Model name: model_name=SNAP_ZuoChenLi_2019_Cu__MO_931672895580_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.633761629462242
cohesive_energy=1.552270683108943
mass=63.546
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: -2.5491213275734 eV

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

Energy: 0.00595978292238113
Energy: 0.9560541097410412
Energy: 0.00595978292238113
Energy: 0.9560541097407393
Energy: 0.00595978292238113
Energy: 0.9560541097410412
Energy: 0.9560541097410412
Energy: 0.9783894224622336
Energy: 0.9560541097410412
Energy: 0.9783894224625355
Energy: 0.9560541097410412
Energy: 1.051210662575624
Energy: 0.00595978292238113
Energy: 0.9560541097407393
Energy: 0.00595978292238113
Energy: 0.9560541097407393
Energy: 0.00595978292238113
Energy: 0.9560541097410412
Energy: 0.9560541097410412
Energy: 0.9783894224622336
Energy: 0.9560541097410412
Energy: 0.9783894224622336
Energy: 0.9560541097410412
Energy: 1.051210662575624
Energy: 0.00595978292238113
Energy: 0.9560541097410412
Energy: 0.00595978292238113
Energy: 0.9560541097410412
Energy: 0.00595978292238113
Energy: 0.9560541097410412
Energy: 0.9560541097410412
Energy: 1.051210662575624
Energy: 0.9560541097410412
Energy: 1.051210662575624
Energy: 0.9560541097410412
Energy: 1.051210662575624

minimum gb energy = 0.00595978292238113 eV
minimum distance =  2.30298653373386 Angstroms
sigma value = 1


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

Energy: 1.0206803869436438
Energy: 0.9428168500995914
Energy: 1.0206803869436438
Energy: 0.9428168500995914
Energy: 1.0206803869436438
Energy: 0.9428168500995914
Energy: 1.0805234636314445
Energy: 0.884434187418606
Energy: 1.080523213301145
Energy: 0.8844341874193533
Energy: 1.0805238413045475
Energy: 0.8844341874193533
Energy: 0.9756629998075281
Energy: 0.9787740438444017
Energy: 0.9756629998075281
Energy: 0.9787740438436545
Energy: 0.9756629998075281
Energy: 0.9787740438429074
Energy: 1.0703170836644493
Energy: 0.9237468136189751
Energy: 1.0703170836644493
Energy: 0.9237468136189751
Energy: 1.0703170836644493
Energy: 0.9237468136189751
Energy: 0.958792319785358
Energy: 1.0312449830837307
Energy: 0.958792319785358
Energy: 1.0312449830837307
Energy: 0.958792319785358
Energy: 1.0312449830837307
Energy: 0.9824297765453204
Energy: 0.9121866123792309
Energy: 0.9824297765453204
Energy: 0.9121866123792309
Energy: 0.9824297765453204
Energy: 0.9121866123792309
Energy: 0.9239918485147833
Energy: 0.9891590324947273
Energy: 0.9239918485147833
Energy: 0.9891590324947273
Energy: 0.9239918485147833
Energy: 0.9891590324947273
Energy: 0.924537489066523
Energy: 1.0657066325719957
Energy: 0.924537489066523
Energy: 1.0657066325719957
Energy: 0.924537489066523
Energy: 1.0657066325712485
Energy: 1.0071583896132748
Energy: 0.9904294988050809
Energy: 1.0071583896132748
Energy: 0.9904294988050809
Energy: 1.0071583896132748
Energy: 0.9904294988050809
Energy: 0.873253091147309
Energy: 1.0471581049382241
Energy: 0.8732530911465617
Energy: 1.0471581049240457
Energy: 0.8732530911465617
Energy: 1.0471581047769316
Energy: 0.9531622667802765
Energy: 0.9060491957735164
Energy: 0.9531622667802765
Energy: 0.9060491957735164
Energy: 0.9531622667802765
Energy: 0.9060491957735164
Energy: 0.8640118368426659
Energy: 1.0022641391185085
Energy: 0.8640118368426659
Energy: 1.002261490758828
Energy: 0.8640118368426659
Energy: 1.0022528452575183
Energy: 1.0870557568193568
Energy: 0.8562992520670926
Energy: 1.0870557568118857
Energy: 0.8562992520670926
Energy: 1.0870557567745467
Energy: 0.8562992520670926
Energy: 0.9207138985933632
Energy: 0.9181927613399912
Energy: 0.9207138985933632
Energy: 0.9181927613399912
Energy: 0.9207138985933632
Energy: 0.9181927613399912
Energy: 1.117013214387146
Energy: 0.8829881625306704
Energy: 1.1170132143759564
Energy: 0.8829881625299232
Energy: 1.1170132143610139
Energy: 0.8829881625306704
Energy: 1.1174719060781595
Energy: 1.00479650184464
Energy: 1.1174719060781595
Energy: 1.004796501843893
Energy: 1.1174719060781595
Energy: 1.0047965018423985
Energy: 0.975762801694077
Energy: 0.9711983641226719
Energy: 0.975762801694077
Energy: 0.9711983641226719
Energy: 0.975762801694077
Energy: 0.9711983641226719
Energy: 0.9756356240450952
Energy: 0.9386190835744894
Energy: 0.9756356240450952
Energy: 0.9386190835744894
Energy: 0.9756356240450952
Energy: 0.9386190835744894
Energy: 0.9278232223475391
Energy: 0.9239513668691183
Energy: 0.9278232223475391
Energy: 0.9239513668683712
Energy: 0.9278232223475391
Energy: 0.9239513668691183
Energy: 0.9935455754184304
Energy: 0.9119694486707685
Energy: 0.9935455754206716
Energy: 0.9119694486707685
Energy: 0.9935455754206716
Energy: 0.9119694486700214
Energy: 0.8964359333879628
Energy: 1.0480188033544096
Energy: 0.8964359333879628
Energy: 1.0480188033544096
Energy: 0.8964359333879628
Energy: 1.0480188033544096
Energy: 0.97979392421324
Energy: 0.9903249981683356
Energy: 0.97979392421324
Energy: 0.9903249981683356
Energy: 0.97979392421324
Energy: 0.9903249981683356
Energy: 0.8673708224067699
Energy: 1.1563137586035965
Energy: 0.8673708224067699
Energy: 1.1563137586035965
Energy: 0.8673708224067699
Energy: 1.1563137586035965

minimum gb energy = 0.8562992520670926 eV
minimum distance =  2.29543243964987 Angstroms
sigma value = 33


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

Energy: 1.1702990837966987
Energy: 1.037356514048966
Energy: 1.0899134526943042
Energy: 1.037356514048966
Energy: 1.1702990837966987
Energy: 1.037356514048966
Energy: 1.0748239298310385
Energy: 0.9323407887415592
Energy: 1.0748239298301885
Energy: 0.9323407887415592
Energy: 1.0748239298293385
Energy: 0.9323407887415592
Energy: 0.9260198217335104
Energy: 0.7831936160710199
Energy: 0.9260198217335104
Energy: 0.7831936243578593
Energy: 0.9260198217339353
Energy: 0.7831936404702076
Energy: 0.8791084500806102
Energy: 1.0468901923025538
Energy: 0.8791076260820783
Energy: 1.0468901923025538
Energy: 0.8791075189445912
Energy: 1.0468901923025538
Energy: 1.0066572379071959
Energy: 0.9009763672440438
Energy: 1.0066572379084708
Energy: 0.9009763687001631
Energy: 1.0066572379101706
Energy: 0.9009763729278791
Energy: 0.9051709190785842
Energy: 0.8966884427436688
Energy: 0.9051709191686366
Energy: 0.8964395863913953
Energy: 0.9051709192854616
Energy: 0.8966884427457935
Energy: 0.8623064358658834
Energy: 1.0862034718476725
Energy: 0.8621350462150722
Energy: 1.0481030832277454
Energy: 0.8623879889513356
Energy: 1.0862034718472475
Energy: 0.8306829694877604
Energy: 0.8972088651488808
Energy: 0.8306829694877604
Energy: 0.8972094318479313
Energy: 0.8306829694877604
Energy: 0.8972110819951483
Energy: 0.8580211978255129
Energy: 0.9273783531584908
Energy: 0.8580211978259381
Energy: 0.9273783531584908
Energy: 0.8580211978259381
Energy: 0.9273783531584908
Energy: 0.8695745063906735
Energy: 0.864560263915691
Energy: 0.8729835416595033
Energy: 0.8645570056305387
Energy: 0.8695745063910983
Energy: 0.864552462242094
Energy: 0.9247933534797376
Energy: 0.897509228737346
Energy: 0.9247933530570972
Energy: 0.897509228737346
Energy: 0.9247933527775907
Energy: 0.897509228737346
Energy: 0.9259547083987387
Energy: 0.9863912402239093
Energy: 0.9256821370509627
Energy: 0.9863912402239093
Energy: 0.9259547083987387
Energy: 0.9863912402239093
Energy: 0.8938741940303682
Energy: 0.9112552983301762
Energy: 0.8379864861938844
Energy: 0.9112552983301762
Energy: 0.8938687841239862
Energy: 0.9112552983301762
Energy: 1.0819610634335146
Energy: 0.8448289411247802
Energy: 1.0819617787734408
Energy: 0.8493520236322837
Energy: 1.0819610634335146
Energy: 0.8448283781505462
Energy: 0.9985140224725302
Energy: 0.9216731414540029
Energy: 0.9985140225417598
Energy: 0.9216731414557027
Energy: 0.9985140226093088
Energy: 0.9216731414582525
Energy: 0.9013701325613706
Energy: 0.8521490593926299
Energy: 0.9013701325826186
Energy: 0.8521490594049538
Energy: 0.901370132603847
Energy: 0.8521490594223576
Energy: 0.856801212419738
Energy: 0.8926189978782546
Energy: 0.8568012234259429
Energy: 0.8926189979020329
Energy: 0.8568012338463815
Energy: 0.8926189979283611
Energy: 0.983596991085347
Energy: 0.9003763609164291
Energy: 0.9835969910793977
Energy: 0.9001698279962485
Energy: 0.983596991074723
Energy: 0.9003763609185539
Energy: 0.9255631408124223
Energy: 0.9205896588805477
Energy: 0.9255631408119972
Energy: 0.8986399276917567
Energy: 0.9255631408124223
Energy: 0.9205896588805477
Energy: 1.0521985664840239
Energy: 1.044492611847484
Energy: 1.0260872712002798
Energy: 1.0831991256425062
Energy: 1.0521985664835989
Energy: 1.044492611847484
Energy: 0.8737537510493744
Energy: 0.8935430311705316
Energy: 0.8739636937759496
Energy: 0.8935319715915016
Energy: 0.8737537510493744
Energy: 0.893571704703815
Energy: 0.7787088173167467
Energy: 0.9281491352828235
Energy: 0.778708795244012
Energy: 0.9281491352828235
Energy: 0.7787087967319838
Energy: 0.9281491352828235
Energy: 0.8953565900910239
Energy: 0.8644644743680556
Energy: 0.8953476557686234
Energy: 0.8645051132729048
Energy: 0.8953565900910239
Energy: 0.8645340377829677
Energy: 0.9246235471909099
Energy: 1.0085389680026127
Energy: 0.9246235471909099
Energy: 1.0085389680026127
Energy: 0.9246235471900601
Energy: 1.0085389680026127
Energy: 0.9254130316424646
Energy: 0.8863463063223724
Energy: 0.92580143943312
Energy: 0.8863463063283219
Energy: 0.9254130316517943
Energy: 0.8863463063385016
Energy: 0.9080147419202526
Energy: 1.038015130066557
Energy: 0.7751359871889194
Energy: 1.038015130066557
Energy: 0.9080145165001698
Energy: 1.038015130066982
Energy: 0.8476649381943605
Energy: 0.7792061115059986
Energy: 0.7843531233225022
Energy: 0.7792060226467556
Energy: 0.8476658978600258
Energy: 0.7792059324664915
Energy: 0.9255035497084824
Energy: 0.9522806804971677
Energy: 0.9255035497161123
Energy: 0.9522806365904285
Energy: 0.925503549720787
Energy: 0.952280681847511
Energy: 0.8644792726240547
Energy: 0.9341940533264887
Energy: 0.8644830654200882
Energy: 0.9341940533264887
Energy: 0.8644874107941207
Energy: 0.9341940533264887
Energy: 0.8955981439571672
Energy: 0.9447185381242468
Energy: 0.8955981439571672
Energy: 0.9447185381293463
Energy: 0.8955981439575922
Energy: 0.9447185381442198
Energy: 0.9652275871934659
Energy: 0.9274507025535191
Energy: 0.9652275320757883
Energy: 0.9271163468781507
Energy: 0.9652274877956846
Energy: 0.9274507025535191
Energy: 0.9087689211964918
Energy: 0.8155126024016591
Energy: 0.9087689211964918
Energy: 0.7841638666987532
Energy: 0.9087689211964918
Energy: 0.815274433279247
Energy: 0.8833685801408475
Energy: 1.0831253759819617
Energy: 0.8833685829634395
Energy: 1.0445487107011873
Energy: 0.8833685850057305
Energy: 1.0831253759823867
Energy: 0.9342390962958066
Energy: 0.998483987202469
Energy: 0.9342390962958066
Energy: 0.9984839872016191
Energy: 0.9342390962958066
Energy: 0.9984839872011942
Energy: 0.8392485187489244
Energy: 0.9007465842593091
Energy: 0.8392485187973503
Energy: 0.900746584233406
Energy: 0.839248518837702
Energy: 0.9007465842057838
Energy: 0.7642191915441605
Energy: 1.1020799876777347
Energy: 0.7642191853132109
Energy: 1.1020799876777347
Energy: 0.764219180223216
Energy: 1.1020799876777347
Energy: 0.8954541189776103
Energy: 0.9834575208450422
Energy: 0.8956086602435159
Energy: 0.9834575208492918
Energy: 0.8954541189771853
Energy: 0.9834575208552413
Energy: 0.8995678989011106
Energy: 0.9051764739477705
Energy: 0.8999724569836739
Energy: 0.9051764739464955
Energy: 0.8995678989006854
Energy: 0.9051764739456455
Energy: 1.0820296832433032
Energy: 1.0257784175092521
Energy: 1.0820295421115165
Energy: 1.0262647694239129
Energy: 1.0820296832433032
Energy: 1.02577841681263
Energy: 0.8691667558943764
Energy: 0.8732443094900076
Energy: 0.8691594912590223
Energy: 0.8731248197156739
Energy: 0.8691534897565829
Energy: 0.8732443094900076
Energy: 0.9259713314502144
Energy: 0.856823765977586
Energy: 0.9259713314506393
Energy: 0.856823765977161
Energy: 0.9259713314506393
Energy: 0.856823765977586

minimum gb energy = 0.764219180223216 eV
minimum distance =  2.37274155337785 Angstroms
sigma value = 51


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

Energy: 0.9975797682416728
Energy: 0.9914395170737458
Energy: 0.9975797682416728
Energy: 0.9914395170737458
Energy: 0.9975797682416728
Energy: 0.9914395170737458
Energy: 1.0489924301976485
Energy: 0.9254810452044615
Energy: 1.0489924301976485
Energy: 0.9254810452044615
Energy: 1.0489924301976485
Energy: 0.9254810452044615
Energy: 0.9394793369576917
Energy: 0.9615455658273764
Energy: 0.9394793369576917
Energy: 0.9615455658273764
Energy: 0.9394793369576917
Energy: 0.9615455658273764
Energy: 0.9659499913789702
Energy: 0.8622387338680086
Energy: 0.9659499913789702
Energy: 0.8622387338680086
Energy: 0.9659499913789702
Energy: 0.8622387338680086
Energy: 0.9956402063578214
Energy: 0.957922368083157
Energy: 0.9956402063578214
Energy: 0.957922368083157
Energy: 0.9956402063578214
Energy: 0.957922368083157
Energy: 0.9938561677783206
Energy: 0.9576131048360496
Energy: 0.9938561677783206
Energy: 0.9576131048360496
Energy: 0.9938561677783206
Energy: 0.9576131048360496
Energy: 0.9209066464112724
Energy: 0.9580013431509932
Energy: 0.9209066464112724
Energy: 0.9580013431509932
Energy: 0.9209066464112724
Energy: 0.9580013431509932
Energy: 0.9052138942812152
Energy: 0.9582071061021015
Energy: 0.9052138942812152
Energy: 0.9582071061021015
Energy: 0.9052138942812152
Energy: 0.9582071061021015
Energy: 1.129997596397329
Energy: 0.8587919295870069
Energy: 1.1299975963963445
Energy: 0.8587919295870069
Energy: 1.129997596397329
Energy: 0.8587919295870069
Energy: 0.8855998769058322
Energy: 1.1283212641131153
Energy: 0.8855998769058322
Energy: 1.1283212641131153
Energy: 0.8855998769058322
Energy: 1.1283212641131153
Energy: 1.1114456899353815
Energy: 0.8592023091593958
Energy: 1.1114456899353815
Energy: 0.8592023091593958
Energy: 1.1114456899353815
Energy: 0.8592023091593958
Energy: 0.9964636963007727
Energy: 0.9936492055754331
Energy: 0.9964636963007727
Energy: 0.9936492055754331
Energy: 0.9964636963007727
Energy: 0.9936492055754331
Energy: 1.1405955992070405
Energy: 0.926211074496456
Energy: 1.1405954898011335
Energy: 0.926211074496456
Energy: 1.1405951920635815
Energy: 0.9262110744954714
Energy: 0.9392720051323997
Energy: 0.924584044490056
Energy: 0.9392720051323997
Energy: 0.9245840444910295
Energy: 0.9392720051323997
Energy: 0.924584044490056
Energy: 0.9661443300943813
Energy: 0.9843727707828389
Energy: 0.9661443300943813
Energy: 0.9843727707818543
Energy: 0.9661443300943813
Energy: 0.9843727707828389
Energy: 0.99356049602062
Energy: 0.9574879356552636
Energy: 0.99356049602062
Energy: 0.9574879356552636
Energy: 0.99356049602062
Energy: 0.9574879356552636
Energy: 0.9936831090826133
Energy: 1.0400907196559335
Energy: 0.9936831090826133
Energy: 1.040090719656918
Energy: 0.9936831090826133
Energy: 1.040090719656918
Energy: 0.946381238456668
Energy: 0.9591555496567651
Energy: 0.946381238456668
Energy: 0.9591555496567651
Energy: 0.946381238456668
Energy: 0.9591555496567651

minimum gb energy = 0.8587919295870069 eV
minimum distance =  2.27608587422321 Angstroms
sigma value = 19


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

Energy: 0.8203941246509449
Energy: 0.8147609060034644
Energy: 0.8203941246509449
Energy: 0.8147609060034644
Energy: 0.8203941246509449
Energy: 0.8147609060034644
Energy: 0.9503678218017921
Energy: 0.9896160883518874
Energy: 0.9503678218017921
Energy: 0.9896160883518874
Energy: 0.9503678218017921
Energy: 0.9896160883518874
Energy: 0.7651130797953406
Energy: 0.9873970443507183
Energy: 0.7651130797953406
Energy: 0.9873970443507183
Energy: 0.7651130797953406
Energy: 0.9873970443507183
Energy: 0.8627498688530952
Energy: 0.7649915642309864
Energy: 0.8627498688530952
Energy: 0.7649915642309864
Energy: 0.8627498688530952
Energy: 0.7649915642309864
Energy: 0.798733205523191
Energy: 0.8174035847749566
Energy: 0.798733205522607
Energy: 0.8174035847749566
Energy: 0.798733205523191
Energy: 0.8174035847749566
Energy: 0.7987210282535535
Energy: 0.8172639924675049
Energy: 0.7987210282535535
Energy: 0.8172639924675049
Energy: 0.7987210282529827
Energy: 0.8172639924675049
Energy: 0.8628475048087595
Energy: 0.7649886594478187
Energy: 0.8628475048087595
Energy: 0.7649886594478187
Energy: 0.8628475048087595
Energy: 0.7649886594478187
Energy: 0.76510057880662
Energy: 0.9873769537175887
Energy: 0.76510057880662
Energy: 0.9873769537175887
Energy: 0.76510057880662
Energy: 0.9873769537170047
Energy: 0.9503890000617464
Energy: 0.9895473785520313
Energy: 0.9503890000617464
Energy: 0.9895473785520313
Energy: 0.9503890000617464
Energy: 0.9895473785520313
Energy: 0.8203941246509449
Energy: 0.8147609060034644
Energy: 0.8203941246509449
Energy: 0.8147609060034644
Energy: 0.8203941246509449
Energy: 0.8147609060034644
Energy: 0.9503678218012082
Energy: 0.9896160883518874
Energy: 0.9503678218017921
Energy: 0.9896160883518874
Energy: 0.9503678218017921
Energy: 0.9896160883518874
Energy: 0.7651130797953406
Energy: 0.9873970443507183
Energy: 0.7651130797953406
Energy: 0.9873970443507183
Energy: 0.7651130797953406
Energy: 0.9873970443507183
Energy: 0.8627498688530952
Energy: 0.7649915642304024
Energy: 0.8627498688530952
Energy: 0.7649915642309864
Energy: 0.8627498688530952
Energy: 0.7649915642309864
Energy: 0.798733205523191
Energy: 0.8174035847749566
Energy: 0.798733205523191
Energy: 0.8174035847749566
Energy: 0.798733205522607
Energy: 0.8174035847749566
Energy: 0.7987210282529827
Energy: 0.817263992466921
Energy: 0.7987210282529827
Energy: 0.8172639924675049
Energy: 0.7987210282529827
Energy: 0.817263992466921
Energy: 0.8628475048087595
Energy: 0.7649886594478187
Energy: 0.8628475048087595
Energy: 0.7649886594478187
Energy: 0.8628475048087595
Energy: 0.7649886594478187
Energy: 0.76510057880662
Energy: 0.9873769537175887
Energy: 0.76510057880662
Energy: 0.9873769537175887
Energy: 0.76510057880662
Energy: 0.9873769537175887
Energy: 0.9503890000617464
Energy: 0.9895473785520313
Energy: 0.9503890000617464
Energy: 0.9895473785520313
Energy: 0.9503890000617464
Energy: 0.9895473785520313
Energy: 0.8203941246509449
Energy: 0.8147609060034644
Energy: 0.8203941246509449
Energy: 0.8147609060034644
Energy: 0.8203941246509449
Energy: 0.8147609060034644
Energy: 0.9503678218017921
Energy: 0.9896160883518874
Energy: 0.9503678218017921
Energy: 0.9896160883518874
Energy: 0.9503678218017921
Energy: 0.9896160883518874
Energy: 0.7651130797953406
Energy: 0.9873970443507183
Energy: 0.7651130797953406
Energy: 0.9873970443507183
Energy: 0.7651130797953406
Energy: 0.9873970443507183
Energy: 0.8627498688530952
Energy: 0.7649915642309864
Energy: 0.8627498688530952
Energy: 0.7649915642304024
Energy: 0.8627498688530952
Energy: 0.7649915642309864
Energy: 0.798733205523191
Energy: 0.8174035847749566
Energy: 0.798733205523191
Energy: 0.8174035847749566
Energy: 0.798733205523191
Energy: 0.8174035847749566
Energy: 0.7987210282529827
Energy: 0.817263992466921
Energy: 0.7987210282529827
Energy: 0.8172639924675049
Energy: 0.7987210282529827
Energy: 0.8172639924675049
Energy: 0.8628475048087595
Energy: 0.7649886594478187
Energy: 0.8628475048087595
Energy: 0.7649886594478187
Energy: 0.8628475048087595
Energy: 0.7649886594478187
Energy: 0.76510057880662
Energy: 0.9873769537170047
Energy: 0.76510057880662
Energy: 0.9873769537170047
Energy: 0.76510057880662
Energy: 0.9873769537170047
Energy: 0.9503890000617464
Energy: 0.9895473785520313
Energy: 0.9503890000617464
Energy: 0.9895473785520313
Energy: 0.9503890000617464
Energy: 0.9895473785520313
Energy: 0.8203941246509449
Energy: 0.8147609060034644
Energy: 0.8203941246509449
Energy: 0.8147609060034644
Energy: 0.8203941246509449
Energy: 0.8147609060034644
Energy: 0.9503678218017921
Energy: 0.9896160883518874
Energy: 0.9503678218017921
Energy: 0.9896160883518874
Energy: 0.9503678218017921
Energy: 0.9896160883518874
Energy: 0.7651130797953406
Energy: 0.9873970443507183
Energy: 0.7651130797953406
Energy: 0.9873970443507183
Energy: 0.7651130797953406
Energy: 0.9873970443507183

minimum gb energy = 0.7649886594478187 eV
minimum distance =  2.29275159657759 Angstroms
sigma value = 27


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

Energy: 0.816115180205814
Energy: 0.7856756843114704
Energy: 0.816115180205814
Energy: 0.7856756843114704
Energy: 0.816115180205814
Energy: 0.7856756843114704
Energy: 0.8670001296260338
Energy: 0.820154902431525
Energy: 0.8670001296260338
Energy: 0.820154902431525
Energy: 0.8670001296260338
Energy: 0.820154902431525
Energy: 0.7903155415172487
Energy: 0.8947132717198493
Energy: 0.7903155415172487
Energy: 0.8947132717198493
Energy: 0.7903155415158181
Energy: 0.8947132717198493
Energy: 0.8823644691564874
Energy: 0.761273512898031
Energy: 0.8823644691493505
Energy: 0.761273512898031
Energy: 0.8823644691379053
Energy: 0.761273512898031
Energy: 0.8831662683400938
Energy: 0.7611892692057866
Energy: 0.8831662683400938
Energy: 0.7611892692057866
Energy: 0.8831662683400938
Energy: 0.7611892692057866
Energy: 0.9085564444680617
Energy: 0.9535594888195951
Energy: 0.9085564444680617
Energy: 0.9535594888195951
Energy: 0.9085564444680617
Energy: 0.9535594888195951
Energy: 0.8682289617937471
Energy: 0.8226305798411847
Energy: 0.8682289617937471
Energy: 0.8226305798411847
Energy: 0.8682289617937471
Energy: 0.8226305798411847
Energy: 0.8110129958801992
Energy: 0.7866289218098926
Energy: 0.8110129958801992
Energy: 0.7866289218098926
Energy: 0.8110129958801992
Energy: 0.7866289218098926
Energy: 0.9256124155244196
Energy: 0.7893021482385967
Energy: 0.9256124155244196
Energy: 0.7893021479240062
Energy: 0.9256124155244196
Energy: 0.7893021474964451
Energy: 0.854267463622907
Energy: 0.9441285219949576
Energy: 0.854267463622907
Energy: 0.9441285219949576
Energy: 0.854267463622907
Energy: 0.9441285219949576
Energy: 0.7860210045365135
Energy: 0.7626432965299179
Energy: 0.7860210045365135
Energy: 0.7626432965299179
Energy: 0.7860210045365135
Energy: 0.7626432965299179
Energy: 0.9498270326007094
Energy: 0.8897700758703696
Energy: 0.9498270326007094
Energy: 0.8897700758703696
Energy: 0.9498270326007094
Energy: 0.8897700758703696

minimum gb energy = 0.7611892692057866 eV
minimum distance =  2.27320912447769 Angstroms
sigma value = 9


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

Energy: 0.8231370219937941
Energy: 0.7629535551645357
Energy: 0.8231370219937941
Energy: 0.7629535551649377
Energy: 0.8231370219937941
Energy: 0.7629535551649377
Energy: 0.8565932723658507
Energy: 0.7461507377994725
Energy: 0.8565932723662527
Energy: 0.7461507377994725
Energy: 0.8565932723658507
Energy: 0.7199960514675846
Energy: 0.6942260015416947
Energy: 0.8790640929882064
Energy: 0.6942260015416947
Energy: 0.8790640929878045
Energy: 0.6942260015416947
Energy: 0.8790640929874025
Energy: 0.7343057295146485
Energy: 0.7020296245855705
Energy: 0.7343057295146485
Energy: 0.7020296245855705
Energy: 0.7343057295146485
Energy: 0.7020296245855705
Energy: 0.7476311325817171
Energy: 0.7291298250720267
Energy: 0.7476311325817171
Energy: 0.7291298250720267
Energy: 0.7476311325817171
Energy: 0.7291298250720267
Energy: 0.7846655711092291
Energy: 0.78705834788
Energy: 0.7846655711092291
Energy: 0.7870583478795979
Energy: 0.7846655711096311
Energy: 0.7928116889812187
Energy: 0.7505954593355322
Energy: 0.7883333712133997
Energy: 0.7505954593355322
Energy: 0.7883333712138019
Energy: 0.7505954593359341
Energy: 0.7883333712138019
Energy: 0.6852925634384113
Energy: 0.7871259029405517
Energy: 0.6852925634384113
Energy: 0.7871259029405517
Energy: 0.6852925634384113
Energy: 0.7871259029401496
Energy: 0.7789320610332745
Energy: 0.7291795709060499
Energy: 0.7789320610332745
Energy: 0.7291795709064519
Energy: 0.7789320610332745
Energy: 0.7291795709060499
Energy: 0.7489939045265981
Energy: 0.8605736417877049
Energy: 0.7489939045253922
Energy: 0.8605736377380561
Energy: 0.7489939045249902
Energy: 0.8605736274336957
Energy: 0.7343157297903473
Energy: 0.7092875898818831
Energy: 0.7343157297899454
Energy: 0.7092875898818831
Energy: 0.7343157297899454
Energy: 0.7092875898818831
Energy: 0.7093089305912588
Energy: 0.7962310365211934
Energy: 0.7093089305908569
Energy: 0.7697503154931584
Energy: 0.7093089305912588
Energy: 0.7962310365211934
Energy: 0.7070960877441321
Energy: 0.7541195162252631
Energy: 0.7188458718358943
Energy: 0.754119516225665
Energy: 0.7102514029210446
Energy: 0.7541195162252631
Energy: 0.8186403260165976
Energy: 0.8582632061344869
Energy: 0.8186403260149897
Energy: 0.8582632061344869
Energy: 0.8186403260137839
Energy: 0.8582632061344869
Energy: 0.7188342024440437
Energy: 0.7678608634504436
Energy: 0.7188342024440437
Energy: 0.7678608634504436
Energy: 0.7188342024440437
Energy: 0.7678608634504436
Energy: 0.7008829767586141
Energy: 0.803624861736085
Energy: 0.7008829767586141
Energy: 0.803624861736085
Energy: 0.7008829767582121
Energy: 0.8036248617368892
Energy: 0.919504577609637
Energy: 0.7027195455966146
Energy: 0.919504577609637
Energy: 0.7027195455966146
Energy: 0.919504577609637
Energy: 0.7027195455966146
Energy: 0.726991117211594
Energy: 0.7282898029066988
Energy: 0.726991117211594
Energy: 0.7282898029066988
Energy: 0.726991117211594
Energy: 0.7282898029066988
Energy: 0.6814468319284287
Energy: 0.9234963570459019
Energy: 0.6814468319284287
Energy: 0.9234963570422843
Energy: 0.6814468319284287
Energy: 0.9234963570306269
Energy: 1.0158660068794607
Energy: 0.7196709755799237
Energy: 1.0158660068794607
Energy: 0.7196709755799237
Energy: 1.0158660068794607
Energy: 0.7196709755799237
Energy: 0.681671960564683
Energy: 0.9937756453492526
Energy: 0.681671960564683
Energy: 0.9937756453492526
Energy: 0.6816719605650667
Energy: 0.9937756453492526
Energy: 0.7270095356303813
Energy: 0.7279453161715238
Energy: 0.7270095356303813
Energy: 0.7279453161715238
Energy: 0.7270095356303813
Energy: 0.7279453161715238
Energy: 0.9195319749470615
Energy: 0.7028878540072213
Energy: 0.9195319749470615
Energy: 0.7028878540072213
Energy: 0.9195319749470615
Energy: 0.7028878540072213
Energy: 0.7010324125666425
Energy: 0.7534672943989199
Energy: 0.7010324125670444
Energy: 0.7534672944005278
Energy: 0.7010324125666425
Energy: 0.7534672943993218
Energy: 0.7182236718832055
Energy: 0.7679780630212264
Energy: 0.7182236718832055
Energy: 0.7679780630208244
Energy: 0.7182236718832055
Energy: 0.7679780630212264
Energy: 0.8186769330960171
Energy: 0.8582124029424562
Energy: 0.818676933096821
Energy: 0.8582124029420543
Energy: 0.8186769330952133
Energy: 0.8582124029420543
Energy: 0.7076470669939255
Energy: 0.7541211101062206
Energy: 0.7266142007608772
Energy: 0.7541211101066225
Energy: 0.7158310707554951
Energy: 0.7541211101066225
Energy: 0.709746469514667
Energy: 0.7143856380081028
Energy: 0.709746469514667
Energy: 0.7143856380077008
Energy: 0.709746469514667
Energy: 0.7143856380081028
Energy: 0.7344997563614035
Energy: 0.7095239173172978
Energy: 0.7344997563610016
Energy: 0.7095239173172978
Energy: 0.7344997563610016
Energy: 0.7095239173172978
Energy: 0.7490054902902077
Energy: 0.7208629846469443
Energy: 0.7490054902906096
Energy: 0.7208629846469443
Energy: 0.7490054902898057
Energy: 0.7208629846481502
Energy: 0.7793922103632431
Energy: 0.7292126228022574
Energy: 0.7793922103628412
Energy: 0.7292126228022574
Energy: 0.7793922103628412
Energy: 0.7292126228018555
Energy: 0.6853072523827699
Energy: 0.7872142486482767
Energy: 0.6853072523827699
Energy: 0.7872142486482767
Energy: 0.6853072523827699
Energy: 0.7872142486482767
Energy: 0.7508965069669474
Energy: 0.788220643987807
Energy: 0.7508965069673494
Energy: 0.788220643987807
Energy: 0.7508965069669474
Energy: 0.788220643987807
Energy: 0.785180789573592
Energy: 0.7133101895279856
Energy: 0.7851807895747981
Energy: 0.7133101895312013
Energy: 0.785180789573592
Energy: 0.7133101895312013
Energy: 0.7477482543475468
Energy: 0.7290600342428235
Energy: 0.7477482543475468
Energy: 0.7290600342428235
Energy: 0.7477482543475468
Energy: 0.7290600342432254
Energy: 0.734399094076678
Energy: 0.702364466532743
Energy: 0.73439909407708
Energy: 0.702364466532743
Energy: 0.73439909407708
Energy: 0.702364466532743
Energy: 0.6941425099010222
Energy: 0.8794664394240578
Energy: 0.6941425099010222
Energy: 0.8794664394240578
Energy: 0.6941425099010222
Energy: 0.8794664394236558
Energy: 0.8570639163557662
Energy: 0.7583416710027652
Energy: 0.8570639163557662
Energy: 0.7583416706608346
Energy: 0.8570639163557662
Energy: 0.7583416702011817
Energy: 0.8231370219937941
Energy: 0.7629535551645357
Energy: 0.8231370219937941
Energy: 0.7629535551645357
Energy: 0.8231370219937941
Energy: 0.7629535551645357
Energy: 0.8565932723662527
Energy: 0.7179596696201666
Energy: 0.8565932723658507
Energy: 0.7179596696201666
Energy: 0.8565932723662527
Energy: 0.7179596696201666
Energy: 0.6942260015416947
Energy: 0.8790640929878045
Energy: 0.6942260015416947
Energy: 0.8790640929874025
Energy: 0.6942260015416947
Energy: 0.8790640929878045
Energy: 0.7343057295146485
Energy: 0.7020296245859725
Energy: 0.7343057295146485
Energy: 0.7020296245859725
Energy: 0.7343057295150504
Energy: 0.7020296245859725
Energy: 0.7476311325817171
Energy: 0.7291298250724287
Energy: 0.7476311325817171
Energy: 0.7291298250724287
Energy: 0.7476311325817171
Energy: 0.7291298250720267

minimum gb energy = 0.6814468319284287 eV
minimum distance =  2.36163746831772 Angstroms
sigma value = 57


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

Energy: 0.3534923935798867
Energy: 0.3619502681398064
Energy: 0.3534923935798867
Energy: 0.3619502681398064
Energy: 0.3534923935798867
Energy: 0.3619502681398064
Energy: 0.4456336197060321
Energy: 0.3545616605942196
Energy: 0.4456336197060321
Energy: 0.3545616605942196
Energy: 0.4456336197060321
Energy: 0.3545616605942196
Energy: 0.3960567613008641
Energy: 0.43937671167252246
Energy: 0.3960567613008641
Energy: 0.43937671167252246
Energy: 0.3960567613008641
Energy: 0.43937671167252246
Energy: 0.3642964014631309
Energy: 0.35334400758164547
Energy: 0.3642964014631309
Energy: 0.35334400758164547
Energy: 0.3642964014631309
Energy: 0.35334400758164547
Energy: 0.44635277113842026
Energy: 0.4476885254004913
Energy: 0.44635277113842026
Energy: 0.4476885254004913
Energy: 0.44635277113842026
Energy: 0.4476885254004913
Energy: 0.35361518653513535
Energy: 0.3981487593733425
Energy: 0.35361518653513535
Energy: 0.3981487593742575
Energy: 0.35361518653513535
Energy: 0.3981487593742575
Energy: 0.35363765352028714
Energy: 0.3969201895600644
Energy: 0.35363765352028714
Energy: 0.39692018956097946
Energy: 0.35363765352028714
Energy: 0.39692018956097946
Energy: 0.44662032961724735
Energy: 0.44767382707280784
Energy: 0.44662032961724735
Energy: 0.44767382707280784
Energy: 0.44662032961724735
Energy: 0.4476738270718928
Energy: 0.36408752227439084
Energy: 0.3533348266612415
Energy: 0.36408752227439084
Energy: 0.3533348266612415
Energy: 0.36408752227439084
Energy: 0.3533348266612415
Energy: 0.39607920617866044
Energy: 0.4394493131677517
Energy: 0.39607920617866044
Energy: 0.4394493131677517
Energy: 0.39607920617866044
Energy: 0.4394493131677517
Energy: 0.44571045615164995
Energy: 0.35472561380828543
Energy: 0.44571045615164995
Energy: 0.35472561380828543
Energy: 0.44571045615164995
Energy: 0.35472561380828543
Energy: 0.3534923935798867
Energy: 0.3619502681398064
Energy: 0.3534923935798867
Energy: 0.3619502681398064
Energy: 0.3534923935798867
Energy: 0.3619502681398064
Energy: 0.4456336197060321
Energy: 0.3545616605942196
Energy: 0.4456336197060321
Energy: 0.3545616605942196
Energy: 0.4456336197060321
Energy: 0.3545616605942196
Energy: 0.3960567613008641
Energy: 0.43937671167252246
Energy: 0.3960567613008641
Energy: 0.43937671167252246
Energy: 0.3960567613008641
Energy: 0.4393767116734375
Energy: 0.3642964014631309
Energy: 0.35334400758164547
Energy: 0.3642964014631309
Energy: 0.35334400758164547
Energy: 0.3642964014631309
Energy: 0.35334400758164547
Energy: 0.44635277113842026
Energy: 0.4476885254004913
Energy: 0.44635277113842026
Energy: 0.4476885254004913
Energy: 0.44635277113842026
Energy: 0.4476885254004913
Energy: 0.35361518653513535
Energy: 0.3981487593742575
Energy: 0.35361518653513535
Energy: 0.3981487593742575
Energy: 0.35361518653513535
Energy: 0.3981487593733425
Energy: 0.35363765352028714
Energy: 0.39692018956097946
Energy: 0.35363765352028714
Energy: 0.3969201895600644
Energy: 0.35363765352028714
Energy: 0.39692018956097946
Energy: 0.44662032961724735
Energy: 0.44767382707280784
Energy: 0.44662032961724735
Energy: 0.44767382707280784
Energy: 0.44662032961724735
Energy: 0.4476738270718928

minimum gb energy = 0.3533348266612415 eV
minimum distance =  2.47141445841867 Angstroms
sigma value = 11


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

Energy: 0.6384011972656585
Energy: 0.6219110616020886
Energy: 0.6384011972663287
Energy: 0.6219110615994075
Energy: 0.6384011972656585
Energy: 0.6219110616000779
Energy: 0.7803471898184595
Energy: 0.6480756092687572
Energy: 0.78034718981913
Energy: 0.6480756092694274
Energy: 0.78034718981913
Energy: 0.6480756092694274
Energy: 0.7979773690240136
Energy: 1.024500016093307
Energy: 0.8184174188970185
Energy: 1.024500016093307
Energy: 0.7979773690240136
Energy: 1.024500016093307
Energy: 0.8233246050507311
Energy: 0.6042677344434085
Energy: 0.8233246050500609
Energy: 0.6042677344434085
Energy: 0.8233246050507311
Energy: 0.6042677344434085
Energy: 0.7100303474113709
Energy: 0.5759173427550672
Energy: 0.7100303474113709
Energy: 0.5759173427550672
Energy: 0.7100303474113709
Energy: 0.5759173427550672
Energy: 0.7078694680131404
Energy: 0.5948638084643679
Energy: 0.7078694680131404
Energy: 0.5948638084643679
Energy: 0.7078694680131404
Energy: 0.5948638084650382
Energy: 0.5865047794216467
Energy: 0.8202311865407542
Energy: 0.5865047794216467
Energy: 0.8202311865407542
Energy: 0.5865047794216467
Energy: 0.8202311865414246
Energy: 0.746904518181323
Energy: 0.5523711662408753
Energy: 0.746904518181323
Energy: 0.5523711662408753
Energy: 0.746904518181323
Energy: 0.5523711662408753
Energy: 0.7447719611763739
Energy: 0.5547144565880712
Energy: 0.7447719611763739
Energy: 0.5547144565880712
Energy: 0.7447719611763739
Energy: 0.5547144565880712
Energy: 0.5678977330248149
Energy: 0.68141998475704
Energy: 0.5678977330248149
Energy: 0.6815243189683075
Energy: 0.5678977330241446
Energy: 0.6815902271746157
Energy: 0.7253647571885867
Energy: 0.7231811308261082
Energy: 0.725364757189257
Energy: 0.7231811308261082
Energy: 0.725364757189257
Energy: 0.7231811308261082
Energy: 0.5959234219072171
Energy: 0.5791535738094981
Energy: 0.5959234219072171
Energy: 0.5791535738094981
Energy: 0.5959234219072171
Energy: 0.5791535738094981
Energy: 0.760329108220305
Energy: 0.607425760852917
Energy: 0.760329108220305
Energy: 0.607425760852917
Energy: 0.760329108220305
Energy: 0.607425760852917
Energy: 0.8303858179391576
Energy: 0.9714671146131899
Energy: 0.8303858179391576
Energy: 0.9714671146131899
Energy: 0.8303858179391576
Energy: 0.9714671146131899
Energy: 0.7806386351730826
Energy: 0.6497679280044113
Energy: 0.7806386351730826
Energy: 0.6497679280044113
Energy: 0.7806386351730826
Energy: 0.6497679280044113
Energy: 0.6357643708244601
Energy: 0.6228926043031581
Energy: 0.6357643708244601
Energy: 0.6228926043031581
Energy: 0.6357643708244601
Energy: 0.6228926043031581
Energy: 0.6723437670013301
Energy: 0.64695143422374
Energy: 0.6723437670013301
Energy: 0.64695143422374
Energy: 0.6723437670013301
Energy: 0.64695143422374
Energy: 0.972223332274839
Energy: 0.9612579000063912
Energy: 0.972223332274839
Energy: 0.9612579000063912
Energy: 0.972223332274839
Energy: 0.9612579000063912
Energy: 0.8361109280763511
Energy: 0.6021367057997183
Energy: 0.8361109280756809
Energy: 0.6021367057997183
Energy: 0.8361109280756809
Energy: 0.6021367057997183
Energy: 0.595892463410688
Energy: 0.6756399203161519
Energy: 0.5958924634120285
Energy: 0.6756399203161519
Energy: 0.5958924634113583
Energy: 0.6756399203161519
Energy: 0.56758120885347
Energy: 0.596835277939733
Energy: 0.56758120885347
Energy: 0.596835277939733
Energy: 0.56758120885347
Energy: 0.596835277939733
Energy: 0.7319699448272301
Energy: 0.8216005307367202
Energy: 0.73196994482656
Energy: 0.8216005307367202
Energy: 0.7319699448272301
Energy: 0.8216005307367202
Energy: 0.7499164925944591
Energy: 0.6816947272366405
Energy: 0.7499164925944591
Energy: 0.6816947272366405
Energy: 0.7499164925944591
Energy: 0.6816947272366405
Energy: 0.742789900718659
Energy: 0.5853190061707053
Energy: 0.742789900718659
Energy: 0.5853190061707053
Energy: 0.742789900718659
Energy: 0.5853190061707053
Energy: 0.5679163888974736
Energy: 0.9164537431914109
Energy: 0.5679163888974736
Energy: 0.9164536000516368
Energy: 0.5679163888974736
Energy: 0.916453569624515
Energy: 1.0828742403962441
Energy: 0.7235278392093906
Energy: 1.0828742403962441
Energy: 0.7235278392100608
Energy: 1.0828742403962441
Energy: 0.7235278392093906

minimum gb energy = 0.5523711662408753 eV
minimum distance =  2.36734022805315 Angstroms
sigma value = 41


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

Energy: 0.7216976236781558
Energy: 0.6427176121136431
Energy: 0.7216976236786842
Energy: 0.6427176121136431
Energy: 0.7216976236786842
Energy: 0.6427176121136431
Energy: 0.8289275556003307
Energy: 0.680501054112862
Energy: 0.8289275555998025
Energy: 0.680501054112862
Energy: 0.8289275555998025
Energy: 0.680501054112862
Energy: 0.7409916419017306
Energy: 1.133173417834336
Energy: 0.7409916419017306
Energy: 1.133173417834336
Energy: 0.7409916419017306
Energy: 1.1331734178338075
Energy: 0.6885405780577908
Energy: 0.6382997924019853
Energy: 0.6885405780577908
Energy: 0.6382997924019853
Energy: 0.6885405780577908
Energy: 0.6382997924019853
Energy: 0.6185982374602652
Energy: 0.6737038710486826
Energy: 0.6185982374602652
Energy: 0.6737038710486826
Energy: 0.6185982374602652
Energy: 0.6737038710486826
Energy: 0.8122054604536912
Energy: 0.6903127366419322
Energy: 0.8122054604536912
Energy: 0.6903127366424605
Energy: 0.8122054604536912
Energy: 0.6903127366419322
Energy: 0.6352945461229532
Energy: 0.9045053488770571
Energy: 0.6352945461229532
Energy: 0.9045053488765287
Energy: 0.6352945461229532
Energy: 0.9045053488765287
Energy: 0.6241338111284886
Energy: 0.6382117889371638
Energy: 0.6241338111284886
Energy: 0.6382117889371638
Energy: 0.6241338111284886
Energy: 0.6382117889371638
Energy: 0.6282045972081604
Energy: 0.6654186519314534
Energy: 0.6282045972081604
Energy: 0.6654186519314534
Energy: 0.6282045972086887
Energy: 0.6654186519314534
Energy: 0.6859413308808925
Energy: 1.0004838857386074
Energy: 0.6859413308808925
Energy: 1.0004838857386074
Energy: 0.6859413308808925
Energy: 1.0004838857386074
Energy: 0.6829491142892911
Energy: 0.9720737934155667
Energy: 0.6829491142892911
Energy: 0.9720737934160948
Energy: 0.6829491142892911
Energy: 0.9720737934224344
Energy: 0.6078513761741465
Energy: 0.6633459570778694
Energy: 0.6078513761741465
Energy: 0.6633459570773411
Energy: 0.6078513761741465
Energy: 0.6633459570773411
Energy: 0.6177571859784979
Energy: 0.6348874097098827
Energy: 0.6177571859784979
Energy: 0.6348874097098827
Energy: 0.6177571859784979
Energy: 0.6348874097098827
Energy: 0.5918614485120438
Energy: 0.8861712593904815
Energy: 0.5918614485120438
Energy: 0.8861712593899532
Energy: 0.5918614485120438
Energy: 0.8861712593904815
Energy: 0.8155123445034531
Energy: 0.6902082824039644
Energy: 0.8155123445034531
Energy: 0.6902082824092473
Energy: 0.8155123445034531
Energy: 0.6902082824097756
Energy: 0.5928862342036576
Energy: 0.7792513619904154
Energy: 0.5928862342036576
Energy: 0.7792513619904154
Energy: 0.5928862342036576
Energy: 0.7792513619904154
Energy: 0.6223541080324222
Energy: 0.6349839275451432
Energy: 0.6223541080324222
Energy: 0.6349839275451432
Energy: 0.6223541080324222
Energy: 0.6349839275451432
Energy: 0.810835430187502
Energy: 1.1508669100096458
Energy: 0.810835430187502
Energy: 1.1508669100096458
Energy: 0.810835430187502
Energy: 1.1508669100091176
Energy: 0.7021286193856471
Energy: 0.6804374036384794
Energy: 0.7021286193861754
Energy: 0.6804374036691084
Energy: 0.7021286193856471
Energy: 0.6804374035666557
Energy: 0.683640890415998
Energy: 0.6415301574837969
Energy: 0.683640890415998
Energy: 0.6415301574779978
Energy: 0.683640890415998
Energy: 0.6415301574832687
Energy: 0.6297662905030984
Energy: 0.681996141666829
Energy: 0.6297662905030984
Energy: 0.681996141666829
Energy: 0.6297662905030984
Energy: 0.681996141666829
Energy: 0.7381918237352735
Energy: 1.1168419613623934
Energy: 0.7381918237358018
Energy: 1.1168419613623934
Energy: 0.7381918237358018
Energy: 1.1168419613618652
Energy: 0.7624624483157894
Energy: 0.6343515895365505
Energy: 0.7624624483157894
Energy: 0.6343515895365505
Energy: 0.7624624483157894
Energy: 0.6343515895370787
Energy: 0.5931796297968639
Energy: 0.6815044206216417
Energy: 0.5931796297968639
Energy: 0.6815044206205852
Energy: 0.5931796297968639
Energy: 0.6815044206190004
Energy: 0.5955248808377491
Energy: 0.8035526018968717
Energy: 0.5955248808377491
Energy: 0.8035526018968717
Energy: 0.5955248808377491
Energy: 0.8035526018968717
Energy: 0.6365476717535874
Energy: 0.9181400948316681
Energy: 0.6365476717535874
Energy: 0.9181400948316681
Energy: 0.6365476717535874
Energy: 0.9181400948316681
Energy: 0.6185686912345406
Energy: 0.6342809981250019
Energy: 0.6185686912345406
Energy: 0.6342809981250019
Energy: 0.6185686912345406
Energy: 0.6342809981250019
Energy: 0.6253007799642158
Energy: 0.6737681990843777
Energy: 0.6253007799642158
Energy: 0.6737681990843777
Energy: 0.6253007799642158
Energy: 0.6737681990838493
Energy: 0.6836062136380896
Energy: 0.7846910007150112
Energy: 0.6836062136380896
Energy: 0.7846910007150112
Energy: 0.6836062136380896
Energy: 0.7846910007150112
Energy: 0.9299105560364883
Energy: 0.8815523268956922
Energy: 0.9299105560364883
Energy: 0.8815523268956922
Energy: 0.92991055603596
Energy: 0.8815523268962205
Energy: 0.6090261105103731
Energy: 0.6615245974513118
Energy: 0.6090261105103731
Energy: 0.6615245974518401
Energy: 0.6090261105103731
Energy: 0.6615245974523684
Energy: 0.6328851896618835
Energy: 0.6599955629985383
Energy: 0.6328851896618835
Energy: 0.6599955629985383
Energy: 0.6328851896618835
Energy: 0.6599955629985383
Energy: 0.5952796056050857
Energy: 0.6562640883091534
Energy: 0.5952796056050857
Energy: 0.6562640883091534
Energy: 0.5952796056050857
Energy: 0.6562640883096817

minimum gb energy = 0.5918614485120438 eV
minimum distance =  2.38618610500025 Angstroms
sigma value = 33


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

Energy: 0.7206842941557698
Energy: 0.6498548179656154
Energy: 0.7206842941557698
Energy: 0.6498548179656154
Energy: 0.7206842941557698
Energy: 0.6498548179656154
Energy: 0.7418640816906884
Energy: 0.6221484549502279
Energy: 0.7418640816914299
Energy: 0.6221484549502279
Energy: 0.7418640816914299
Energy: 0.6221484549502279
Energy: 0.9203336167090325
Energy: 0.7715354695157672
Energy: 0.9203336167094034
Energy: 0.7715354695153965
Energy: 0.9203336167090325
Energy: 0.771535469516138
Energy: 0.6797900544134862
Energy: 0.6410001991380574
Energy: 0.6797900544134862
Energy: 0.6410001991380574
Energy: 0.6797900544134862
Energy: 0.6410001991380574
Energy: 0.66787439393796
Energy: 0.7306808086783765
Energy: 0.66787439393796
Energy: 0.7306808086783765
Energy: 0.66787439393796
Energy: 0.7306808086783765
Energy: 0.9027413288744746
Energy: 0.6629936625519812
Energy: 0.9027413288744746
Energy: 0.6629936625527227
Energy: 0.9027413288744746
Energy: 0.6629936625519812
Energy: 0.6602984787188322
Energy: 0.7351881664767598
Energy: 0.6602984787184614
Energy: 0.7351881664767598
Energy: 0.6602984787184614
Energy: 0.7351881664767598
Energy: 0.7085023459573973
Energy: 0.7248832275355553
Energy: 0.7085023459573973
Energy: 0.7248832275355553
Energy: 0.7085023459573973
Energy: 0.7248832275355553
Energy: 0.7165045588607512
Energy: 0.6791179181351028
Energy: 0.7165045588607512
Energy: 0.6791179181351028
Energy: 0.7165045588614927
Energy: 0.6791179181351028
Energy: 0.9554227831448446
Energy: 0.6458677652754787
Energy: 0.9554227831452153
Energy: 0.6458677652754787
Energy: 0.9554227831448446
Energy: 0.6458677652754787
Energy: 0.7010467629046225
Energy: 0.7010339321157464
Energy: 0.7010467629046225
Energy: 0.7010339321161171
Energy: 0.7010467629046225
Energy: 0.7010339321161171
Energy: 0.7247925233943083
Energy: 0.641051047762848
Energy: 0.7247925233924545
Energy: 0.6410510477621065
Energy: 0.7247925233939377
Energy: 0.641051047762848
Energy: 0.6827934021021892
Energy: 0.7172279683494245
Energy: 0.6827934021021892
Energy: 0.7172279683501659
Energy: 0.6827934021021892
Energy: 0.7172279683497953
Energy: 0.7187094817594605
Energy: 0.7042265939819842
Energy: 0.7187094817594605
Energy: 0.7042265939819842
Energy: 0.7187094817594605
Energy: 0.7042265939819842
Energy: 0.7115460198261674
Energy: 0.6602180022727021
Energy: 0.7115460198261674
Energy: 0.6602180022727021
Energy: 0.7115460198265381
Energy: 0.6602180022727021
Energy: 0.667054615951215
Energy: 0.8525899485795164
Energy: 0.667054615951215
Energy: 0.8525899485795164
Energy: 0.6670546159519565
Energy: 0.8525899485795164
Energy: 0.6814731523898198
Energy: 0.6365022251062333
Energy: 0.6814731523890782
Energy: 0.6365022251062333
Energy: 0.6814731523890782
Energy: 0.6365022251062333
Energy: 0.6388160152020625
Energy: 0.6800263810733964
Energy: 0.6388160152020625
Energy: 0.6800263810733964
Energy: 0.6388160152020625
Energy: 0.6800263810733964
Energy: 0.773240317078981
Energy: 0.9199570199527078
Energy: 0.773240317078981
Energy: 0.9199570199523371
Energy: 0.773240317078981
Energy: 0.9199570199523371
Energy: 0.671556685674787
Energy: 0.6828572690412819
Energy: 0.6715566856755285
Energy: 0.6828572690412819
Energy: 0.6715566856755285
Energy: 0.6828572690412819
Energy: 0.6558896001516921
Energy: 0.7007694603941936
Energy: 0.6558896001516921
Energy: 0.7007694603941936
Energy: 0.6558896001513214
Energy: 0.7007694603941936
Energy: 0.6193214884467787
Energy: 0.7444294409405621
Energy: 0.6193214884467787
Energy: 0.7444294409405621
Energy: 0.6193214884467787
Energy: 0.7444294409405621
Energy: 0.7116671416168783
Energy: 0.7033865676988365
Energy: 0.7116671416176199
Energy: 0.703386567684006
Energy: 0.7116671416168783
Energy: 0.7033865677021732
Energy: 0.6458856222905932
Energy: 0.6757518101949674
Energy: 0.6458856222905932
Energy: 0.6757518101912597
Energy: 0.6458856222905932
Energy: 0.6757518101934845
Energy: 0.6819509358148697
Energy: 0.6364050489084019
Energy: 0.6819509358148697
Energy: 0.6364050489084019
Energy: 0.6819509358148697
Energy: 0.6364050489084019
Energy: 0.6609708482967794
Energy: 0.9058241590590003
Energy: 0.6609708482967794
Energy: 0.9058241590590003
Energy: 0.6609708482967794
Energy: 0.9058241590586295
Energy: 0.7424665771697376
Energy: 0.6618139536259146
Energy: 0.7424665771697376
Energy: 0.6618139536259146
Energy: 0.7424665771697376
Energy: 0.6618139536259146
Energy: 0.7135585355715144
Energy: 0.6461014421441287
Energy: 0.7135585355715144
Energy: 0.6461014421441287
Energy: 0.7135585355715144
Energy: 0.6461014421441287
Energy: 0.6971807277349017
Energy: 0.717759463429263
Energy: 0.6971807277349017
Energy: 0.7177594634307463
Energy: 0.6971807277349017
Energy: 0.7177594634314878
Energy: 0.6430533456018732
Energy: 0.955500691935113
Energy: 0.6430533456018732
Energy: 0.955500691935113
Energy: 0.6430533456018732
Energy: 0.955500691935113
Energy: 0.6769123779064022
Energy: 0.6375972063085291
Energy: 0.6769123779064022
Energy: 0.6375972063085291
Energy: 0.6769123779064022
Energy: 0.6375972063092706
Energy: 0.6457789454708508
Energy: 0.6412978563457954
Energy: 0.6457789454708508
Energy: 0.641297856464759
Energy: 0.6457789454708508
Energy: 0.6412978564425302
Energy: 0.6721603769712743
Energy: 0.6745501551165682
Energy: 0.6721603769720158
Energy: 0.6745501551165682
Energy: 0.6721603769734988
Energy: 0.6745501551165682
Energy: 0.7014691254559755
Energy: 0.7142251384226259
Energy: 0.7014691254559755
Energy: 0.7142251384226259
Energy: 0.7014691254559755
Energy: 0.7142251384226259
Energy: 0.7013663536847428
Energy: 0.7142225566044066
Energy: 0.7013663536847428
Energy: 0.7142225566044066
Energy: 0.7013663536847428
Energy: 0.7142225566044066
Energy: 0.6720090262290901
Energy: 0.6741686604865679
Energy: 0.6720090262290901
Energy: 0.6741686604865679
Energy: 0.6720090262298316
Energy: 0.6741686604865679
Energy: 0.645684346402091
Energy: 0.6815880315345487
Energy: 0.645684346402091
Energy: 0.681588031534178
Energy: 0.645684346402091
Energy: 0.6815880315349195
Energy: 0.6769295528306891
Energy: 0.637320966906923
Energy: 0.6769295528310598
Energy: 0.637320966906923
Energy: 0.6769295528310598
Energy: 0.637320966906923
Energy: 0.6430569537271568
Energy: 0.955708322634285
Energy: 0.6430569537271568
Energy: 0.9557083226346557
Energy: 0.6430569537271568
Energy: 0.9557083226346557
Energy: 0.696703667605931
Energy: 0.7172569782363145
Energy: 0.696703667605931
Energy: 0.7172569782363145
Energy: 0.696703667605931
Energy: 0.717256978237056
Energy: 0.7019803327814379
Energy: 0.6460792484480207
Energy: 0.7019803327814379
Energy: 0.6460792484480207
Energy: 0.7019803327814379
Energy: 0.6460792484480207
Energy: 0.7423172155370676
Energy: 0.6615676549915918
Energy: 0.7423172155370676
Energy: 0.6615676549915918
Energy: 0.7423172155370676
Energy: 0.6615676549915918
Energy: 0.660986737952443
Energy: 0.9057078881110824
Energy: 0.6609867379528137
Energy: 0.9057078881107115
Energy: 0.660986737952443
Energy: 0.9057078881107115
Energy: 0.6911492194904084
Energy: 0.6364237759521401
Energy: 0.6911492194904084
Energy: 0.6364237759521401
Energy: 0.6911492194896669
Energy: 0.6364237759521401
Energy: 0.6458817618704189
Energy: 0.6752178921088938
Energy: 0.6458817618700482
Energy: 0.6752178921088938
Energy: 0.6458817618700482
Energy: 0.6752178921088938
Energy: 0.7114959712761019
Energy: 0.7059659944536569
Energy: 0.7114959712761019
Energy: 0.7059659943139476
Energy: 0.7114959712761019
Energy: 0.7059659944447587
Energy: 0.619148967541265
Energy: 0.7446925874446304
Energy: 0.619148967541265
Energy: 0.7446925874446304
Energy: 0.6191489675408943
Energy: 0.7446925874446304

minimum gb energy = 0.6191489675408943 eV
minimum distance =  2.38643965723478 Angstroms
sigma value = 67


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

Energy: 0.7626362673269328
Energy: 0.6711177140831467
Energy: 0.7626362673269328
Energy: 0.6711177140833859
Energy: 0.7626362673269328
Energy: 0.6711177140831467
Energy: 0.7277250406445966
Energy: 0.6417344264136728
Energy: 0.7277250406445966
Energy: 0.6417344264136728
Energy: 0.7277250406445966
Energy: 0.6417344264136728
Energy: 0.9634524667950275
Energy: 0.840752702618276
Energy: 0.8688439804445633
Energy: 0.840752702618276
Energy: 0.6895883077662791
Energy: 0.840752702618276
Energy: 0.7264162633265284
Energy: 0.6413194796505957
Energy: 0.7264162633262891
Energy: 0.6413194796505957
Energy: 0.7264162633262891
Energy: 0.6413194796505957
Energy: 0.7626362673271863
Energy: 0.6711177140831467
Energy: 0.7626362673269328
Energy: 0.6711177140831467
Energy: 0.7626362673271863
Energy: 0.6711177140831467
Energy: 0.7277250406445966
Energy: 0.6417344264136728
Energy: 0.7277250406445966
Energy: 0.6417344264136728
Energy: 0.7277250406445966
Energy: 0.6417344264136728
Energy: 0.6895883077662791
Energy: 0.840752702618276
Energy: 0.6895883077665326
Energy: 0.840752702618276
Energy: 0.6895883077662791
Energy: 0.840752702618276

minimum gb energy = 0.6413194796505957 eV
minimum distance =  2.3925808747454 Angstroms
sigma value = 3


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

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Energy: 0.748228419281411
Energy: 0.8552536741143718
Energy: 0.748228419281411
Energy: 0.8552536741143718
Energy: 0.748228419281411
Energy: 0.8194348010037094
Energy: 0.8999111463990777
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Energy: 0.8999111463990777
Energy: 0.8194348010037094
Energy: 0.8999111463990777
Energy: 0.8401888967580872
Energy: 0.7809114746349055
Energy: 0.8401888967580872
Energy: 0.7809114745506512
Energy: 0.8401888967580872
Energy: 0.7809114743922281
Energy: 0.7626422493023608
Energy: 0.8337643702629616
Energy: 0.7626422493023608
Energy: 0.8337642778671108
Energy: 0.7626422493023608
Energy: 0.8337639617804544
Energy: 0.7971604790513952
Energy: 0.7992846397218257
Energy: 0.7971604790513952
Energy: 0.7992846397218257
Energy: 0.7971604790513952
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Energy: 0.8123808947483082
Energy: 0.803670151330992
Energy: 0.8123808947483082
Energy: 0.803670151330992
Energy: 0.8123808947483082
Energy: 0.803670151330992

minimum gb energy = 0.7371278552505361 eV
minimum distance =  2.33988238541891 Angstroms
sigma value = 81


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

Energy: 0.7818170800475229
Energy: 0.7649716674676897
Energy: 0.7818170800475229
Energy: 0.7649716674676897
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Energy: 0.8737277366932994
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Energy: 0.8936732834693396
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Energy: 0.873937546194272
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Energy: 0.873804643095791
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Energy: 0.8738046430967167
Energy: 0.7250757826961256
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Energy: 0.7226605998763345
Energy: 0.7256277348053306
Energy: 0.7226605998763345
Energy: 0.7256277348053306
Energy: 0.7226605998763345
Energy: 0.7256277348053306
Energy: 0.7245376804125987
Energy: 0.6933613340418
Energy: 0.7245376804125987
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Energy: 0.7245376804125987
Energy: 0.6933613340418
Energy: 0.8009838326536676
Energy: 1.011103709440201
Energy: 0.8009838326536676
Energy: 1.011103709440201
Energy: 0.8009838326532047
Energy: 1.011103709439738
Energy: 0.9060552882213447
Energy: 0.8449067140013486
Energy: 0.9060552882213447
Energy: 0.8449067139685106
Energy: 0.9060552882213447
Energy: 0.8449067138676614
Energy: 0.8129743561617099
Energy: 0.7398273883808596
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Energy: 0.694275249985364
Energy: 0.7283255322218991
Energy: 0.694275249985364
Energy: 0.7283255322218991
Energy: 0.6942752499858269
Energy: 0.7283255322218991

minimum gb energy = 0.6767749315541537 eV
minimum distance =  2.38432647721928 Angstroms
sigma value = 43


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

Energy: 0.9490861497237989
Energy: 0.7613898211862332
Energy: 0.9490861497237989
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Energy: 0.8630404225247736
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Energy: 0.7282068427462618
Energy: 0.914041043696329
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Energy: 0.914041043696329
Energy: 0.7846164872197612
Energy: 0.8348835265380504
Energy: 0.7846164872197612
Energy: 0.8348835265380504
Energy: 0.7846164872197612
Energy: 0.8348835265380504
Energy: 0.8111249304032659
Energy: 0.8491674248766404
Energy: 0.8111249304032659
Energy: 0.8491674248766404
Energy: 0.8111249304032659
Energy: 0.8491674248760719
Energy: 0.8506658318112142
Energy: 0.75215576191703
Energy: 0.8506657226693445
Energy: 0.7521557619175985
Energy: 0.8506653979342599
Energy: 0.7521557619175985
Energy: 0.8857827718930589
Energy: 0.7929587343845098
Energy: 0.8857827718930589
Energy: 0.7929587343845098
Energy: 0.8857827718930589
Energy: 0.7929587343845098
Energy: 0.8863118737810776
Energy: 0.7793288848756414
Energy: 0.8863118737810776
Energy: 0.7793288848756414
Energy: 0.8863118737810776
Energy: 0.7793288848756414
Energy: 0.8488111782667475
Energy: 0.753421847200088
Energy: 0.8488096421749641
Energy: 0.753421847200088
Energy: 0.8488030507419192
Energy: 0.753421847200088
Energy: 0.8105033786879676
Energy: 0.8114178288022628
Energy: 0.8105033786879676
Energy: 0.8114178288022628
Energy: 0.8105033786879676
Energy: 0.8114178288022628
Energy: 0.8849446901779513
Energy: 0.8552869032865775
Energy: 0.8849446901773828
Energy: 0.8552869032865775
Energy: 0.8849446901773828
Energy: 0.8552869032865775
Energy: 0.7281905647365491
Energy: 0.8527030726384589
Energy: 0.7281905647365491
Energy: 0.8527030726384589
Energy: 0.7281905647365491
Energy: 0.8527030726384589
Energy: 0.8615302631443755
Energy: 0.8208793610363885
Energy: 0.861530263144944
Energy: 0.8208793610358199
Energy: 0.8615302631443755
Energy: 0.8208793610358199
Energy: 0.7901919426380878
Energy: 0.7844293959812351
Energy: 0.7901919426380878
Energy: 0.7844293959812351
Energy: 0.7901919426380878
Energy: 0.7844293959812351
Energy: 0.8964054714864468
Energy: 0.8092115878512914
Energy: 0.8964054714864468
Energy: 0.8092115878512914
Energy: 0.8964054714864468
Energy: 0.8092115878512914
Energy: 0.8045079267559244
Energy: 0.893061449280474
Energy: 0.8045079267559244
Energy: 0.893061449280474
Energy: 0.8045079267559244
Energy: 0.893061449280474
Energy: 0.8538218624490741
Energy: 0.7420249030335141
Energy: 0.8538107149526247
Energy: 0.7420249030335141
Energy: 0.7648350690721387
Energy: 0.7420249030335141
Energy: 0.7902564141215824
Energy: 0.8266063900059345
Energy: 0.7902564141215824
Energy: 0.8266063899718391
Energy: 0.7902564141215824
Energy: 0.8266063899218264
Energy: 0.8275264674004229
Energy: 0.8505799212721655
Energy: 0.8275264674004229
Energy: 0.8505799212715972
Energy: 0.8275264674004229
Energy: 0.8505799212715972
Energy: 0.7848168566726031
Energy: 0.8181021238017012
Energy: 0.7848168566720347
Energy: 0.8181021238017012
Energy: 0.7848168566708978
Energy: 0.8181021238017012

minimum gb energy = 0.7281905647365491 eV
minimum distance =  2.34564969828019 Angstroms
sigma value = 57


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

Energy: 0.8647032781162369
Energy: 0.7438676752769521
Energy: 0.8647032781162369
Energy: 0.7438676752769521
Energy: 0.8647032781162369
Energy: 0.7438676752769521
Energy: 0.8028163500395016
Energy: 0.7109386357520417
Energy: 0.8028163500395016
Energy: 0.7109386357520417
Energy: 0.8028163500395016
Energy: 0.7109386357520417
Energy: 0.810726309881621
Energy: 0.9088972837316684
Energy: 0.810726309880885
Energy: 0.9088972837316684
Energy: 0.8107263098779407
Energy: 0.9088972837316684
Energy: 0.8017093646652569
Energy: 0.8202743113437962
Energy: 0.8017093646652569
Energy: 0.8202743111797243
Energy: 0.8017093646652569
Energy: 0.8202743109008954
Energy: 0.77188350901262
Energy: 0.8201461538148407
Energy: 0.77188350901262
Energy: 0.715209536395502
Energy: 0.77188350901262
Energy: 0.7153399957313318
Energy: 0.808237788651715
Energy: 0.8005752548516764
Energy: 0.8082377886281614
Energy: 0.8005752548516764
Energy: 0.8082377885906397
Energy: 0.8005752548516764
Energy: 0.8124676319377901
Energy: 0.8670548833491335
Energy: 0.8124676319377901
Energy: 0.8670548833491335
Energy: 0.8124676319377901
Energy: 0.8670548833498696
Energy: 0.8028894910864098
Energy: 0.7481969214767639
Energy: 0.8028894910864098
Energy: 0.7481969214767639
Energy: 0.8028894910864098
Energy: 0.7481969214767639
Energy: 0.7749083824053363
Energy: 0.7110687697609852
Energy: 0.7749083824053363
Energy: 0.7110687697609852
Energy: 0.7749083824053363
Energy: 0.7110687697609852
Energy: 0.7013968075001565
Energy: 0.7776406528701761
Energy: 0.7013968075001565
Energy: 0.7776406528701761
Energy: 0.7013968074994205
Energy: 0.7776406528701761
Energy: 0.8125253647595156
Energy: 0.820319762105368
Energy: 0.8125253647602517
Energy: 0.8203197620788871
Energy: 0.8125253647595156
Energy: 0.8203197620332687
Energy: 0.7727327708659932
Energy: 0.7172205694921211
Energy: 0.7727327708659932
Energy: 0.7176561921340485
Energy: 0.7727327708659932
Energy: 0.7178854804042041
Energy: 0.7981585043866481
Energy: 0.7110365748955968
Energy: 0.7981585043859121
Energy: 0.7110365748955968
Energy: 0.7981585043851761
Energy: 0.7110365748955968
Energy: 0.8749457599030249
Energy: 0.7200913451080251
Energy: 0.8749457599030249
Energy: 0.7200913451080251
Energy: 0.8749457599030249
Energy: 0.7200913451080251
Energy: 0.7717027734318521
Energy: 0.7158953905178098
Energy: 0.7717042546625258
Energy: 0.7158953905178098
Energy: 0.7717018712897744
Energy: 0.7158953905178098
Energy: 0.7729303027907385
Energy: 0.7708901716366385
Energy: 0.7729303027907385
Energy: 0.7708901716366385
Energy: 0.7729303027907385
Energy: 0.7708901716366385
Energy: 0.6971977989225321
Energy: 0.8020209695849285
Energy: 0.6971977989225321
Energy: 0.8020209695849285
Energy: 0.6971977989225321
Energy: 0.8020209695849285
Energy: 0.8107539211996685
Energy: 0.8041484669252529
Energy: 0.8107539212004046
Energy: 0.8041484669252529
Energy: 0.8107539212004046
Energy: 0.8041484669252529
Energy: 0.697062528363118
Energy: 0.8020211875677049
Energy: 0.697062528363118
Energy: 0.8020211875677049
Energy: 0.697062528363118
Energy: 0.8020211875677049
Energy: 0.7730823366263498
Energy: 0.7709134051087894
Energy: 0.7730823366263498
Energy: 0.7709134051087894
Energy: 0.7730823366263498
Energy: 0.7709134051087894
Energy: 0.7871593243261295
Energy: 0.7159653882109999
Energy: 0.7871593243261295
Energy: 0.7159653882109999
Energy: 0.7871593243268655
Energy: 0.7159653882109999
Energy: 0.875130701247577
Energy: 0.7421830221415586
Energy: 0.875130701247577
Energy: 0.7421830221422947
Energy: 0.875130701247577
Energy: 0.7421830221422947
Energy: 0.7981532931640198
Energy: 0.7109861338907799
Energy: 0.7981532931632838
Energy: 0.7109861338907799
Energy: 0.7981532931625477
Energy: 0.7109861338907799
Energy: 0.7727198373736779
Energy: 0.7171436504844638
Energy: 0.7727198373736779
Energy: 0.7179124194695498
Energy: 0.7727198373736779
Energy: 0.717411579264187

minimum gb energy = 0.697062528363118 eV
minimum distance =  2.41925845620873 Angstroms
sigma value = 17


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

Energy: 0.7756121884570027
Energy: 0.7352894793044013
Energy: 0.7756121884570027
Energy: 0.7352894793044013
Energy: 0.7756121884570027
Energy: 0.7352894793044013
Energy: 0.706813155909867
Energy: 0.7070938392423788
Energy: 0.706813155909867
Energy: 0.7070938392413378
Energy: 0.706813155909867
Energy: 0.7070938392413378
Energy: 0.7467851976819111
Energy: 0.8454767102015049
Energy: 0.7467851976746246
Energy: 0.8454767102015049
Energy: 0.7467851976673382
Energy: 0.8454767102015049
Energy: 0.6602828873039974
Energy: 0.8463399933302118
Energy: 0.6602828873050384
Energy: 0.8463399933302118
Energy: 0.6602828873039974
Energy: 0.8463399933302118
Energy: 0.794214756466387
Energy: 0.8045926918222263
Energy: 0.7942147555237296
Energy: 0.8045926918222263
Energy: 0.7942147534063699
Energy: 0.8045926918211852
Energy: 0.7627778848947439
Energy: 0.8129874842898005
Energy: 0.7627778848947439
Energy: 0.8129874842898005
Energy: 0.7627778848947439
Energy: 0.8129874842898005
Energy: 0.7704441988678887
Energy: 0.6991140800476379
Energy: 0.7704441988678887
Energy: 0.6991140800476379
Energy: 0.7704441988678887
Energy: 0.6991140800476379
Energy: 0.6599922050032302
Energy: 0.8080230068806084
Energy: 0.6599922050032302
Energy: 0.8080230068806084
Energy: 0.6599922050032302
Energy: 0.8080230068806084
Energy: 0.8050857891513933
Energy: 0.705596620603457
Energy: 0.8050857891513933
Energy: 0.705596620603457
Energy: 0.8050857891513933
Energy: 0.705596620603457
Energy: 0.7561201290847837
Energy: 0.7068994778023205
Energy: 0.7561201290847837
Energy: 0.7068994778023205
Energy: 0.7561201290847837
Energy: 0.7068994778023205
Energy: 0.7463245929975652
Energy: 0.6961928835883328
Energy: 0.7463245929965242
Energy: 0.6961928835883328
Energy: 0.7463245929975652
Energy: 0.6961928835883328
Energy: 0.7602694001244262
Energy: 0.7070315711538857
Energy: 0.7602694001181806
Energy: 0.7070315711538857
Energy: 0.7602694001025785
Energy: 0.7070315711538857
Energy: 0.6596824507307572
Energy: 0.8145876516864552
Energy: 0.6596824507307572
Energy: 0.8145876516864552
Energy: 0.6596824507307572
Energy: 0.8145876516864552
Energy: 0.7561301182961584
Energy: 0.8153676380367938
Energy: 0.7561301182961584
Energy: 0.8153676380367938
Energy: 0.7561301182961584
Energy: 0.8153676380378347
Energy: 0.762325548091807
Energy: 0.692154800506795
Energy: 0.762325548091807
Energy: 0.692154800506795
Energy: 0.762325548091807
Energy: 0.692154800506795
Energy: 0.7626101754864131
Energy: 0.8215409989381788
Energy: 0.762610175487454
Energy: 0.8215409989392196
Energy: 0.7626101754864131
Energy: 0.8215409989392196
Energy: 0.7549084206480233
Energy: 0.7536048528496282
Energy: 0.7549084206480233
Energy: 0.7536048528496282
Energy: 0.7549084206480233
Energy: 0.7536048528496282

minimum gb energy = 0.6596824507307572 eV
minimum distance =  2.34349562761608 Angstroms
sigma value = 17


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

Energy: 0.6855388233310284
Energy: 0.6645150600668234
Energy: 0.6855388233310284
Energy: 0.6645150600668234
Energy: 0.6855388233310284
Energy: 0.6645150600664214
Energy: 0.6749445986334527
Energy: 0.6401746892069741
Energy: 0.6749445986330508
Energy: 0.6401746892069741
Energy: 0.6749445986334527
Energy: 0.6401746892069741
Energy: 0.7016517418881464
Energy: 0.6955832119978026
Energy: 0.7016517418877444
Energy: 0.6955832119982046
Energy: 0.7016517418881464
Energy: 0.6955832119978026
Energy: 0.6208149693515397
Energy: 0.7203798787797812
Energy: 0.6208149693515397
Energy: 0.7203798787801831
Energy: 0.6208149693515397
Energy: 0.7203798787801831
Energy: 0.6699481380499273
Energy: 0.6407149288255917
Energy: 0.6699481380499273
Energy: 0.6407149288252079
Energy: 0.6699481380499273
Energy: 0.6407149288255917
Energy: 0.7242134828367722
Energy: 0.6504494662540589
Energy: 0.7242134828367722
Energy: 0.6504494662536568
Energy: 0.7242134828363702
Energy: 0.6504494662540589
Energy: 0.6758127969737453
Energy: 0.688799310836085
Energy: 0.6758127969737453
Energy: 0.688799310836085
Energy: 0.6758127969737453
Energy: 0.688799310836085
Energy: 0.7016552315039318
Energy: 0.7607269501012618
Energy: 0.7016552314565175
Energy: 0.7607269501016637
Energy: 0.7016552313339715
Energy: 0.7607269501012618
Energy: 0.7078054735718144
Energy: 0.7164389830904332
Energy: 0.7078054735718144
Energy: 0.7164389830904332
Energy: 0.7078054735718144
Energy: 0.7164389830904332
Energy: 0.6748886367756456
Energy: 0.6054641103584392
Energy: 0.6748886367756456
Energy: 0.6054641103584392
Energy: 0.6748886367756456
Energy: 0.6054641103584392
Energy: 0.62077561928042
Energy: 0.707192505462521
Energy: 0.62077561928042
Energy: 0.7071922025239891
Energy: 0.62077561928042
Energy: 0.7071915309009502
Energy: 0.7530239881163581
Energy: 0.6624325647745569
Energy: 0.7530239881167601
Energy: 0.6624325647749589
Energy: 0.7530239881163581
Energy: 0.6624325647749589
Energy: 0.6913712731604571
Energy: 0.6609584309296538
Energy: 0.6913712731604571
Energy: 0.6609584309292519
Energy: 0.6913712731604571
Energy: 0.6609584309296538
Energy: 0.681482609305399
Energy: 0.6667174950479059
Energy: 0.681482609305399
Energy: 0.6667174950483078
Energy: 0.681482609305801
Energy: 0.6667174950479059
Energy: 0.7119151581578965
Energy: 0.662419238549522
Energy: 0.7119151581578965
Energy: 0.6624192385491201
Energy: 0.7119151581574945
Energy: 0.662419238549522
Energy: 0.6206387630534255
Energy: 0.7033751384020756
Energy: 0.6206387630530237
Energy: 0.7033751384020756
Energy: 0.6206387630534255
Energy: 0.7033751384020756
Energy: 0.6918990829369893
Energy: 0.7144225482450551
Energy: 0.6918990829373914
Energy: 0.7144225482450551
Energy: 0.6918990829373914
Energy: 0.7144225482454571
Energy: 0.7410832946025142
Energy: 0.7028407758205691
Energy: 0.7410832946025142
Energy: 0.7028407758205691
Energy: 0.7410832946025142
Energy: 0.702840775820971
Energy: 0.7011633198400345
Energy: 0.704150180470397
Energy: 0.7011633198380246
Energy: 0.704150180469995
Energy: 0.7011633198372207
Energy: 0.704150180469995
Energy: 0.6910049799827255
Energy: 0.6856184410946793
Energy: 0.6910049799823236
Energy: 0.6856184410946793
Energy: 0.6910049799827255
Energy: 0.6856184410946793
Energy: 0.7012113025234784
Energy: 0.7040537399928197
Energy: 0.7012113025234784
Energy: 0.7040537399928197
Energy: 0.7012113025222725
Energy: 0.7040537399928197
Energy: 0.740760530378807
Energy: 0.7030472312393662
Energy: 0.740760530378807
Energy: 0.7030472312393662
Energy: 0.740760530378807
Energy: 0.7030472312393662
Energy: 0.6916786692618827
Energy: 0.7143704436081586
Energy: 0.6916786692622848
Energy: 0.7143704436081586
Energy: 0.6916786692618827
Energy: 0.7143704436081586
Energy: 0.620925887005114
Energy: 0.7569673620458619
Energy: 0.620925887005114
Energy: 0.7569673620454599
Energy: 0.620925887005114
Energy: 0.7569673620458619
Energy: 0.7124070497358171
Energy: 0.6622204633772688
Energy: 0.7124070497358171
Energy: 0.6622204633772688
Energy: 0.7124070497358171
Energy: 0.6622204633776708
Energy: 0.6813544101735105
Energy: 0.6674874428845774
Energy: 0.6813544101739124
Energy: 0.6674874428845774
Energy: 0.6813544101735105
Energy: 0.6674874428845774
Energy: 0.6915887341905413
Energy: 0.6605248842292007
Energy: 0.6915887341905413
Energy: 0.6605248842287988
Energy: 0.6915887341905413
Energy: 0.6605248842287988
Energy: 0.7531836914771718
Energy: 0.662517780954048
Energy: 0.7531836914771718
Energy: 0.662517780954048
Energy: 0.7531836914771718
Energy: 0.66251778095445
Energy: 0.6209531298873647
Energy: 0.7072201636162379
Energy: 0.6209531298873647
Energy: 0.7072199806716075
Energy: 0.6209531298873647
Energy: 0.7072196180842766
Energy: 0.6749408208869507
Energy: 0.7162681537450252
Energy: 0.6749408208869507
Energy: 0.7162681537450252
Energy: 0.6749408208869507
Energy: 0.7162681537450252
Energy: 0.7079573958845977
Energy: 0.7167401808276315
Energy: 0.7079573958845977
Energy: 0.7167401808276315
Energy: 0.7079573958845977
Energy: 0.7167401808276315
Energy: 0.7017909163162999
Energy: 0.7599999793544348
Energy: 0.7017909162118424
Energy: 0.7599999793544348
Energy: 0.7017909160354505
Energy: 0.7599999793544348
Energy: 0.6759133454626209
Energy: 0.6890839406976215
Energy: 0.6759133454626209
Energy: 0.6890839406976215
Energy: 0.6759133454626209
Energy: 0.6890839406976215
Energy: 0.723553614706908
Energy: 0.6587824169236167
Energy: 0.723553614706908
Energy: 0.6587824169232147
Energy: 0.7235536147065061
Energy: 0.6587824169232147
Energy: 0.669940614112444
Energy: 0.6402128375494863
Energy: 0.669940614112444
Energy: 0.6402128375490843
Energy: 0.669940614112444
Energy: 0.6402128375490843
Energy: 0.6207389156649112
Energy: 0.7203734377855816
Energy: 0.6207389156649112
Energy: 0.7203734377855816
Energy: 0.6207389156649112
Energy: 0.7203734377851797
Energy: 0.7017101665879643
Energy: 0.6957276835365604
Energy: 0.7017101665879643
Energy: 0.6957276835365604
Energy: 0.7017101665879643
Energy: 0.6957276835365604
Energy: 0.6745967838358939
Energy: 0.6483994294198494
Energy: 0.6745967838358939
Energy: 0.6483994294198494
Energy: 0.6745967838358939
Energy: 0.6483994294198494
Energy: 0.6855388233306264
Energy: 0.6645150600664214
Energy: 0.6855388233310284
Energy: 0.6645150600664214
Energy: 0.6855388233310284
Energy: 0.6645150600668234
Energy: 0.6749445986334527
Energy: 0.6401746892069741
Energy: 0.6749445986334527
Energy: 0.6401746892065722
Energy: 0.6749445986334527
Energy: 0.6401746892069741
Energy: 0.7016517418877444
Energy: 0.6955832119982046
Energy: 0.7016517418877444
Energy: 0.6955832119982046
Energy: 0.7016517418877444
Energy: 0.6955832119982046
Energy: 0.6208149693515397
Energy: 0.7394023528581652
Energy: 0.6208149693511378
Energy: 0.7394023528581652
Energy: 0.6208149693511378
Energy: 0.7394023528581652
Energy: 0.6699481380499273
Energy: 0.6407149288263956
Energy: 0.6699481380499273
Energy: 0.6407149288263956
Energy: 0.6699481380499273
Energy: 0.6407149288263956

minimum gb energy = 0.6054641103584392 eV
minimum distance =  2.38293886147126 Angstroms
sigma value = 57


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

Energy: 0.6301823950877989
Energy: 0.614446174737238
Energy: 0.6301823950871445
Energy: 0.614446174737238
Energy: 0.6301823950877989
Energy: 0.614446174737238
Energy: 0.6148341419249176
Energy: 0.5982371315725528
Energy: 0.6148341419249176
Energy: 0.5982371315718982
Energy: 0.6148341419249176
Energy: 0.5982371315718982
Energy: 0.718888182024841
Energy: 0.6476640798179795
Energy: 0.7188881820254955
Energy: 0.6476640798179795
Energy: 0.718888182024841
Energy: 0.6476640798173251
Energy: 0.5840514031279174
Energy: 0.6791677518212655
Energy: 0.5840514031279174
Energy: 0.6791677518212655
Energy: 0.5840514031279174
Energy: 0.6791677518212655
Energy: 0.6163541837999006
Energy: 0.5625836333064265
Energy: 0.6163541837678299
Energy: 0.5625836333070809
Energy: 0.616354183797937
Energy: 0.5625836333070809
Energy: 0.6579653386501817
Energy: 0.6052708145508485
Energy: 0.6579653386501817
Energy: 0.605270814550194
Energy: 0.6579653386501817
Energy: 0.6052708145508485
Energy: 0.6015280961536387
Energy: 0.6594292400531655
Energy: 0.6015280961542931
Energy: 0.6594292400531655
Energy: 0.6015280961542931
Energy: 0.6594292400531655
Energy: 0.6861408795262135
Energy: 0.6444729854004461
Energy: 0.6861408795262135
Energy: 0.644472984266697
Energy: 0.686140879526868
Energy: 0.6444729830668728
Energy: 0.6209904597876904
Energy: 0.6068064859430792
Energy: 0.6209904597876904
Energy: 0.6068064859424247
Energy: 0.6209904597876904
Energy: 0.6068064859430792
Energy: 0.6203133470685306
Energy: 0.634434536868326
Energy: 0.6203133470685306
Energy: 0.634434536868326
Energy: 0.6203133470685306
Energy: 0.634434536868326
Energy: 0.573512185708616
Energy: 0.6947554081225673
Energy: 0.573512185708616
Energy: 0.6947554081199493
Energy: 0.573512185708616
Energy: 0.6947554081225673
Energy: 0.6466586255117335
Energy: 0.5781203941604717
Energy: 0.6466586255117335
Energy: 0.5781203941598172
Energy: 0.6466586255117335
Energy: 0.5781203941598172
Energy: 0.6181093000388442
Energy: 0.665946606768996
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Energy: 0.665946606768996
Energy: 0.6181093000388442
Energy: 0.665946606768996
Energy: 0.5844114413023858
Energy: 0.6512884979453933
Energy: 0.5844114413017312
Energy: 0.6512884979453933
Energy: 0.5844114413023858
Energy: 0.6512884979460478
Energy: 0.6896982663478727
Energy: 0.6178462082862459
Energy: 0.6896982663478727
Energy: 0.6178462082862459
Energy: 0.6896982663478727
Energy: 0.6178462082862459
Energy: 0.6176065024815666
Energy: 0.613729573315474
Energy: 0.6176065024815666
Energy: 0.613729573315474
Energy: 0.6176065024815666
Energy: 0.613729573315474
Energy: 0.6404127498677351
Energy: 0.7000346755527634
Energy: 0.6404127498677351
Energy: 0.700034675552109
Energy: 0.6404127498677351
Energy: 0.700034675552109
Energy: 0.6528427463832694
Energy: 0.6176780939319156
Energy: 0.652842746382615
Energy: 0.6176780939312613
Energy: 0.652842746373452
Energy: 0.6176780939319156
Energy: 0.5937340052602169
Energy: 0.6593620212248259
Energy: 0.5937340052608714
Energy: 0.6593620212248259
Energy: 0.5937340052608714
Energy: 0.6593620212248259
Energy: 0.5845504274092858
Energy: 0.6753521511023718
Energy: 0.5845504274092858
Energy: 0.6753521511023718
Energy: 0.5845504274099402
Energy: 0.6753521511023718
Energy: 0.6758920290267268
Energy: 0.6489383870174721
Energy: 0.6758920290260724
Energy: 0.6489383870174721
Energy: 0.6758920290260724
Energy: 0.6489383870174721
Energy: 0.5728046567856423
Energy: 0.6594231163829447
Energy: 0.5728046567849877
Energy: 0.6594231163822901
Energy: 0.5728046567849877
Energy: 0.6594231163822901
Energy: 0.6385435272816645
Energy: 0.6485188181261917
Energy: 0.6385435272816645
Energy: 0.6485188181261917
Energy: 0.6385435272816645
Energy: 0.6485188181261917
Energy: 0.6525662606272609
Energy: 0.8196326264527509
Energy: 0.6525662606266064
Energy: 0.8196326264507875
Energy: 0.6525662606272609
Energy: 0.8196326264481695
Energy: 0.6407365156487577
Energy: 0.7884907681811942
Energy: 0.6407365139955706
Energy: 0.7884907681811942
Energy: 0.6407365083896279
Energy: 0.7884907681811942
Energy: 0.6168118825219308
Energy: 0.6473963692671443
Energy: 0.6168118825219308
Energy: 0.6473963692664899
Energy: 0.6168118825213059
Energy: 0.6473963692671443
Energy: 0.5835450080638283
Energy: 0.6598989815471593
Energy: 0.5835450080638283
Energy: 0.6598989815425779
Energy: 0.5835450080638283
Energy: 0.6598989815491229

minimum gb energy = 0.5625836333064265 eV
minimum distance =  2.36200750768247 Angstroms
sigma value = 43


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

Energy: 0.6021233966805183
Energy: 0.5616050068326761
Energy: 0.6021233966790877
Energy: 0.5616050068326761
Energy: 0.6021233966790877
Energy: 0.5616050068326761
Energy: 0.6143414138990387
Energy: 0.5708360417031195
Energy: 0.6143414138990387
Energy: 0.5708360417031195
Energy: 0.6143414138990387
Energy: 0.5708360417031195
Energy: 0.6069920077615898
Energy: 0.6080389986687733
Energy: 0.6069920077615898
Energy: 0.6080389986687733
Energy: 0.6069920077615898
Energy: 0.6080389986687733
Energy: 0.5730306821600405
Energy: 0.5902548031060475
Energy: 0.5730306821595635
Energy: 0.5902548031060475
Energy: 0.5730306821600405
Energy: 0.5902548031060475
Energy: 0.6157648180436209
Energy: 0.5421027034309336
Energy: 0.6157648180440979
Energy: 0.5421027034309336
Energy: 0.6157648180440979
Energy: 0.5421027034314105
Energy: 0.5919047822307477
Energy: 0.5516063516810826
Energy: 0.5919047822307477
Energy: 0.5516063516810826
Energy: 0.5919047822307477
Energy: 0.5516063516810826
Energy: 0.5562488308493211
Energy: 0.5772898393098537
Energy: 0.5562488308493211
Energy: 0.5772898393098537
Energy: 0.5562488308493211
Energy: 0.5772898393098537
Energy: 0.6139001988806938
Energy: 0.5318139806226484
Energy: 0.6139001988811705
Energy: 0.5318139806226484
Energy: 0.6139001988806938
Energy: 0.5318139806226484
Energy: 0.5821888185359883
Energy: 0.5433384172153601
Energy: 0.5821888185359883
Energy: 0.5433384172153601
Energy: 0.5821888185359883
Energy: 0.5433384172153601
Energy: 0.5566142759242708
Energy: 0.5506072340060237
Energy: 0.5566142759242708
Energy: 0.5506072340060237
Energy: 0.5566142759242708
Energy: 0.5506072340060237
Energy: 0.672418227805444
Energy: 0.6012215320486685
Energy: 0.6724182278059209
Energy: 0.6012215320486685
Energy: 0.672418227805444
Energy: 0.6012215320491452
Energy: 0.5323864652513406
Energy: 0.5447817632133993
Energy: 0.5323864652513406
Energy: 0.544781763214353
Energy: 0.5323864652513406
Energy: 0.5447817632138763
Energy: 0.5563011690380353
Energy: 0.530280776385322
Energy: 0.5563011690375584
Energy: 0.530280776385322
Energy: 0.5563011690375584
Energy: 0.530280776385322
Energy: 0.6153742299427892
Energy: 0.5979278050546302
Energy: 0.6153742299427892
Energy: 0.5979278050546302
Energy: 0.6153742299427892
Energy: 0.5979278050546302
Energy: 0.5493691974973816
Energy: 0.5431166981832337
Energy: 0.5493691974973816
Energy: 0.5431166981832337
Energy: 0.5493691974973816
Energy: 0.5431166981832337
Energy: 0.5783403322416054
Energy: 0.5711856271055729
Energy: 0.5783403322416054
Energy: 0.5711856271055729
Energy: 0.5783403322411286
Energy: 0.5711856271055729
Energy: 0.5590716015524858
Energy: 0.5906451255890003
Energy: 0.5590716015529628
Energy: 0.5906451255890003
Energy: 0.5590716015524858
Energy: 0.5906451255890003
Energy: 0.5671394244172643
Energy: 0.5435785301034468
Energy: 0.5671394244172643
Energy: 0.5435785301034468
Energy: 0.5671394244172643
Energy: 0.5435785301034468
Energy: 0.5526709929880647
Energy: 0.5817665588356501
Energy: 0.5526709929880647
Energy: 0.5817665588356501
Energy: 0.5526709929885415
Energy: 0.5817665588356501
Energy: 0.5770410471126578
Energy: 0.5357153942370285
Energy: 0.5770410471131346
Energy: 0.5357153942370285
Energy: 0.5770410471126578
Energy: 0.5357153942370285
Energy: 0.6025861006797929
Energy: 0.5581330794542024
Energy: 0.6025861006797929
Energy: 0.5581330794542024
Energy: 0.6025861006797929
Energy: 0.5581330794546793
Energy: 0.5720578161517417
Energy: 0.5633471530001422
Energy: 0.5720578161517417
Energy: 0.5633471530006191
Energy: 0.5720578161517417
Energy: 0.5633471530001422
Energy: 0.5900673864898147
Energy: 0.6112140697498561
Energy: 0.5900673864902917
Energy: 0.6112140697498561
Energy: 0.5900673864898147
Energy: 0.6112140697498561
Energy: 0.5776166260282786
Energy: 0.5567843965990049
Energy: 0.5776166260282786
Energy: 0.5567843965990049
Energy: 0.5776166260282786
Energy: 0.556784396598528
Energy: 0.5251775976397713
Energy: 0.5329235891771622
Energy: 0.5251775976397713
Energy: 0.5329235891771622
Energy: 0.5251775976397713
Energy: 0.5329235891771622
Energy: 0.5374071643430686
Energy: 0.5881932697642076
Energy: 0.5374071643430686
Energy: 0.5881932697642076
Energy: 0.5374071643430686
Energy: 0.5881932697642076
Energy: 0.5940939401658824
Energy: 0.5375995276768213
Energy: 0.5796859584516764
Energy: 0.5375995276768213
Energy: 0.5940939401654054
Energy: 0.5375995276768213
Energy: 0.49504394508203825
Energy: 0.5933401795570062
Energy: 0.49504394508203825
Energy: 0.5933401795570062
Energy: 0.4950439450815613
Energy: 0.5933401795570062
Energy: 0.5372970441516643
Energy: 0.5565343192243701
Energy: 0.5372970441516643
Energy: 0.5565343192243701
Energy: 0.5372970441516643
Energy: 0.5565343192243701
Energy: 0.545992253203572
Energy: 0.5323978517572842
Energy: 0.545992253203572
Energy: 0.5323978517572842
Energy: 0.545992253203572
Energy: 0.5323978517572842
Energy: 0.5098687445785282
Energy: 0.7035733175151906
Energy: 0.5299190778915203
Energy: 0.7035733175161442
Energy: 0.5098687445785282
Energy: 0.7035733175151906
Energy: 0.5378450260349337
Energy: 0.5394817933812448
Energy: 0.5378450260349337
Energy: 0.5394817933812448
Energy: 0.5378450260349337
Energy: 0.539481793380768
Energy: 0.5294074864296081
Energy: 0.5331703460575937
Energy: 0.5294074864286543
Energy: 0.5331703460575937
Energy: 0.5294074864281774
Energy: 0.5331703460575937
Energy: 0.6241149202186967
Energy: 0.6010789350184952
Energy: 0.6241149202186967
Energy: 0.6010789350184952
Energy: 0.6241149202186967
Energy: 0.6010789350184952
Energy: 0.5383467051707176
Energy: 0.5243025518711298
Energy: 0.5383467051711944
Energy: 0.5243025518711298
Energy: 0.5383467051707176
Energy: 0.5243025518711298
Energy: 0.4813064136694164
Energy: 0.5937578081671497
Energy: 0.4813064136694164
Energy: 0.5937578081671497
Energy: 0.4813064136694164
Energy: 0.5937578081671497

minimum gb energy = 0.4813064136694164 eV
minimum distance =  2.32792718784021 Angstroms
sigma value = 81


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

Energy: 0.03701268614390721
Energy: 0.07001547751656825
Energy: 0.03701268614390721
Energy: 0.07001547751656825
Energy: 0.03701268614390721
Energy: 0.07001547751656825
Energy: 0.6041009634521997
Energy: 0.037913072753010826
Energy: 0.6041009634521997
Energy: 0.037913072753010826
Energy: 0.6041009634521997
Energy: 0.037913072754762966
Energy: 0.6040999222034034
Energy: 0.03792170439406132
Energy: 0.6040999222034034
Energy: 0.03792170439406132
Energy: 0.6040999222034034
Energy: 0.03792170439406132
Energy: 0.03701268614390721
Energy: 0.07001547751656825
Energy: 0.03701268614390721
Energy: 0.07001547751656825
Energy: 0.03701268614390721
Energy: 0.07001547751656825
Energy: 0.6041009634521997
Energy: 0.037913072754762966
Energy: 0.6041009634521997
Energy: 0.037913072754762966
Energy: 0.6041009634521997
Energy: 0.037913072754762966
Energy: 0.6040999222034034
Energy: 0.03792170439406132
Energy: 0.6040999222034034
Energy: 0.03792170439406132
Energy: 0.6040999222034034
Energy: 0.03792170439406132
Energy: 0.03701268614390721
Energy: 0.07001547751656825
Energy: 0.03701268614390721
Energy: 0.07001547751656825
Energy: 0.03701268614390721
Energy: 0.07001547751656825
Energy: 0.6041009634521997
Energy: 0.03791307275651512
Energy: 0.6041009634521997
Energy: 0.03791307275651512
Energy: 0.6041009634521997
Energy: 0.03791307275651512
Energy: 0.6040999222034034
Energy: 0.03792170439406132
Energy: 0.6040999222034034
Energy: 0.03792170439406132
Energy: 0.6040999222034034
Energy: 0.03792170439406132
Energy: 0.03701268614390721
Energy: 0.07001547751656825
Energy: 0.03701268614390721
Energy: 0.07001547751656825
Energy: 0.03701268614390721
Energy: 0.07001547751656825

minimum gb energy = 0.03701268614390721 eV
minimum distance =  2.54592759160711 Angstroms
sigma value = 3


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

Energy: 0.5805511402324854
Energy: 0.49101451334651186
Energy: 0.5805511402324854
Energy: 0.4910145133470362
Energy: 0.5805511402324854
Energy: 0.49101451334651186
Energy: 0.49238942465207347
Energy: 0.514301239484707
Energy: 0.49238942465207347
Energy: 0.514301239484707
Energy: 0.49238942465207347
Energy: 0.514301239484707
Energy: 0.5547998740783339
Energy: 0.5135450631966008
Energy: 0.5547998740783339
Energy: 0.5135450631966008
Energy: 0.522035859071194
Energy: 0.5135450631966008
Energy: 0.5179327497438522
Energy: 0.5008050068353987
Energy: 0.5179327497443765
Energy: 0.5008050068353987
Energy: 0.5179327497443765
Energy: 0.5008050068348744
Energy: 0.4453711776916147
Energy: 0.5142318847496828
Energy: 0.4453711776916147
Energy: 0.5142318847496828
Energy: 0.4453711776916147
Energy: 0.5142318847496828
Energy: 0.5240836705484995
Energy: 0.5246378921190983
Energy: 0.5240836705484995
Energy: 0.5246378921190983
Energy: 0.5240836705484995
Energy: 0.5246378921190983
Energy: 0.5203344081534449
Energy: 0.5107779685868872
Energy: 0.5203344081534449
Energy: 0.5107779685868872
Energy: 0.5203344081534449
Energy: 0.5107779685868872
Energy: 0.44047869621204816
Energy: 0.51575040634663
Energy: 0.4404786962125726
Energy: 0.5157504063476788
Energy: 0.4404786962125726
Energy: 0.5157504063476788
Energy: 0.5331150328058724
Energy: 0.5285817331043445
Energy: 0.5331150328058724
Energy: 0.5285817331043445
Energy: 0.5331150328058724
Energy: 0.5285817331043445
Energy: 0.4980122151639821
Energy: 0.4822035738562247
Energy: 0.4980122151639821
Energy: 0.4822035738562247
Energy: 0.4980122151639821
Energy: 0.4822035738562247
Energy: 0.4746348066262767
Energy: 0.5151298573297477
Energy: 0.4746348066262767
Energy: 0.5151298573297477
Energy: 0.4746348066262767
Energy: 0.5151298573297477
Energy: 0.5508008008981058
Energy: 0.5562917131372077
Energy: 0.5508008008975815
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Energy: 0.5508008008975815
Energy: 0.5562917131372077
Energy: 0.5193147709476749
Energy: 0.449352226389338
Energy: 0.5193147709476749
Energy: 0.449352226389338
Energy: 0.5193147709476749
Energy: 0.449352226389338
Energy: 0.4934865115741405
Energy: 0.5273699269001986
Energy: 0.4934865115741405
Energy: 0.5273699269001986
Energy: 0.4934865115741405
Energy: 0.5273699269001986
Energy: 0.5229341619704914
Energy: 0.5368866920285911
Energy: 0.522934161969967
Energy: 0.5368866920285911
Energy: 0.5229341619704914
Energy: 0.5368866920285911
Energy: 0.5251510414172974
Energy: 0.5914176805768184
Energy: 0.5251510414167732
Energy: 0.5914176805768184
Energy: 0.5251510414172974
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Energy: 0.5145806061620729
Energy: 0.5608421718278307
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Energy: 0.5608421718278307
Energy: 0.5145806061620729
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Energy: 0.5170167991880629
Energy: 0.5118577853483727
Energy: 0.5170167991880629
Energy: 0.5118577853478483
Energy: 0.5170167991880629
Energy: 0.5118577853483727
Energy: 0.5254786605940882
Energy: 0.6148391309210387
Energy: 0.5254786605940882
Energy: 0.6148391309210387
Energy: 0.5254786605940882
Energy: 0.6148391309210387
Energy: 0.4111522320949813
Energy: 0.5125351388899629
Energy: 0.4111521536803748
Energy: 0.5125351388904872
Energy: 0.4111518865208159
Energy: 0.5125351388904872
Energy: 0.5401291738857845
Energy: 0.5185543391502752
Energy: 0.5401291738863088
Energy: 0.5185543391502752
Energy: 0.5401291738863088
Energy: 0.5185543391502752
Energy: 0.5389048778119444
Energy: 0.5031874967974066
Energy: 0.5389048778119444
Energy: 0.5031874967974066
Energy: 0.5389048778119444
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Energy: 0.5210666987530713
Energy: 0.5128142264495583
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Energy: 0.5128142264495583
Energy: 0.5210666987530713
Energy: 0.5128142264500826
Energy: 0.527508917104173
Energy: 0.510189162857604
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Energy: 0.510189162857604
Energy: 0.527508917104173
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Energy: 0.5194934997393016
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Energy: 0.5194934997393016
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Energy: 0.5097796509732387
Energy: 0.5267750389454131
Energy: 0.5097796509732387
Energy: 0.5267750389454131
Energy: 0.5097796509732387
Energy: 0.5267750389454131
Energy: 0.5866982018885745
Energy: 0.4415154199368959
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Energy: 0.4415154199368959
Energy: 0.5233988259542492
Energy: 0.5366306782962262
Energy: 0.5233988259542492
Energy: 0.5366306782962262
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Energy: 0.5148254141241609
Energy: 0.4953811084873157
Energy: 0.5148254141246853
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Energy: 0.5148254141241609
Energy: 0.5870027958500846
Energy: 0.4772602082739321
Energy: 0.5870027958500846
Energy: 0.4772602082372405
Energy: 0.5870027958500846
Energy: 0.47726020814028625
Energy: 0.5330440940427897
Energy: 0.5331940043055307
Energy: 0.569268678399035
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Energy: 0.5567246328977383
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Energy: 0.47583533108175485
Energy: 0.5053891100065606
Energy: 0.47583533108175485
Energy: 0.5053891100065606
Energy: 0.47583533108175485
Energy: 0.5053891100065606
Energy: 0.5392127673493484
Energy: 0.5324265656560336
Energy: 0.5392127673493484
Energy: 0.5324265656560336
Energy: 0.5392127673493484
Energy: 0.5324265656560336

minimum gb energy = 0.4111518865208159 eV
minimum distance =  2.39623867267216 Angstroms
sigma value = 67


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

Energy: 0.7004064962867815
Energy: 0.6382937319070113
Energy: 0.7004064962867815
Energy: 0.6382937319070113
Energy: 0.7004064962867815
Energy: 0.6382937319070113
Energy: 0.6335959385956434
Energy: 0.6400104723020058
Energy: 0.6335959385956434
Energy: 0.6400104723020058
Energy: 0.6335959385963905
Energy: 0.6400104723020058
Energy: 0.6650717468325993
Energy: 0.6625800701404344
Energy: 0.6650717468325993
Energy: 0.6625800701404344
Energy: 0.6650717468325993
Energy: 0.6625800701404344
Energy: 0.6841187029986302
Energy: 0.6362010302153994
Energy: 0.6841187029986302
Energy: 0.6362010302153994
Energy: 0.6841187029986302
Energy: 0.6362010302153994
Energy: 0.5691165741050941
Energy: 0.6185974342985969
Energy: 0.5691165741050941
Energy: 0.6185974342985969
Energy: 0.5691165741050941
Energy: 0.6185974342985969
Energy: 0.6659354413372226
Energy: 0.6592380863796896
Energy: 0.6659354413372226
Energy: 0.6592380863796896
Energy: 0.6659354413372226
Energy: 0.6592380863796896
Energy: 0.6655885011791836
Energy: 0.6241122288759042
Energy: 0.6655885011791836
Energy: 0.6241122288759042
Energy: 0.6655885011791836
Energy: 0.6241122288759042
Energy: 0.6238763466931444
Energy: 0.6228423881698376
Energy: 0.6238763466931444
Energy: 0.6228423881698376
Energy: 0.6238763466931444
Energy: 0.6228423881698376
Energy: 0.6924362520701154
Energy: 0.7063925722613636
Energy: 0.6924362520701154
Energy: 0.7063925722613636
Energy: 0.6924362520701154
Energy: 0.7063925722613636
Energy: 0.6504205902189584
Energy: 0.5829549182148603
Energy: 0.6504205902189584
Energy: 0.5829549182156074
Energy: 0.6504205902189584
Energy: 0.5829549182156074
Energy: 0.6698821516382759
Energy: 0.6697394346543792
Energy: 0.6698821516382759
Energy: 0.6697394346543792
Energy: 0.6698821516382759
Energy: 0.6697394346543792
Energy: 0.6304436216487143
Energy: 0.6617191471009976
Energy: 0.6304436216487143
Energy: 0.6617191471009976
Energy: 0.6304436216487143
Energy: 0.6617191471009976
Energy: 0.6499482736818744
Energy: 0.6204435960667064
Energy: 0.6499482736818744
Energy: 0.6204435960667064
Energy: 0.6499482736818744
Energy: 0.6204435960667064
Energy: 0.6281224291522307
Energy: 0.6719181714903119
Energy: 0.6281224291522307
Energy: 0.6719181714910589
Energy: 0.6281224291522307
Energy: 0.6719181714910589
Energy: 0.6323160688631874
Energy: 0.6334377828922964
Energy: 0.6323160688631874
Energy: 0.6334377828922964
Energy: 0.6323160688639345
Energy: 0.6334377828922964
Energy: 0.6736236997194696
Energy: 0.6411190450672162
Energy: 0.6736236997194696
Energy: 0.6411190450672162
Energy: 0.6736236997194696
Energy: 0.6411190450672162
Energy: 0.6561189270114066
Energy: 0.6677283052158164
Energy: 0.6561189270114066
Energy: 0.6677283052158164
Energy: 0.6561189270114066
Energy: 0.6677283052158164
Energy: 0.6575551405297174
Energy: 0.6222606336631831
Energy: 0.6575551405304646
Energy: 0.6222606336624361
Energy: 0.6575551405304646
Energy: 0.6222606336624361
Energy: 0.6613628726601954
Energy: 0.6696841201824154
Energy: 0.6613628726594484
Energy: 0.6696841201824154
Energy: 0.6613628726594484
Energy: 0.6696841201824154
Energy: 0.7672988274729516
Energy: 0.6648676322714655
Energy: 0.7672988274729516
Energy: 0.6648676322714655
Energy: 0.7672988274729516
Energy: 0.6648676322714655
Energy: 0.6884892996737377
Energy: 0.6242421862689405
Energy: 0.6884892996737377
Energy: 0.6242421862689405
Energy: 0.6884892996737377
Energy: 0.6242421862689405
Energy: 0.6845154151505722
Energy: 0.7045378409332689
Energy: 0.684515415149825
Energy: 0.7045378409332689
Energy: 0.6845154151505722
Energy: 0.7045378409332689
Energy: 0.6188456516043994
Energy: 0.6644029900898527
Energy: 0.6188456516043994
Energy: 0.6644029900898527
Energy: 0.6188456516051466
Energy: 0.6644029900898527

minimum gb energy = 0.5691165741050941 eV
minimum distance =  2.39858270583136 Angstroms
sigma value = 33


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

Energy: 0.798283219828506
Energy: 0.712590215156879
Energy: 0.7982832198289799
Energy: 0.712590215156879
Energy: 0.7982832198289799
Energy: 0.712590215156879
Energy: 0.7150784525993936
Energy: 0.7748783028657759
Energy: 0.7150784525993936
Energy: 0.7748783028653019
Energy: 0.7150784525998568
Energy: 0.7748783028653019
Energy: 0.7612977048996744
Energy: 0.7462189009513297
Energy: 0.7612977048996744
Energy: 0.7462189009513297
Energy: 0.7612977048996744
Energy: 0.7462189009513297
Energy: 0.7609412376014298
Energy: 0.7303560836592168
Energy: 0.7609412376014298
Energy: 0.7303560836592168
Energy: 0.7609412376014298
Energy: 0.7303560836587427
Energy: 0.7215453508667703
Energy: 0.7320140902033647
Energy: 0.7215453508667703
Energy: 0.7320140902033647
Energy: 0.7215453508667703
Energy: 0.7320140902033647
Energy: 0.809768919532405
Energy: 0.7537689379108113
Energy: 0.8097689195319311
Energy: 0.7830766723859396
Energy: 0.8097689195319311
Energy: 0.7815420272124546
Energy: 0.714344861602615
Energy: 0.703158049103479
Energy: 0.714344861602615
Energy: 0.703158049103479
Energy: 0.714344861602615
Energy: 0.703158049103479
Energy: 0.766482148404971
Energy: 0.7510811397259625
Energy: 0.766482148404971
Energy: 0.7510811397259625
Energy: 0.766482148404971
Energy: 0.7510811397259625
Energy: 0.7577522549428285
Energy: 0.7612504377513324
Energy: 0.7577522549428285
Energy: 0.7612504377513324
Energy: 0.7577522549428285
Energy: 0.7612504377513324
Energy: 0.7782311282975264
Energy: 0.7163782519927289
Energy: 0.7782311282975264
Energy: 0.7267942720856726
Energy: 0.7782311282975264
Energy: 0.7121798916125377
Energy: 0.7544609293128665
Energy: 0.7598479140569987
Energy: 0.7544609293128665
Energy: 0.7598479140569987
Energy: 0.7544609293123925
Energy: 0.7598479140569987
Energy: 0.7144851543919809
Energy: 0.7200255775896677
Energy: 0.7144851543919809
Energy: 0.7200255775896677
Energy: 0.7144851543924549
Energy: 0.7200255775896677
Energy: 0.7751951734163753
Energy: 0.7223499427661245
Energy: 0.7751951734163753
Energy: 0.7223499427661245
Energy: 0.7751951734163753
Energy: 0.7223499427661245
Energy: 0.7207970215033503
Energy: 0.7567500138191661
Energy: 0.7207970215033503
Energy: 0.7567500138191661
Energy: 0.7207970215033503
Energy: 0.7567500138191661
Energy: 0.7463589703416807
Energy: 0.7363977631997036
Energy: 0.7463589703412068
Energy: 0.7363977631997036
Energy: 0.7463589703416807
Energy: 0.7363977631997036
Energy: 0.7610941439268036
Energy: 0.7607201739562167
Energy: 0.7610941439268036
Energy: 0.7607201739562167
Energy: 0.7610941439268036
Energy: 0.7607201739562167
Energy: 0.6673294287375605
Energy: 0.7465653366240799
Energy: 0.6673294287375605
Energy: 0.7465653366240799
Energy: 0.6673294287375605
Energy: 0.7465653366240799
Energy: 0.7816238053398405
Energy: 0.8180797544456725
Energy: 0.7816238053398405
Energy: 0.8180797544456725
Energy: 0.7816238053398405
Energy: 0.8180797544456725
Energy: 0.7181835793988637
Energy: 0.7785898453371856
Energy: 0.7181835793988637
Energy: 0.7785898453376596
Energy: 0.7181835793988637
Energy: 0.7785898453376596
Energy: 0.7255604675511725
Energy: 0.7468373271617114
Energy: 0.7255604675511725
Energy: 0.7468373271617114
Energy: 0.7255604675511725
Energy: 0.7468373271617114
Energy: 0.7643922862509241
Energy: 0.7598406469331328
Energy: 0.7643922862509241
Energy: 0.7598406469331328
Energy: 0.7643922862509241
Energy: 0.7598406469331328
Energy: 0.7463358125512976
Energy: 0.7037684702422804
Energy: 0.7463358125517714
Energy: 0.7037684702422804
Energy: 0.7463358125512976
Energy: 0.7037684702422804
Energy: 0.7497306975666623
Energy: 0.7601453737082611
Energy: 0.7497306975666623
Energy: 0.7601453737082611
Energy: 0.7497306975666623
Energy: 0.7601453737082611
Energy: 0.7769516655019768
Energy: 0.7192707314421882
Energy: 0.7769516655019768
Energy: 0.7192707314421882
Energy: 0.7769516655019768
Energy: 0.7192707314421882
Energy: 0.7136090372490348
Energy: 0.7185274753959139
Energy: 0.7136090372490348
Energy: 0.7185274753959139
Energy: 0.7136090372490348
Energy: 0.7185274753959139
Energy: 0.7452137953319237
Energy: 0.7621751786471435
Energy: 0.7452137953319237
Energy: 0.7621751786471435
Energy: 0.7452137953319237
Energy: 0.7621751786471435
Energy: 0.7142009463007624
Energy: 0.7029093712629942
Energy: 0.7142009463012363
Energy: 0.7029093712629942
Energy: 0.7142009463007624
Energy: 0.7029093712629942
Energy: 0.7549857654128228
Energy: 0.8033582507757995
Energy: 0.7549857654128228
Energy: 0.8033582507757995
Energy: 0.7549857654128228
Energy: 0.8033582507753257
Energy: 0.7223687098618375
Energy: 0.7757475153942134
Energy: 0.7223687098618375
Energy: 0.7757475153937394
Energy: 0.7223687098618375
Energy: 0.7757475153937394
Energy: 0.716230210111076
Energy: 0.7014082428474766
Energy: 0.7162302101106021
Energy: 0.7014082428474766
Energy: 0.7162302101106021
Energy: 0.7014082428474766
Energy: 0.813842980477374
Energy: 0.8013323000806132
Energy: 0.813842980477374
Energy: 0.801332300081087
Energy: 0.813842980477374
Energy: 0.801332300081087
Energy: 0.727213643805546
Energy: 0.7467258651514656
Energy: 0.7272136438050721
Energy: 0.7467258651514656
Energy: 0.727213643805546
Energy: 0.7467258651514656
Energy: 0.76159222043665
Energy: 0.7556468267806454
Energy: 0.76159222043665
Energy: 0.7556468267020007
Energy: 0.76159222043665
Energy: 0.7556468264561245
Energy: 0.74441727635141
Energy: 0.7323815556435564
Energy: 0.74441727635141
Energy: 0.7323815556430826
Energy: 0.74441727635141
Energy: 0.7323815556430826
Energy: 0.7203640694747561
Energy: 0.7465983144474712
Energy: 0.7203640694747561
Energy: 0.7465983144474712
Energy: 0.7203640694747561
Energy: 0.7465983144474712
Energy: 0.7999433920073958
Energy: 0.7127104159989838
Energy: 0.7999433920073958
Energy: 0.7127104159989838
Energy: 0.7999433920069218
Energy: 0.7127104159989838
Energy: 0.7183881601032599
Energy: 0.7373282212483627
Energy: 0.7183881601032599
Energy: 0.7373282212483627
Energy: 0.7183881601032599
Energy: 0.7373282212483627

minimum gb energy = 0.6673294287375605 eV
minimum distance =  2.37922840127791 Angstroms
sigma value = 41


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

Energy: 0.8932423480075482
Energy: 0.8487677071142473
Energy: 0.8932423480075482
Energy: 0.8487677071142473
Energy: 0.8932423480075482
Energy: 0.8487677071142473
Energy: 0.825621103702133
Energy: 0.8513337725697538
Energy: 0.825621103702133
Energy: 0.8513337725697538
Energy: 0.825621103702133
Energy: 0.8513337725697538
Energy: 0.9642043359313753
Energy: 0.8536632860990834
Energy: 0.9869594710914322
Energy: 0.8536632860990834
Energy: 0.9504011491439364
Energy: 0.8536632860990834
Energy: 0.8915652901025866
Energy: 0.8968349656387288
Energy: 0.8915652901025866
Energy: 0.8968349656387288
Energy: 0.8915652901025866
Energy: 0.8968349656387288
Energy: 0.8345224065050217
Energy: 0.8708304931126941
Energy: 0.8345224065050217
Energy: 0.8708304931126941
Energy: 0.8345224065037277
Energy: 0.8708304931126941
Energy: 0.9733265936662239
Energy: 0.9123522586334916
Energy: 0.9733265936662239
Energy: 0.9123522586334916
Energy: 0.9733265936662239
Energy: 0.9123522586334916
Energy: 0.8938090405342616
Energy: 0.8043916548268811
Energy: 0.8938090405342616
Energy: 0.8043916548268811
Energy: 0.8938090405342616
Energy: 0.8043916548268811
Energy: 0.8887664244822937
Energy: 0.8520447936910179
Energy: 0.8887664244822937
Energy: 0.8520447936910179
Energy: 0.8887664244822937
Energy: 0.8520447936910179
Energy: 0.8287872678108332
Energy: 0.8325696628438592
Energy: 0.8287872678108332
Energy: 0.8325696628438592
Energy: 0.8287872678108332
Energy: 0.8325696628438592
Energy: 0.8909831618283046
Energy: 0.8448220025795218
Energy: 0.8909831618283046
Energy: 0.8448220025795218
Energy: 0.8909831618283046
Energy: 0.8448220025795218
Energy: 0.828724882531289
Energy: 0.8538037796712916
Energy: 0.828724882531289
Energy: 0.8538037796712916
Energy: 0.828724882531289
Energy: 0.8538037796712916
Energy: 0.8758040563742994
Energy: 0.850942857886653
Energy: 0.8758040563742994
Energy: 0.850942857886653
Energy: 0.8758040563755787
Energy: 0.850942857886653
Energy: 0.8821733135727626
Energy: 0.8960757807437686
Energy: 0.8821733135727626
Energy: 0.8960757807437686
Energy: 0.8821733135727626
Energy: 0.8960757807437686
Energy: 0.8942783639359883
Energy: 0.8518778938952549
Energy: 0.8942783639359883
Energy: 0.8518778938952549
Energy: 0.8942783639359883
Energy: 0.8518778938952549

minimum gb energy = 0.8043916548268811 eV
minimum distance =  2.33191773239361 Angstroms
sigma value = 11


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

Energy: 1.011679946886625
Energy: 0.9849948190417445
Energy: 1.011679946886625
Energy: 0.984994819042313
Energy: 1.011679946886625
Energy: 0.984994819042313
Energy: 0.9272507470390233
Energy: 0.9547673598167381
Energy: 0.9272507470390233
Energy: 0.9547673598167381
Energy: 0.9272507470390233
Energy: 0.9547673598167381
Energy: 1.0203491052454832
Energy: 0.957741961463892
Energy: 1.0203491052454832
Energy: 0.957741961463892
Energy: 0.9368726484968403
Energy: 0.957741961463892
Energy: 0.9676653267903941
Energy: 0.9137820129815212
Energy: 0.9676653267903941
Energy: 0.9137820129815212
Energy: 0.9676653267909626
Energy: 0.9137820129815212
Energy: 0.9958821373313214
Energy: 0.9373083178368522
Energy: 0.9958821373313214
Energy: 0.9373083178368522
Energy: 0.9958821373313214
Energy: 0.9373083178368522
Energy: 0.9590099218861271
Energy: 0.9717791064855803
Energy: 0.9590099218861271
Energy: 0.9717791064855803
Energy: 0.9590099218861271
Energy: 0.9717791064855803
Energy: 0.9727240590027904
Energy: 0.9554507456660959
Energy: 0.9727240590027904
Energy: 0.9554507456655275
Energy: 0.9727240590027904
Energy: 0.9554507456655275
Energy: 0.9595150802070344
Energy: 0.9792341027732635
Energy: 0.9595150802070344
Energy: 0.9792341027732635
Energy: 0.9595150802070344
Energy: 0.9792341027732635
Energy: 0.9825481962995697
Energy: 0.981832691367346
Energy: 0.9825481962995697
Energy: 0.981832691367346
Energy: 0.9825481962995697
Energy: 0.981832691367346
Energy: 0.9466742865475998
Energy: 0.9768961223202818
Energy: 0.9466742865475998
Energy: 0.9768961223202818
Energy: 0.9466742865475998
Energy: 0.9768961223202818
Energy: 0.9560088757815723
Energy: 0.9598067845216093
Energy: 0.9560088757815723
Energy: 0.959806784521041
Energy: 0.9560088757815723
Energy: 0.9598067845216093
Energy: 0.9786326398503776
Energy: 0.9635010649617375
Energy: 0.9786326398526516
Energy: 0.9635010649617375
Energy: 0.9786326398509462
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Energy: 0.9824431068210437
Energy: 0.9372671015017178
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Energy: 0.9824431068210437
Energy: 0.9372671015017178
Energy: 0.9657926679491837
Energy: 0.981538892425224
Energy: 0.92727773792489
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Energy: 0.9272486816900057
Energy: 0.981538892425224
Energy: 0.9455952985348244
Energy: 0.9628571220681361
Energy: 0.9455952985348244
Energy: 0.9628571220681361
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Energy: 0.9628571220681361
Energy: 0.97366940959038
Energy: 0.9559530499098777
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Energy: 0.9559530813028504
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Energy: 0.9559527351095343
Energy: 0.9238102901329182
Energy: 0.954197466472226
Energy: 0.9238102901329182
Energy: 0.954197466472226
Energy: 0.9238102901329182
Energy: 0.954197466472226
Energy: 0.9832202172716783
Energy: 0.9885194531467286
Energy: 0.9832202172716783
Energy: 0.9885194531461601
Energy: 0.9832202172716783
Energy: 0.9885194531467286
Energy: 0.9540837009661435
Energy: 0.9030994778990187
Energy: 0.9540837009661435
Energy: 0.9030994778990187
Energy: 0.9540837009667118
Energy: 0.9030994778990187
Energy: 0.9612882319444053
Energy: 0.9539632971244932
Energy: 0.9612853379049702
Energy: 0.9539632971244932
Energy: 0.9612792351490894
Energy: 0.9539632971244932
Energy: 0.9396746138439963
Energy: 0.9415075961877745
Energy: 0.9396746138439963
Energy: 0.9415075961877745
Energy: 0.9396746138445647
Energy: 0.9415075961877745
Energy: 1.011562348613787
Energy: 0.9986477673278387
Energy: 1.011562348613787
Energy: 0.9986477673278387
Energy: 1.011562348613787
Energy: 0.9986477673278387
Energy: 0.9540442927787125
Energy: 0.9592930801232381
Energy: 0.9540442927787125
Energy: 0.9592930801232381
Energy: 0.9540442927787125
Energy: 0.9592930801232381
Energy: 1.0052973044400244
Energy: 0.9537317128685141
Energy: 1.0052973044400244
Energy: 0.9537317128685141
Energy: 1.0052973044400244
Energy: 0.9537317128685141
Energy: 0.957121926891961
Energy: 0.9665726277862896
Energy: 0.957121926891961
Energy: 0.9665726277862896
Energy: 0.957121926891961
Energy: 0.9665726277862896
Energy: 0.9380328220673985
Energy: 0.9534309522995807
Energy: 0.938032822067967
Energy: 0.9534309522995807
Energy: 0.938032822067967
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Energy: 0.958628232853659
Energy: 1.011780846735266
Energy: 0.958628232853659
Energy: 1.0117808467324234
Energy: 0.958628232853659
Energy: 1.0117808467261704
Energy: 0.9800051388008031
Energy: 0.9442346139245469
Energy: 0.9800051388008031
Energy: 0.9442346139245469
Energy: 0.9800051388008031
Energy: 0.9442346139245469
Energy: 0.9791037837935984
Energy: 0.9749749008481056
Energy: 0.9791037837935984
Energy: 0.9749749008481056
Energy: 0.9791037837935984
Energy: 0.9749749008481056
Energy: 0.9503304613419161
Energy: 0.9146416957078154
Energy: 0.9503304613419161
Energy: 0.9146416957078154
Energy: 0.9503304613419161
Energy: 0.9146416957078154
Energy: 0.9519082882848179
Energy: 1.008774138218693
Energy: 0.9519082882848179
Energy: 1.008774138218693
Energy: 0.9519082882848179
Energy: 1.008774138218693

minimum gb energy = 0.9030994778990187 eV
minimum distance =  2.30302290255921 Angstroms
sigma value = 57


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

Energy: 0.9216618924779685
Energy: 0.9212714229286564
Energy: 0.9216618924779685
Energy: 0.9212714229286564
Energy: 0.9216618924779685
Energy: 0.9212714229286564
Energy: 0.9152492939129548
Energy: 1.0079566227045678
Energy: 0.9152492939129548
Energy: 1.0079566227045678
Energy: 0.9152492939129548
Energy: 1.0079566227045678
Energy: 1.027939840510749
Energy: 0.9051645171426334
Energy: 1.027939840510749
Energy: 0.9051645171426334
Energy: 1.027939840510749
Energy: 0.9051645171426334
Energy: 0.9139021118407217
Energy: 1.0282285479129825
Energy: 0.9139021118417333
Energy: 1.0282285479119708
Energy: 0.9139021118407217
Energy: 0.9326056006348225
Energy: 1.028038402543184
Energy: 0.9051762248063879
Energy: 1.028038402543184
Energy: 0.9051762248063879
Energy: 1.028038402543184
Energy: 0.9051762248063879
Energy: 0.9151489943867585
Energy: 1.0037031273894954
Energy: 0.9151489943857468
Energy: 1.0037031273894954
Energy: 0.9151489943857468
Energy: 1.0037031273905068
Energy: 0.9216618924779685
Energy: 0.9212714229286564
Energy: 0.9216618924779685
Energy: 0.9212714229286564
Energy: 0.9216618924779685
Energy: 0.9212714229286564
Energy: 0.9152492939129548
Energy: 1.0079566227045678
Energy: 0.9152492939139664
Energy: 1.0079566227035561
Energy: 0.9152492939129548
Energy: 1.0079566227045678
Energy: 1.027939840510749
Energy: 0.9051645171426334
Energy: 1.027939840510749
Energy: 0.9051645171426334
Energy: 1.027939840510749
Energy: 0.9051645171426334
Energy: 0.9139021118417333
Energy: 0.9712281198242062
Energy: 0.9139021118417333
Energy: 0.9712281198242062
Energy: 0.9139021118417333
Energy: 0.9712281198242062
Energy: 1.028038402543184
Energy: 0.9051762248063879
Energy: 1.028038402543184
Energy: 0.9051762248063879
Energy: 1.028038402543184
Energy: 0.9051762248063879
Energy: 0.9151489943857468
Energy: 1.0037031273905068
Energy: 0.9151489943857468
Energy: 1.0037031273905068
Energy: 0.9151489943857468
Energy: 1.0037031273905068
Energy: 0.9216618924779685
Energy: 0.9212714229286564
Energy: 0.9216618924779685
Energy: 0.9212714229286564
Energy: 0.9216618924779685
Energy: 0.9212714229286564
Energy: 0.9152492939129548
Energy: 1.0079566227035561
Energy: 0.9152492939129548
Energy: 1.0079566227045678
Energy: 0.9152492939129548
Energy: 1.0079566227045678
Energy: 1.027939840510749
Energy: 0.9051645171426334
Energy: 1.027939840510749
Energy: 0.9051645171426334
Energy: 1.027939840510749
Energy: 0.9051645171426334
Energy: 0.9139021118417333
Energy: 0.9712281198242062
Energy: 0.9139021118407217
Energy: 0.9712281198242062
Energy: 0.9139021118407217
Energy: 0.9712281198242062
Energy: 1.028038402543184
Energy: 0.9051762248063879
Energy: 1.028038402543184
Energy: 0.9051762248063879
Energy: 1.028038402543184
Energy: 0.9051762248063879

minimum gb energy = 0.9051645171426334 eV
minimum distance =  2.33086087947133 Angstroms
sigma value = 9


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

Energy: 0.9965998752992978
Energy: 0.9542206150802097
Energy: 0.9965998752992978
Energy: 0.9542206150802097
Energy: 0.9965998752992978
Energy: 0.9542206150802097
Energy: 1.0030818674780633
Energy: 0.9687238177003218
Energy: 1.0030818674780633
Energy: 0.9687238177003218
Energy: 1.0030818674780633
Energy: 0.9687238177003218
Energy: 0.9631030934427992
Energy: 0.9599279617208838
Energy: 0.9799177874405491
Energy: 0.9599279617208838
Energy: 0.9799177874405491
Energy: 0.9599279617208838
Energy: 0.9315583090826877
Energy: 1.0638860261797645
Energy: 0.9315583090826877
Energy: 1.0638860261797645
Energy: 0.9315583090826877
Energy: 1.0638860261805905
Energy: 0.9855459386279758
Energy: 0.9761270239231965
Energy: 0.9855459386279758
Energy: 0.9761270239231965
Energy: 0.9855459386279758
Energy: 0.9761270239231965
Energy: 1.0028933774212394
Energy: 0.952379270195338
Energy: 1.0028933774212394
Energy: 0.952379270195338
Energy: 1.0028933774212394
Energy: 0.952379270195338
Energy: 0.9297544276799211
Energy: 1.0171153240192055
Energy: 0.9297544276799211
Energy: 1.0171153240192055
Energy: 0.9297544276799211
Energy: 1.0171153240192055
Energy: 0.9370912445489578
Energy: 1.0125723036203869
Energy: 0.9370912445489578
Energy: 1.0125723036203869
Energy: 0.9370912445489578
Energy: 1.0125723036203869
Energy: 1.0646988277352851
Energy: 0.9761309860723218
Energy: 1.0646988277352851
Energy: 0.9761309860723218
Energy: 1.064698827734459
Energy: 0.9761309860723218
Energy: 0.9320387740492293
Energy: 0.9986687939537734
Energy: 0.9320387740492293
Energy: 0.9986687939537734
Energy: 0.9320387740492293
Energy: 0.9986687939529474
Energy: 0.9861969004319867
Energy: 1.0047735280429675
Energy: 0.9861969004319867
Energy: 1.0047735280429675
Energy: 0.9861969004319867
Energy: 1.0047735280429675
Energy: 1.0648923588736576
Energy: 0.9531925686606412
Energy: 1.0648923588736576
Energy: 0.9531925686606412
Energy: 1.0648923588736576
Energy: 0.9531925686606412
Energy: 0.9313917360737904
Energy: 1.025870885131048
Energy: 0.9313917360737904
Energy: 1.025870885131048
Energy: 0.9313917360737904
Energy: 1.025870885131874
Energy: 0.9679196146907366
Energy: 0.9773302133193076
Energy: 0.9679196146899107
Energy: 0.9773302133193076
Energy: 0.9679196146899107
Energy: 0.9773302133193076
Energy: 1.0152361097747324
Energy: 0.9523276780789436
Energy: 1.0152361097747324
Energy: 0.9523276780789436
Energy: 1.0152361097747324
Energy: 0.9523276780789436
Energy: 0.9756115795679022
Energy: 1.0133133801530776
Energy: 0.9756115795679022
Energy: 1.0133133801530776
Energy: 0.9756115795679022
Energy: 1.0133133801530776
Energy: 0.9977276433301878
Energy: 1.029127407415052
Energy: 0.9977276433301878
Energy: 1.029127407415052
Energy: 0.9977276433301878
Energy: 1.029127407415052
Energy: 1.0887664834308373
Energy: 0.9520660747267681
Energy: 1.088766483429204
Energy: 0.9520660747267681
Energy: 1.0887664834209443
Energy: 0.9520660747267681
Energy: 0.9360740115566557
Energy: 0.9799565837295261
Energy: 0.9360740115566557
Energy: 0.9799565837295261
Energy: 0.9360740115566557
Energy: 0.9799565837295261
Energy: 0.9514671940825997
Energy: 0.9513239905726426
Energy: 0.9514671940825997
Energy: 0.9513239905726426
Energy: 0.9514671940825997
Energy: 0.9513239905726426
Energy: 1.0624286806649894
Energy: 0.9577792944949183
Energy: 1.0624286806658154
Energy: 0.9577792944949183
Energy: 1.0624286806658154
Energy: 0.9577792944949183

minimum gb energy = 0.9297544276799211 eV
minimum distance =  2.34016551403768 Angstroms
sigma value = 27


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

Energy: 0.9872224034913536
Energy: 0.9745925253982659
Energy: 0.9562756957069465
Energy: 0.9745925253982659
Energy: 0.9872224034913536
Energy: 0.9745925253982659
Energy: 0.9831933292172238
Energy: 0.9662713065145107
Energy: 0.9831933292172238
Energy: 0.9662713065145107
Energy: 0.9831933292172238
Energy: 0.9662713065145107
Energy: 0.9997687375818983
Energy: 0.9387428877948493
Energy: 0.9997687375818983
Energy: 0.938742887794153
Energy: 0.9997687375818983
Energy: 0.9387428877948493
Energy: 0.9761943786537864
Energy: 1.037948281577639
Energy: 0.9761943786537864
Energy: 1.0379482815769427
Energy: 0.9761943786537864
Energy: 1.0379482815769427
Energy: 0.9739761906006774
Energy: 0.9305378564649974
Energy: 0.9739761906006774
Energy: 0.9305378564649974
Energy: 0.9739761906006774
Energy: 0.9305378564649974
Energy: 0.9770524281230926
Energy: 0.9638418359504782
Energy: 0.9770524281230926
Energy: 0.9638418359504782
Energy: 0.9770524281230926
Energy: 0.9638418359504782
Energy: 0.957544381237658
Energy: 0.9987541101496944
Energy: 0.957544381237658
Energy: 0.9987541101489981
Energy: 0.957544381237658
Energy: 0.9987541101496944
Energy: 1.0671425377852994
Energy: 1.0338598629995586
Energy: 1.0671425377852994
Energy: 1.0338598629995586
Energy: 1.0671425377852994
Energy: 1.0338598629995586
Energy: 0.9350612546105854
Energy: 0.9562312155671245
Energy: 0.9350612546105854
Energy: 0.9562312155671245
Energy: 0.9350612546105854
Energy: 0.9562312155671245
Energy: 0.97563202476516
Energy: 0.936138627499983
Energy: 0.97563202476516
Energy: 0.936138627499983
Energy: 0.97563202476516
Energy: 0.936138627499983
Energy: 0.9760625496791353
Energy: 0.9455731583129654
Energy: 0.9760625496791353
Energy: 0.9455731583129654
Energy: 0.9760625496791353
Energy: 0.9455731583129654
Energy: 0.9969417345299947
Energy: 0.9611805279455882
Energy: 0.996941734533476
Energy: 0.9611805279448918
Energy: 0.9969417345209437
Energy: 0.9611805279448918
Energy: 1.0395653514499885
Energy: 1.067692329595751
Energy: 1.0395653514499885
Energy: 1.067692329595751
Energy: 1.0395653514499885
Energy: 1.067692329595751
Energy: 0.9562029944089204
Energy: 0.933618444607081
Energy: 0.9562029944089204
Energy: 0.933618444607081
Energy: 0.9562029944089204
Energy: 0.933618444607081
Energy: 0.9782059280173436
Energy: 0.9643003662640408
Energy: 0.9782059280166474
Energy: 0.9643003662640408
Energy: 0.9782059280173436
Energy: 0.9643003662640408
Energy: 0.9740798133098931
Energy: 0.9307290685522824
Energy: 0.9740798133098931
Energy: 0.9307290685522824
Energy: 0.9740798133098931
Energy: 0.9307290685522824
Energy: 0.9701556107393481
Energy: 1.0019011521453194
Energy: 0.9701556107393481
Energy: 1.0019011521453194
Energy: 0.9701556107393481
Energy: 1.0019011521453194
Energy: 1.0640624353352286
Energy: 0.9432734156206829
Energy: 1.0640624353352286
Energy: 0.9432734156206829
Energy: 1.0640624353352286
Energy: 0.9432734156206829
Energy: 0.9673156759840026
Energy: 0.9669810200995719
Energy: 0.9187865698750514
Energy: 0.9669810200995719
Energy: 0.9673156759840026
Energy: 0.9669810200995719
Energy: 0.9872224034913536
Energy: 0.9745925253982659
Energy: 0.9562756957069465
Energy: 0.9745925253982659
Energy: 0.9872224034913536
Energy: 0.9745925253982659
Energy: 0.9831933292172238
Energy: 0.9662713065145107
Energy: 0.9831933292172238
Energy: 0.9662713065145107
Energy: 0.9831933292172238
Energy: 0.9662713065145107
Energy: 0.9997687375818983
Energy: 0.9387428877948493
Energy: 0.9997687375818983
Energy: 0.938742887794153
Energy: 0.9997687375818983
Energy: 0.9387428877948493
Energy: 0.9761943786537864
Energy: 1.0379482815769427
Energy: 0.9761943786537864
Energy: 1.0379482815769427
Energy: 0.9761943786537864
Energy: 1.0379482815769427
Energy: 0.9739761906006774
Energy: 0.9305378564649974
Energy: 0.9739761906006774
Energy: 0.9305378564649974
Energy: 0.9739761906006774
Energy: 0.9305378564649974
Energy: 0.9770524281230926
Energy: 0.9638418359504782
Energy: 0.9770524281230926
Energy: 0.9638418359504782
Energy: 0.9770524281230926
Energy: 0.9638418359504782

minimum gb energy = 0.9187865698750514 eV
minimum distance =  2.33144808309033 Angstroms
sigma value = 19


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

Energy: 0.9666156824798489
Energy: 1.0745515063664905
Energy: 0.9666156824798489
Energy: 1.0745515063664905
Energy: 0.9666156824798489
Energy: 1.0745515063664905
Energy: 0.9608408797287694
Energy: 0.9258353409956378
Energy: 0.9608408797287694
Energy: 0.9258353409956378
Energy: 0.9608408797287694
Energy: 0.9258353409956378
Energy: 0.9525884688521177
Energy: 0.9038852492926303
Energy: 1.0100043720782894
Energy: 0.9038852492926303
Energy: 0.949796611658146
Energy: 0.9038852492926303
Energy: 0.9114448085908012
Energy: 0.9427725744749147
Energy: 0.9114448085908012
Energy: 0.9427725744749147
Energy: 0.9114448085908012
Energy: 0.9427725744743137
Energy: 0.9350499873823229
Energy: 0.961293245754182
Energy: 0.9350499873823229
Energy: 0.961293245754182
Energy: 0.9350499873823229
Energy: 0.961293245754182
Energy: 0.9826948875244719
Energy: 0.9354458291817627
Energy: 0.9826948875244719
Energy: 0.9354458291817627
Energy: 0.9826948875244719
Energy: 0.9354458291817627
Energy: 0.9020079556238999
Energy: 0.9497012407225836
Energy: 0.9020079556238999
Energy: 0.9497012407225836
Energy: 0.9020079556238999
Energy: 0.9497012407225836
Energy: 0.9247077250258621
Energy: 0.9602143733132569
Energy: 0.9247077250258621
Energy: 0.9602143733132569
Energy: 0.9247077250258621
Energy: 0.9602143733132569
Energy: 0.985301593902946
Energy: 0.9035626196034159
Energy: 0.9853015939023451
Energy: 0.9035626196034159
Energy: 0.985301593900542
Energy: 0.9035626196034159
Energy: 0.9406700048764491
Energy: 0.9458069546745167
Energy: 0.9406700048764491
Energy: 0.9458069546745167
Energy: 0.9406700048764491
Energy: 0.9458069546745167
Energy: 0.9130598327779745
Energy: 1.0211833294273518
Energy: 0.9130598327779745
Energy: 1.0211833294273518
Energy: 0.9130598327779745
Energy: 1.0211833294273518
Energy: 0.9451994655690272
Energy: 0.9018397045069718
Energy: 0.9451994655690272
Energy: 0.9018397045069718
Energy: 0.9451994655690272
Energy: 0.9018397045069718
Energy: 0.9111083792570305
Energy: 0.9236191232103784
Energy: 0.9111083792570305
Energy: 0.9236191232097911
Energy: 0.9111083792570305
Energy: 0.9236191232097911
Energy: 0.9263243136262181
Energy: 0.9676168177000439
Energy: 0.9263243136262181
Energy: 0.9676168177000439
Energy: 0.9263243136262181
Energy: 0.9676168177000439
Energy: 0.9713705114630444
Energy: 0.8970530472356322
Energy: 0.9713705114630444
Energy: 0.8970530472356322
Energy: 0.9713705114630444
Energy: 0.8970530472356322
Energy: 0.9706825466112878
Energy: 0.8968496218052187
Energy: 0.9706825466112878
Energy: 0.8968496218046176
Energy: 0.9706825466112878
Energy: 0.8968496218052187
Energy: 0.9104626095142735
Energy: 0.9314675933103529
Energy: 0.9104626095142735
Energy: 0.9314675933103529
Energy: 0.9104626095142735
Energy: 0.9314675933103529
Energy: 0.9519183480365085
Energy: 0.9464073746835695
Energy: 0.9519183480365085
Energy: 0.9464073746835695
Energy: 0.9519183480365085
Energy: 0.9464073746835695
Energy: 1.0206001382376964
Energy: 0.9355270718488436
Energy: 1.0206001382376964
Energy: 0.9355270718488436
Energy: 1.0206001382376964
Energy: 0.9355270718488436
Energy: 0.9106390302635436
Energy: 0.9806373775110677
Energy: 0.9106390302635436
Energy: 0.9806373775110677
Energy: 0.9106390302635436
Energy: 0.9806373775110677
Energy: 0.8886804322795523
Energy: 0.9776326534243768
Energy: 0.8886804322795523
Energy: 0.9776326534243768
Energy: 0.8886804322795523
Energy: 0.9776326534243768
Energy: 1.0076736413031853
Energy: 0.9031135078408083
Energy: 1.0076736354336022
Energy: 0.9031135078408083
Energy: 1.0076736194708056
Energy: 0.9031135078408083
Energy: 0.9692864190871279
Energy: 0.9492893569132183
Energy: 0.9692864190871279
Energy: 0.9492893569132183
Energy: 0.9692864190871279
Energy: 0.9492893569132183
Energy: 0.9660617047325029
Energy: 1.0360979594842172
Energy: 0.9660617047325029
Energy: 1.0360979594842172
Energy: 0.9660617047325029
Energy: 1.0360979594842172
Energy: 0.9763305325145756
Energy: 0.9008940619267455
Energy: 0.9763305325145756
Energy: 0.9008940619267455
Energy: 0.9763305325145756
Energy: 0.9008940619267455
Energy: 0.9235779538001259
Energy: 0.9115635339525366
Energy: 0.9235779538001259
Energy: 0.9115635339525366
Energy: 0.9235779538001259
Energy: 0.9115635339525366
Energy: 0.8952585617905466
Energy: 0.963155677674722
Energy: 0.8952585617905466
Energy: 0.9631556776170551
Energy: 0.8952585617905466
Energy: 0.9631556774524545
Energy: 0.9585870984152253
Energy: 0.9259824842139288
Energy: 0.9585870984152253
Energy: 0.9259824842139288
Energy: 0.9585870984152253
Energy: 0.9259824842139288
Energy: 0.9822754559710117
Energy: 0.9286046896023885
Energy: 0.9822754559710117
Energy: 0.9286046896023885
Energy: 0.9822754559710117
Energy: 0.9286046896023885

minimum gb energy = 0.8886804322795523 eV
minimum distance =  2.31340929579686 Angstroms
sigma value = 101


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

Energy: 0.9081828598615096
Energy: 0.9777898243999311
Energy: 0.9081828598615096
Energy: 0.9777898243999311
Energy: 0.9081828598615096
Energy: 0.9777898243999311
Energy: 0.9073481251514978
Energy: 0.8777804465169142
Energy: 0.9073481251514978
Energy: 0.8777804465169142
Energy: 0.9073481251514978
Energy: 0.8777804465169142
Energy: 0.8980875147383355
Energy: 0.8635906789674108
Energy: 0.8980875147378072
Energy: 0.8635906789674108
Energy: 0.8980875147383355
Energy: 0.8635906789674108
Energy: 0.8482084899312408
Energy: 0.9314091306148145
Energy: 0.8482084899312408
Energy: 0.9891984606733961
Energy: 0.8482084899312408
Energy: 0.9208254516964837
Energy: 0.8760886552972188
Energy: 0.8797353848740227
Energy: 0.8760886552972188
Energy: 0.8797353848740227
Energy: 0.8760886552972188
Energy: 0.8797353848740227
Energy: 0.9107582759106796
Energy: 0.8631188604844653
Energy: 0.9107582759101512
Energy: 0.8631188604849936
Energy: 0.9107582759106796
Energy: 0.8631188604849936
Energy: 0.8767295120142515
Energy: 0.8969212260257545
Energy: 0.8767295120142515
Energy: 0.8969212260257545
Energy: 0.8767295120142515
Energy: 0.8969212260257545
Energy: 0.8458993153082254
Energy: 1.0144705469404909
Energy: 0.8458993153082254
Energy: 0.9531631407033602
Energy: 0.8458993153082254
Energy: 0.897188150606265
Energy: 0.9119515075503649
Energy: 0.8668247554372838
Energy: 0.9119515075498366
Energy: 0.8668247554372838
Energy: 0.9119515075503649
Energy: 0.8668247554372838
Energy: 0.8741279876873006
Energy: 0.9475044352178307
Energy: 0.8741279876873006
Energy: 1.0064111457291116
Energy: 0.8741279876873006
Energy: 0.8979906728458368
Energy: 0.8448133032951312
Energy: 1.0466757731990537
Energy: 0.8448133032951312
Energy: 1.0466757485197438
Energy: 0.8448133032951312
Energy: 1.0466756298107565
Energy: 0.9363145555349943
Energy: 0.8746846894354346
Energy: 0.9363145555349943
Energy: 0.8746846894354346
Energy: 0.9363145555349943
Energy: 0.8746846894354346
Energy: 0.9431682120736661
Energy: 0.86344721590566
Energy: 0.9431682120741943
Energy: 0.86344721590566
Energy: 0.9431682120741943
Energy: 0.86344721590566
Energy: 0.9071910682261007
Energy: 0.9733156761528685
Energy: 0.9071910682266291
Energy: 1.0269657489942252
Energy: 0.9071910682266291
Energy: 0.9928792791855238
Energy: 0.9119837452624219
Energy: 0.8794789009171606
Energy: 0.9119837452624219
Energy: 0.8794789009171606
Energy: 0.9119837452618936
Energy: 0.8794789009171606
Energy: 0.898134483884259
Energy: 0.8617401090132358
Energy: 0.898134483884259
Energy: 0.8617401090132358
Energy: 0.898134483884259
Energy: 0.8617401090132358
Energy: 0.8423372280767896
Energy: 0.9195245860339661
Energy: 0.8423372280767896
Energy: 0.9195245860344945
Energy: 0.8423372280767896
Energy: 0.9195245860344945
Energy: 0.8442032800963017
Energy: 0.8799237647554172
Energy: 0.8442032800957733
Energy: 0.8799237647554172
Energy: 0.8442032800957733
Energy: 0.8799237647554172
Energy: 0.910494183552123
Energy: 0.8669757399560166
Energy: 0.910494183552123
Energy: 0.8669757399560166
Energy: 0.9104941835515946
Energy: 0.8669757399560166
Energy: 0.8702029996766073
Energy: 0.8746294731474802
Energy: 0.8702029996771357
Energy: 0.8746294731480085
Energy: 0.8702029996766073
Energy: 0.8746294731480085
Energy: 0.8432696893295026
Energy: 0.8653437340139706
Energy: 0.8432696893295026
Energy: 0.8656982892280841
Energy: 0.8432696893295026
Energy: 0.8655813611545142
Energy: 0.958062862303762
Energy: 0.8602411502605457
Energy: 0.9580628623032339
Energy: 0.8602411502605457
Energy: 0.9580628623032339
Energy: 0.8602411502605457
Energy: 0.9568203634115949
Energy: 0.8575129811320391
Energy: 0.9568203634115949
Energy: 0.8575129811320391
Energy: 0.9568203634115949
Energy: 0.8575129811320391
Energy: 0.8483644634905829
Energy: 0.8959308788241689
Energy: 0.8483644634900547
Energy: 0.896095046133614
Energy: 0.8483644634905829
Energy: 0.8957731449550452
Energy: 0.9373298334674771
Energy: 0.8791473059494448
Energy: 0.9373298334674771
Energy: 0.8791473059494448
Energy: 0.9373298334674771
Energy: 0.8791473059494448
Energy: 0.9101862599781122
Energy: 0.8616188246902687
Energy: 0.9101862599781122
Energy: 0.8616188246902687
Energy: 0.9101862599781122
Energy: 0.8616188246902687
Energy: 0.9120820300699634
Energy: 0.9385835461152391
Energy: 0.9120820300699634
Energy: 0.9385835461152391
Energy: 0.9120820300699634
Energy: 0.9385835461152391
Energy: 0.9112197377138925
Energy: 0.8963065054064746
Energy: 0.9112197377138925
Energy: 0.8963065054064746
Energy: 0.9112197377138925
Energy: 0.8963065054064746
Energy: 0.8946137612928017
Energy: 0.8729026401121832
Energy: 0.8959059287830453
Energy: 0.8729026401121832
Energy: 0.8958516317793362
Energy: 0.8729026401121832
Energy: 0.8400535968824392
Energy: 0.8961894362289917
Energy: 0.8400535968829674
Energy: 0.8961894362289917
Energy: 0.8400535968824392
Energy: 0.8961894362289917
Energy: 0.8430705134037527
Energy: 0.9622474032689502
Energy: 0.8430705134037527
Energy: 0.9622474032689502
Energy: 0.8430705134037527
Energy: 0.9622474032689502
Energy: 0.9556541643737853
Energy: 0.8602751305877719
Energy: 0.9556541644012445
Energy: 0.8602751305877719
Energy: 0.9556541644192065
Energy: 0.8602751305877719
Energy: 0.9572934091019631
Energy: 0.8575673645576913
Energy: 0.9572934091024915
Energy: 0.8575673645576913
Energy: 0.9572934091024915
Energy: 0.8575673645576913

minimum gb energy = 0.8400535968824392 eV
minimum distance =  2.33129320048853 Angstroms
sigma value = 33


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

Energy: 0.006740988552261895
Energy: 0.7514110058721011
Energy: 0.006740988552261895
Energy: 0.7514110058721011
Energy: 0.006740988552261895
Energy: 0.7514110058721011
Energy: 0.007234429677096789
Energy: 0.2491046507553892
Energy: 0.007234429677096789
Energy: 0.2491046507553892
Energy: 0.007234429677096789
Energy: 0.2491046507553892
Energy: 0.7517363567113671
Energy: 0.2492031399165959
Energy: 0.751736356711794
Energy: 0.2492031399165959
Energy: 0.7517363567113671
Energy: 0.2492031399165959
Energy: 0.007234429677096789
Energy: 0.2491046507553892
Energy: 0.007234429677096789
Energy: 0.2491046507553892
Energy: 0.007234429677096789
Energy: 0.2491046507553892

minimum gb energy = 0.006740988552261895 eV
minimum distance =  2.55463122878749 Angstroms
sigma value = 1