118792799
Energy: 1.6674100711262414
Energy: 1.5487771595732975
Energy: 1.6674100711677473
Energy: 1.4638069415851522
Energy: 1.7324719079613413
Energy: 1.4736329076708141
Energy: 1.7324719079816224
Energy: 1.4638069415861181
Energy: 1.732471907921767
Energy: 1.4844770631497222
Energy: 1.661378713568897
Energy: 1.4360106177820953
Energy: 1.6613787139
Energy: 1.4844770631159423
Energy: 1.6613787136866542
Energy: 1.429929299677058
Energy: 1.5759386113899412
Energy: 1.4187510945596156
Energy: 1.5759386122587542
Energy: 1.429929299677058
Energy: 1.575938611305964
Energy: 1.4398786555547747
Energy: 1.5945527431995017
Energy: 1.4112587383032076
Energy: 1.5945527430662922
Energy: 1.4398786555509338
Energy: 1.594552743690855

minimum gb energy = 1.3937537959926705 eV
minimum distance =  2.22321721149343 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.610575056688505
Energy: 1.7009057468817288
Energy: 1.5234505294433616
Energy: 1.7009058253130085
Energy: 1.610575054588274
Energy: 1.7009060856669966
Energy: 1.3904854974952552
Energy: 1.5322946103042552
Energy: 1.445302014035164
Energy: 1.5302174785695397
Energy: 1.3904854974944063
Energy: 1.5330922908131799
Energy: 1.3221844279609933
Energy: 1.6302578313038802
Energy: 1.460725102883502
Energy: 1.6302578312486986
Energy: 1.3221844277683583
Energy: 1.6302578320242935
Energy: 1.3878209626666558
Energy: 1.617430795621561
Energy: 1.3464240181362788
Energy: 1.6174308019502697
Energy: 1.3878209625597648
Energy: 1.6174307978041018
Energy: 1.3637057403454618
Energy: 1.6407876974919497
Energy: 1.3532598717555917
Energy: 1.640787698130053
Energy: 1.3637057403463109
Energy: 1.6407876988369219
Energy: 1.3272724775520222
Energy: 1.5521798126752546
Energy: 1.3687939335562025
Energy: 1.5521796849290237
Energy: 1.3272724775486262
Energy: 1.5521795878723452
Energy: 1.3527413495076976
Energy: 1.5801678713624516
Energy: 1.3515566132165564
Energy: 1.5801678691154288
Energy: 1.3527413495085467
Energy: 1.58016789304952
Energy: 1.3422840496748292
Energy: 1.5232944355301807
Energy: 1.341979985099819
Energy: 1.5195129979318456
Energy: 1.3422840496765271
Energy: 1.523509060522634
Energy: 1.3619671552720947
Energy: 1.5307020187838665
Energy: 1.324346628903934
Energy: 1.530702015640736
Energy: 1.3619671552729435
Energy: 1.5307020136949372
Energy: 1.3699139642619158
Energy: 1.5784207853496834
Energy: 1.3541413362330237
Energy: 1.5784207860777761
Energy: 1.3699139642534648
Energy: 1.5784207867328586
Energy: 1.3419318930164081
Energy: 1.5727687981298737
Energy: 1.4336209709435368
Energy: 1.572768798127327
Energy: 1.3419318925411878
Energy: 1.5727687981349674
Energy: 1.4465756290487937
Energy: 1.648572701915218
Energy: 1.3535000643382302
Energy: 1.648572664650876
Energy: 1.4465756290487937
Energy: 1.648572639493985
Energy: 1.4598052702088138
Energy: 1.614616020488752
Energy: 1.458135511258311
Energy: 1.6146160656711575
Energy: 1.4598052701884388
Energy: 1.614616053473718
Energy: 1.3462295573318777
Energy: 1.7287644371782485
Energy: 1.3947540768521047
Energy: 1.7285420898414963
Energy: 1.3462295572597553
Energy: 1.7277876981942684
Energy: 1.3660696539741823
Energy: 1.7451270299729658
Energy: 1.397863742706916
Energy: 1.7451178566969365
Energy: 1.3660696539716353
Energy: 1.745116898949644
Energy: 1.4552704091616109
Energy: 1.6016536225077496
Energy: 1.3239458353707731
Energy: 1.601653625521029
Energy: 1.4552704091607618
Energy: 1.6016536219604067
Energy: 1.349920322665386
Energy: 1.603270579015248
Energy: 1.382704132635198
Energy: 1.6032705802397458
Energy: 1.3499203226611411
Energy: 1.6032705780317749
Energy: 1.3417114478610077
Energy: 1.6257046345451243
Energy: 1.3694459374380494
Energy: 1.6257046345272963
Energy: 1.3417114497550207
Energy: 1.6257046345230515
Energy: 1.3839920938895058
Energy: 1.5586466873480198
Energy: 1.3289314122421383
Energy: 1.5586466873488687
Energy: 1.3839920938895058
Energy: 1.558646687381129
Energy: 1.3547654596201528
Energy: 1.614740277270964
Energy: 1.3694249712400544
Energy: 1.614740277269266
Energy: 1.3547654596150591
Energy: 1.614740277269266
Energy: 1.3606385621418096
Energy: 1.5519762850639158
Energy: 1.3328202096830082
Energy: 1.551976285040145
Energy: 1.360638561628425
Energy: 1.5519762834931994
Energy: 1.368788077610451
Energy: 1.5460044074648411
Energy: 1.371408454205699
Energy: 1.546004407291732
Energy: 1.3687880776257324
Energy: 1.5460044075285129
Energy: 1.3259491350752182
Energy: 1.5460994049072394
Energy: 1.36330270504045
Energy: 1.5460994112740738
Energy: 1.325949135077765
Energy: 1.5460994066103153
Energy: 1.3823552614973866
Energy: 1.5916215278584773
Energy: 1.3471581921002993
Energy: 1.5916215278746075
Energy: 1.3823552554063456
Energy: 1.5916215278661179
Energy: 1.362818839533528
Energy: 1.681234614935974
Energy: 1.3670415667418003
Energy: 1.6812346156538793
Energy: 1.3628188395343768
Energy: 1.681234615752319
Energy: 1.3723891557334813
Energy: 1.614033869588542
Energy: 1.4581022766867149
Energy: 1.6140338722089491
Energy: 1.3723891557165022
Energy: 1.6140338717719316
Energy: 1.390432185201951
Energy: 1.7244357979551312
Energy: 1.3353402861248844
Energy: 1.72443593067742
Energy: 1.3909858200761056
Energy: 1.7244358351855151
Energy: 1.4041824326111638
Energy: 1.5767761156602067
Energy: 1.3381801640941244
Energy: 1.5741920064845745
Energy: 1.4041824325067818
Energy: 1.5855873461919294
Energy: 1.4098795234358212
Energy: 1.6087445242059104
Energy: 1.5040470042931333
Energy: 1.6087445243714178
Energy: 1.409879604337321
Energy: 1.6087445244002432
Energy: 1.370009271460657
Energy: 1.4969097002994116
Energy: 1.3372958621685782
Energy: 1.497422592502545
Energy: 1.370009271461506
Energy: 1.498016331007585
Energy: 1.3803362124386271
Energy: 1.600154961337588
Energy: 1.35087067060061
Energy: 1.6001549613384367
Energy: 1.3803362123741454
Energy: 1.600154961331645
Energy: 1.3715192006663803
Energy: 1.5275068606321178
Energy: 1.3698826128727726
Energy: 1.5275068608323545
Energy: 1.3715192006646824
Energy: 1.5275068607542897
Energy: 1.3630245953955689
Energy: 1.593853995534796
Energy: 1.3326515528556189
Energy: 1.5938539955263065
Energy: 1.3630245953972666
Energy: 1.5938539954270174

minimum gb energy = 1.3221844277683583 eV
minimum distance =  2.22577506670438 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.015017448172857918
Energy: 0.015468252794376707
Energy: 1.6297746203151684
Energy: 0.015468252793005158
Energy: 0.015017448172857918
Energy: 0.015468252793671339
Energy: 0.015180108123247644
Energy: 0.8908941999045251
Energy: 0.015180108122542276
Energy: 0.8908941999045251
Energy: 0.015180108122542276
Energy: 0.8908941999052304
Energy: 1.6297742529744799
Energy: 0.015468252793671339
Energy: 0.015017448172857918
Energy: 0.015468252793671339
Energy: 1.6297743650203866
Energy: 0.015468252793671339
Energy: 0.015180108122542276
Energy: 0.8908941999045251
Energy: 0.015180108122542276
Energy: 0.8908941999045251
Energy: 0.015180108122542276
Energy: 0.8908941999045251

minimum gb energy = 0.015017448172857918 eV
minimum distance =  2.41258822354354 Angstroms
sigma value = 1