Model name: model_name=EAM_Dynamo_MendelevSordeletKramer_2007_CuZr__MO_120596890176_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.639085099101067
cohesive_energy=3.2833744382854766
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.014174951744230876
Energy: 0.34742493710322486
Energy: 0.3474249371046513
Energy: 0.014174951744230876
Energy: 0.3474249371046513
Energy: 0.34742493710322486
Energy: 0.014174951744230876
Energy: 0.34742493710322486
Energy: 0.3474249371046513
Energy: 0.014174951745657315
Energy: 0.34366069570706353
Energy: 0.017044095980863247
Energy: 0.3456447515519236
Energy: 0.34366069570706353
Energy: 0.017044095980863247
Energy: 0.34564475155335
Energy: 0.34366069570706353
Energy: 0.017044095980863247
Energy: 0.3456447515519236
Energy: 0.34366069570706353
Energy: 0.7477576799999591
Energy: 0.18833572291037365
Energy: 0.1883357229118001
Energy: 0.7475979597578744
Energy: 0.18833572291037365
Energy: 0.1883357229118001
Energy: 0.7476090832368727
Energy: 0.18833572291037365
Energy: 0.1883357229118001
Energy: 0.7476111720821107
Energy: 0.34366069570706353
Energy: 0.3456447515504972
Energy: 0.017044095980863247
Energy: 0.34366069570706353
Energy: 0.3456447515504972
Energy: 0.017044095980863247
Energy: 0.34366069570706353
Energy: 0.3456447515519236
Energy: 0.017044095980863247
Energy: 0.34366069570706353
Energy: 0.014174951744230876
Energy: 0.3474249371046513
Energy: 0.3474249371046513
Energy: 0.014174951744230876
Energy: 0.34742493710607775
Energy: 0.34742493710322486
Energy: 0.014174951744230876
Energy: 0.3474249371046513
Energy: 0.3474249371046513
Energy: 0.014174951744230876
Energy: 0.34366069570706353
Energy: 0.017044095980863247
Energy: 0.3456447515504972
Energy: 0.34366069570706353
Energy: 0.017044095980863247
Energy: 0.3456447515504972
Energy: 0.34366069570706353
Energy: 0.017044095980863247
Energy: 0.3456447515504972
Energy: 0.34366069570706353
Energy: 0.74760994626196
Energy: 0.18833572291037365
Energy: 0.6564332428675017
Energy: 0.747608736265405
Energy: 0.18833572291037365
Energy: 0.18833572291037365
Energy: 0.7475522507051817
Energy: 0.18833572291037365
Energy: 0.18833572291037365
Energy: 0.7476092256578567

minimum gb energy = 0.014174951744230876 eV
minimum distance =  2.23924491196303 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

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Energy: 1.0992059268656371
Energy: 1.0993354838590506
Energy: 0.7684635760275716
Energy: 1.099205926875071
Energy: 1.0993354838524116
Energy: 0.8446757039390622
Energy: 1.0992059268785652
Energy: 1.0993354838590506
Energy: 0.7684635760293187
Energy: 0.863170863798239
Energy: 0.8047025112866248
Energy: 1.0163234376754786
Energy: 0.8631708637888369
Energy: 0.8047025112764921
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Energy: 1.0163234376870092
Energy: 0.8631708637947451
Energy: 0.9717454614185645
Energy: 0.9939730087088842
Energy: 1.1051487267516096
Energy: 0.9660091909901475
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Energy: 1.1051487267530073
Energy: 0.971745461429396
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Energy: 1.1051487267526579
Energy: 0.9660091909852876
Energy: 1.0056432594502305
Energy: 1.102001175454268
Energy: 0.7690421075966117
Energy: 1.0056432594540423
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Energy: 0.98549524829329
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Energy: 1.005696735159577
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Energy: 0.769052075954635
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Energy: 1.0686792834005199
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Energy: 1.0686792834026164
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Energy: 0.9845381495170865
Energy: 1.0359204526893349
Energy: 0.8044431649386103
Energy: 0.9845381495093997
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Energy: 0.9845381495118455
Energy: 1.035920452699817
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Energy: 0.9845381495076527
Energy: 0.8976061741643612
Energy: 0.802292896476616
Energy: 1.0972749858889752
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Energy: 1.101057150485651
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Energy: 0.7680299181733378
Energy: 1.100926336662115
Energy: 1.0594735549016425
Energy: 0.994637089699044
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Energy: 1.0594735549113938
Energy: 0.9946370897032366
Energy: 0.7717528793462858
Energy: 1.0594735549134902
Energy: 0.7285514043514334
Energy: 1.0047203112393202
Energy: 0.9851331923541676
Energy: 0.72855140434165
Energy: 0.9719601086459964
Energy: 1.0591388005443494
Energy: 0.728551404348638
Energy: 1.0047203112316332
Energy: 0.9851331923590592
Energy: 0.7285514043465416
Energy: 1.0193073028968993
Energy: 0.7688929563210161
Energy: 1.071125795997112
Energy: 1.019307302895851
Energy: 0.7688929563213655
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Energy: 1.0193073028955015
Energy: 0.7688929563206668
Energy: 1.0711257959943168
Energy: 1.0193073028874653
Energy: 0.968533558788919
Energy: 0.9050655017403051
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Energy: 0.9685335587826298
Energy: 0.9050655017326181
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Energy: 0.9685335587840272
Energy: 0.9050655017294734
Energy: 0.9165930586054885
Energy: 0.9685335587875213
Energy: 0.8937827529589047
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Energy: 0.8051466572777025
Energy: 0.8937827529648448
Energy: 1.041590768605107
Energy: 0.8050277879769708
Energy: 0.8937827529802185
Energy: 1.0415907686106973
Energy: 0.8051466572756062
Energy: 0.893782752959953
Energy: 0.7684635760261741
Energy: 1.099205926862842
Energy: 1.0993354838604483
Energy: 0.8203656613401383
Energy: 1.099205926875071
Energy: 1.0993354838614964
Energy: 0.7684635760261741
Energy: 1.0992059268743721
Energy: 1.0993354838632434
Energy: 0.8203656613394394
Energy: 0.8631708638006849
Energy: 0.8047025112817331
Energy: 1.016323437674081
Energy: 0.8631708637891863
Energy: 0.8047025112768416
Energy: 1.016323437679322
Energy: 0.8631708637975403
Energy: 0.8047025112834801
Energy: 1.0163234376828163
Energy: 0.8631708638027813
Energy: 0.9264898324694625
Energy: 0.9939730087137759
Energy: 1.105148726756152
Energy: 0.9828620382599503
Energy: 0.9939730087218123
Energy: 1.105148726755104
Energy: 0.9264898324691131
Energy: 0.9939730087172699
Energy: 1.105148726751959
Energy: 0.9828620382477213
Energy: 1.0056432594561386
Energy: 1.102001175453569
Energy: 0.7690421075969611
Energy: 1.0056432594519775
Energy: 1.1020011754657664
Energy: 0.7690421075938164
Energy: 1.0056432594519775
Energy: 1.1020011754615737
Energy: 0.7690421075896237
Energy: 1.0056432594578857

minimum gb energy = 0.7285428683387185 eV
minimum distance =  2.34446538870333 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

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Energy: 0.8278944049618466
Energy: 0.8277882978136312
Energy: 0.9430555113269607
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minimum gb energy = 0.8241231337705222 eV
minimum distance =  2.18448525424122 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 0.9946197479473836
Energy: 0.9999375521873092
Energy: 1.0257797234905885
Energy: 0.994562726462155
Energy: 0.9999375521847914
Energy: 1.0352112043847783
Energy: 1.0481790113616498
Energy: 0.9437094187658017
Energy: 1.0352112043824704
Energy: 1.0481790113624192
Energy: 0.9437216974119039
Energy: 1.0352112043895694
Energy: 1.0481790113701128
Energy: 0.9437094187608008
Energy: 1.020125036960763
Energy: 1.0684587377367405
Energy: 1.0160155679764449
Energy: 1.0229194107909532
Energy: 1.0279725825881538
Energy: 1.0160155679795224
Energy: 1.0229194107824902
Energy: 1.0684587377388388
Energy: 1.016015567978578
Energy: 1.0229194107884352
Energy: 1.0279725825889234
Energy: 1.0671313083484213
Energy: 1.0269030717089873
Energy: 1.0181289781717058
Energy: 1.0271168665143893
Energy: 1.026903071707239
Energy: 0.9800514413249356
Energy: 1.067131308354961
Energy: 1.0269030716966776
Energy: 1.0181289781688379
Energy: 1.0271168665163124
Energy: 0.9795630257963877
Energy: 0.922691685277185
Energy: 1.0051823225208794
Energy: 0.9795630257956184
Energy: 0.922691685278549
Energy: 1.0051823225201098
Energy: 0.9795630257954084
Energy: 0.9226916852802626
Energy: 1.0051823225176268
Energy: 0.9795630257990805
Energy: 1.073997089329939
Energy: 1.0011380662903575
Energy: 0.9868576353368855
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Energy: 1.0011380662967222
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Energy: 1.001138066299415
Energy: 0.9868576353266741
Energy: 1.0739970893295545
Energy: 0.9494206400335258
Energy: 1.020573083180113
Energy: 0.9332210162108853
Energy: 0.9494206400260418
Energy: 1.0205730831824211
Energy: 0.933221016209906
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Energy: 1.0205730831766509
Energy: 0.9332210162112701
Energy: 0.9494206400335258
Energy: 0.9459052055174043
Energy: 1.0460782594163032
Energy: 1.045976569016825
Energy: 0.9461383561214516
Energy: 1.0460782594163032
Energy: 1.0459765690146918
Energy: 0.9459052055171944
Energy: 1.0460782594180167
Energy: 1.045976569011824
Energy: 0.9461383561202976
Energy: 1.108403066798999
Energy: 0.9537310368077798
Energy: 1.0012386789345367
Energy: 1.1084030668038252
Energy: 0.9537310368070107
Energy: 1.0012386789372294
Energy: 1.1084030668053637
Energy: 0.953731036806241
Energy: 1.001238678932613
Energy: 1.1084030667972853
Energy: 1.0059597074152145
Energy: 0.9875550065847079
Energy: 0.9820255228056761
Energy: 1.0264871459756135
Energy: 0.9875550065843234
Energy: 0.9820255228051166
Energy: 1.0059597074103885
Energy: 0.9875550065820151
Energy: 0.982025522799906
Energy: 1.0264871459794604
Energy: 1.029733090986681
Energy: 1.0301683530139467
Energy: 0.9318552558985036
Energy: 1.0297452034352248
Energy: 1.0301595423474401
Energy: 0.9318552559031198
Energy: 1.029733090983219
Energy: 1.0301683530083865
Energy: 0.9318552559037142
Energy: 1.0297452034300143
Energy: 1.060774630254035
Energy: 1.0080478279729035
Energy: 1.0522730345996298
Energy: 1.060774630249209
Energy: 1.0080478279705956
Energy: 1.0522730345996298
Energy: 1.0607746302594205
Energy: 1.0080478279800027
Energy: 1.0522730345927405
Energy: 1.0607746302519019
Energy: 1.0108862966306715
Energy: 1.0061989086781085
Energy: 0.9945349958000235
Energy: 1.0108862966224184
Energy: 1.0061989086808012
Energy: 0.9945349957956169
Energy: 1.0108862966185717
Energy: 1.0061989086788778
Energy: 0.9945349957971557
Energy: 1.0108862966226284
Energy: 1.0090593395320564
Energy: 1.040433797782956
Energy: 0.9918627773367932
Energy: 1.0203677104551454
Energy: 1.0287881277151705
Energy: 0.9918627773343102
Energy: 1.0265850301251271
Energy: 1.0404337977846696
Energy: 0.9918627773329463
Energy: 1.021529199298202
Energy: 1.0051570608497415
Energy: 0.9972579856381155
Energy: 0.9423441446760433
Energy: 1.0051570608493567
Energy: 0.9972579856469632
Energy: 0.9423441446808692
Energy: 1.00515706084551
Energy: 0.9972579856427317
Energy: 0.9423441446729658
Energy: 1.0051570608461045
Energy: 0.98185171800267
Energy: 1.0333730748511802
Energy: 0.9840073598763912
Energy: 0.9818517180038242
Energy: 1.0333730748465642
Energy: 0.9840073598808325
Energy: 0.9818517180001524
Energy: 1.0333730748528938
Energy: 0.9840073598813921
Energy: 0.9818517180042088
Energy: 0.9431802151182684
Energy: 1.0300926265276296
Energy: 1.025455272323678
Energy: 0.9431802151150159
Energy: 1.0300926265309172
Energy: 1.0254552723248322
Energy: 0.9431802151136524
Energy: 1.0300926265303225
Energy: 1.0254552723244474
Energy: 0.9431802151161701
Energy: 0.9902945913799693
Energy: 0.9797860202160399
Energy: 0.9918787969924294
Energy: 0.9902945913809134
Energy: 0.9797836403773249
Energy: 0.9918787969970456
Energy: 0.9902945913774513
Energy: 0.9797860202139067
Energy: 0.991878796990506
Energy: 0.9902945913799693
Energy: 1.0595711324064663
Energy: 0.9796458468800986
Energy: 1.0915360041045417
Energy: 1.059571132404333
Energy: 0.9796557528036876
Energy: 1.091536004105311
Energy: 1.0595711323997168
Energy: 0.9796458468716706
Energy: 1.0915360041066748
Energy: 1.0595711324027943
Energy: 1.0030455733791284
Energy: 1.00127387715609
Energy: 0.9458728627581092
Energy: 1.0030455733774148
Energy: 1.00127387716221
Energy: 0.9458728627554165
Energy: 1.0030455733752817
Energy: 1.0012738771551108
Energy: 0.9458728627575497
Energy: 1.0030455733787438
Energy: 0.9920583746323216
Energy: 1.0398729019890374
Energy: 0.9698783215214933
Energy: 0.9920583746350143
Energy: 1.0402824002161408
Energy: 0.9698783215174368
Energy: 0.9920583746274955
Energy: 1.039872901986939
Energy: 0.9698783215178214
Energy: 0.9920583746263415
Energy: 1.0145435536981993
Energy: 0.9944290475555495
Energy: 1.0004610513158099
Energy: 1.014543553693618
Energy: 0.9944343020113209
Energy: 1.000461051319447
Energy: 1.0145435536953318
Energy: 0.994429047563418
Energy: 1.0004610513204262
Energy: 1.0145435536966956
Energy: 1.0252610092671544
Energy: 0.9436618858109849
Energy: 1.0353641741468187
Energy: 1.025261009266595
Energy: 0.943617789238558
Energy: 1.0353641741514348
Energy: 1.025261009269078
Energy: 0.9436618858125234
Energy: 1.0353641741583588
Energy: 1.0252610092671544

minimum gb energy = 0.922691685277185 eV
minimum distance =  2.158254336203 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 0.9463139872257356
Energy: 0.9519303728535466
Energy: 0.9519965410461261
Energy: 0.9113128787510424
Energy: 0.9519303728542071
Energy: 0.9519965410467864
Energy: 0.946313987224415
Energy: 0.9519303728588292
Energy: 0.9519965410467864
Energy: 0.9113128787510424
Energy: 0.9527868908499064
Energy: 0.9036117148459437
Energy: 1.0553921015207424
Energy: 0.9527868908492462
Energy: 0.903611714846604
Energy: 1.055392101524044
Energy: 0.9527868908446239
Energy: 0.9036117148459437
Energy: 1.0553921015260248
Energy: 0.9527868908452843
Energy: 0.932214783414447
Energy: 0.92309209599082
Energy: 0.9219554772178103
Energy: 0.932214783414447
Energy: 0.9230920959947818
Energy: 0.9220964429548845
Energy: 0.9322147834098248
Energy: 0.9230920959921406
Energy: 0.921955477215169
Energy: 0.9322147834137866
Energy: 0.9597832319647016
Energy: 0.9148440305357524
Energy: 0.9177433146713895
Energy: 0.959783231965362
Energy: 0.9148440305357524
Energy: 0.9177433146786529
Energy: 0.9597832319673429
Energy: 0.9148440305416952
Energy: 0.9177433146773323
Energy: 0.959783231965362
Energy: 0.9555340739326604
Energy: 0.9516175764515423
Energy: 0.9176492618013569
Energy: 0.9555340739313398
Energy: 0.9516175764515423
Energy: 0.9176492618000361
Energy: 0.9555340739313398
Energy: 0.9516175764482407
Energy: 0.9176492617973949
Energy: 0.9555340739313398
Energy: 0.903302038853362
Energy: 0.9735372525839261
Energy: 1.0562582157869218
Energy: 0.9033020388546826
Energy: 0.9735372525832658
Energy: 1.0562582157895632
Energy: 0.9033020388546826
Energy: 0.9735372525812849
Energy: 1.0562582157895632
Energy: 0.9033020388546826
Energy: 0.9524397498556895
Energy: 0.9393133543749302
Energy: 0.9520038467123034
Energy: 0.9524397498530481
Energy: 0.9393133543729492
Energy: 0.952003846713624
Energy: 0.9524397498543689
Energy: 0.9393133543775715
Energy: 0.9520038467142843
Energy: 0.9524397498537086
Energy: 1.022867934333057
Energy: 0.9156903515691402
Energy: 0.9027559353960319
Energy: 1.0228679343350378
Energy: 0.915690351566499
Energy: 0.90275593539207
Energy: 1.022867934333057
Energy: 0.9156903515691402
Energy: 0.9027559353881082
Energy: 1.0228679343337173
Energy: 0.9578925216536535
Energy: 1.0254219631067183
Energy: 0.9392365775644352
Energy: 0.9578925216523329
Energy: 1.0254219631080388
Energy: 0.9393640651268076
Energy: 0.9578925216543137
Energy: 1.0254219631139816
Energy: 0.939236577565756
Energy: 0.9578925216536535
Energy: 0.9538582020099925
Energy: 1.0559095914741041
Energy: 0.9935949725940401
Energy: 0.9202033723403641
Energy: 1.055909591480047
Energy: 0.9935949725953607
Energy: 0.9538582020067209
Energy: 1.0559095914807073
Energy: 0.9935949725953607
Energy: 0.9202033723377228
Energy: 0.9601569583309348
Energy: 0.9168286557361269
Energy: 1.057405462671649
Energy: 0.9142269880526706
Energy: 0.9168286557394285
Energy: 0.9932814242420662
Energy: 0.9601569583309348
Energy: 0.9168286557400888
Energy: 1.0574054626729694
Energy: 0.9142269880487086
Energy: 1.0773691350295562
Energy: 0.9177629284218177
Energy: 1.0225483277992786
Energy: 1.0773691350295562
Energy: 0.9177629284204971
Energy: 1.022548327799939
Energy: 1.0773691350321974
Energy: 0.9177629284185163
Energy: 1.022548327797958
Energy: 1.0773691350361596
Energy: 0.9660699265772241
Energy: 0.9249326205944893
Energy: 0.9856601290767883
Energy: 0.9660699265785448
Energy: 0.9249326205951497
Energy: 0.9856601290774486
Energy: 0.9660699265785448
Energy: 0.9249326205958099
Energy: 0.9856601290734868
Energy: 0.9660699265798655
Energy: 1.0165117804718826
Energy: 1.0193105993363278
Energy: 0.9029457515196047
Energy: 1.016511780475184
Energy: 1.0193105993402898
Energy: 0.9029457515202649
Energy: 1.0165117804725428
Energy: 1.0193105993383087
Energy: 0.9029457515189443
Energy: 1.0165117804718826
Energy: 0.9113128787517026
Energy: 0.9519303728528864
Energy: 0.9519965410474468
Energy: 0.9113128787530232
Energy: 0.9519303728555277
Energy: 0.9519965410481072
Energy: 0.9113128787517026
Energy: 0.9519303728575086
Energy: 0.9519965410487674
Energy: 0.9113128787530232

minimum gb energy = 0.9027559353881082 eV
minimum distance =  2.31077139332533 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 0.9919481804304959
Energy: 0.8991542315659166
Energy: 0.8992202346963045
Energy: 0.9437112234589514
Energy: 0.8991542315738353
Energy: 0.8992202346983541
Energy: 0.9919481804323126
Energy: 0.899154231562097
Energy: 0.8992202347024532
Energy: 0.9437112234592306
Energy: 0.879108696302496
Energy: 0.8065400190520096
Energy: 0.8980273169275821
Energy: 0.8791086963117191
Energy: 0.8065400190614656
Energy: 0.8980273169334979
Energy: 0.8791086963135357
Energy: 0.8065400190471185
Energy: 0.898027316930144
Energy: 0.879108696309949
Energy: 0.9417394337906372
Energy: 0.8084384910080409
Energy: 0.8664453811965039
Energy: 0.9417394337880753
Energy: 0.8084384910149349
Energy: 0.8657134111509603
Energy: 0.9675630904895359
Energy: 0.8084384910203384
Energy: 0.8664453812067519
Energy: 0.922854062040712
Energy: 0.8142533148586235
Energy: 0.8150537263569907
Energy: 0.8447224976797334
Energy: 0.8142533148529872
Energy: 0.8150537263493048
Energy: 0.844881989334453
Energy: 0.8142533148532201
Energy: 0.8150537263541959
Energy: 0.844722497667203
Energy: 0.8142533148499129
Energy: 0.8244402428323196
Energy: 0.9429153329714823
Energy: 0.8430421174878078
Energy: 0.8244402428361394
Energy: 0.9429153329706905
Energy: 0.8430804979277883
Energy: 0.8244402428387013
Energy: 0.9429153329599769
Energy: 0.8430421174903697
Energy: 0.8244402428364188
Energy: 0.8346676767288164
Energy: 0.8921885982050867
Energy: 0.8561572610012147
Energy: 0.8346676767342196
Energy: 0.8921885982137973
Energy: 0.8561572609981403
Energy: 0.8346676767280711
Energy: 0.892188598217384
Energy: 0.8561572610022394
Energy: 0.8346676767370146
Energy: 0.8267080988851799
Energy: 0.8093198380703424
Energy: 0.893872749579365
Energy: 0.8267080988746993
Energy: 0.8093198380734166
Energy: 0.8938727495765235
Energy: 0.8267080988803356
Energy: 0.8093198380708547
Energy: 0.8938727495783402
Energy: 0.8267080988795437
Energy: 0.9013427800470737
Energy: 0.797386244030967
Energy: 0.8164447385451741
Energy: 0.9013427800467944
Energy: 0.7973668512122737
Energy: 0.8164447385448946
Energy: 0.9013427800457695
Energy: 0.7973862440407025
Energy: 0.8164447385464317
Energy: 0.9013427800508935
Energy: 0.8566353446145324
Energy: 0.9716395934639193
Energy: 0.9763400409477666
Energy: 0.8566353446101538
Energy: 0.9716395934774744
Energy: 0.9400078856135609
Energy: 0.856635344606567
Energy: 0.9716395934731423
Energy: 0.9763400409277834
Energy: 0.8566353446150448
Energy: 0.8323616133631979
Energy: 0.8778055366440926
Energy: 0.8391279941446373
Energy: 0.8323616133619403
Energy: 0.8723171050917383
Energy: 0.8238339455699919
Energy: 0.8323616133727005
Energy: 0.8778055366427884
Energy: 0.8391279941400724
Energy: 0.8323616133686013
Energy: 0.822140107826369
Energy: 0.8408013501678487
Energy: 0.8410257400105624
Energy: 0.8221401078197079
Energy: 0.8407763108559637
Energy: 0.841171066736653
Energy: 0.8221401078273937
Energy: 0.8408013501773511
Energy: 0.8410257400072085
Energy: 0.8221401078199408
Energy: 0.808123513463724
Energy: 0.9300850378694544
Energy: 0.8661310326206048
Energy: 0.8081235134739719
Energy: 0.9176210956598448
Energy: 0.8661310326218623
Energy: 0.8081235134667984
Energy: 0.9300850378661006
Energy: 0.8661310326305731
Energy: 0.8081235134673107
Energy: 0.9475444105111026
Energy: 0.8282332067750944
Energy: 0.9585233690497078
Energy: 0.9475444105016002
Energy: 0.8282371978203024
Energy: 0.9585233690535274
Energy: 0.9475444105090531
Energy: 0.8282332067715076
Energy: 0.9585233690514778
Energy: 0.9475444105136647
Energy: 0.8932484611496829
Energy: 0.8755394481324504
Energy: 0.830153125196209
Energy: 0.8932484611479128
Energy: 0.87553944813627
Energy: 0.8301531251977462
Energy: 0.8932484611412517
Energy: 0.8755394481367824
Energy: 0.8301531251916441
Energy: 0.8932484611471209
Energy: 0.8068077390352196
Energy: 0.8953573874368151
Energy: 0.8317352885254955
Energy: 0.8068077390439301
Energy: 0.8953573874314583
Energy: 0.8317352885234459
Energy: 0.8068077390367567
Energy: 0.8953573874373275
Energy: 0.8317352885203715
Energy: 0.8068077390367567
Energy: 0.8080611946411953
Energy: 0.8569159029342707
Energy: 0.9264687713930186
Energy: 0.808061194636351
Energy: 0.8569159029401865
Energy: 0.92646877138128
Energy: 0.8080611946389128
Energy: 0.8569159029322211
Energy: 0.9264687713807678
Energy: 0.8080611946450615
Energy: 0.8246970761128711
Energy: 0.8907828938302513
Energy: 0.847220949356261
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Energy: 0.8333195031498498
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Energy: 0.8246970761141754
Energy: 0.8907828938412445
Energy: 0.8472209493652046
Energy: 0.8246970761179949
Energy: 0.9011248754247734
Energy: 0.891276084891246
Energy: 0.8991491222151689
Energy: 0.8695767838669475
Energy: 0.9077642328404532
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Energy: 0.8912760848782032
Energy: 0.8991491222077159
Energy: 0.8695767838587491
Energy: 0.893797881762402
Energy: 0.8878493921102563
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Energy: 0.8937978817567658
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Energy: 0.809304418132967
Energy: 0.8937978817575577
Energy: 0.8878493921251156
Energy: 0.8093044181378115
Energy: 0.8937978817685508
Energy: 0.8283929549252756
Energy: 0.9133442228744123
Energy: 0.8075370295676063
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Energy: 0.8075370295676063
Energy: 0.8283929549252756
Energy: 0.913344222863885
Energy: 0.8075370295681187
Energy: 0.8284487170589984
Energy: 0.8294789912466225
Energy: 0.8767983505544129
Energy: 0.8991640540294191
Energy: 0.8294884212607144
Energy: 0.8767983505585121
Energy: 0.8991640540371051
Energy: 0.8294789912432686
Energy: 0.8767983505572078
Energy: 0.8991640540322141
Energy: 0.8294884212663508
Energy: 0.9996022931626838
Energy: 0.828223836878367
Energy: 0.922602999098678
Energy: 0.9996022931713944
Energy: 0.8282238368678863
Energy: 0.9226029990889426
Energy: 0.99960229316655
Energy: 0.8282238368706811
Energy: 0.9226029990940664
Energy: 0.9996022931585846
Energy: 0.8677386466613659
Energy: 0.9568660758990801
Energy: 0.8079748964043441
Energy: 0.8677386466610865
Energy: 0.9568660759080236
Energy: 0.8079748963976829
Energy: 0.86773864666826
Energy: 0.956866075900897
Energy: 0.8079748963925589
Energy: 0.8677386466713344
Energy: 0.8406379367223129
Energy: 0.8411120754118834
Energy: 0.822802632864516
Energy: 0.8406379367202634
Energy: 0.8411120754060142
Energy: 0.8228026328634913
Energy: 0.8406379367136022
Energy: 0.8411120754093215
Energy: 0.8228026328699195
Energy: 0.8406379367123447
Energy: 0.848048121718421
Energy: 0.9908372200904352
Energy: 0.8241268777049969
Energy: 0.8480481217155796
Energy: 0.9908372200914601
Energy: 0.8241268777024816
Energy: 0.8480481217173962
Energy: 0.9908372200809793
Energy: 0.8241268777068136
Energy: 0.8480481217191663
Energy: 0.9956947943295498
Energy: 0.8920742852557992
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Energy: 0.9492538643716689
Energy: 0.911180213502971
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Energy: 0.8478988729507216
Energy: 0.9041064487420741
Energy: 0.9345577533720559
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Energy: 0.8921912861395516
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Energy: 0.8921912861375021
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Energy: 0.8773884973880417
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Energy: 0.8773884974031806
Energy: 0.9683273799299013
Energy: 0.8936494240344995
Energy: 0.8064074694093416
Energy: 0.8722817496141582
Energy: 0.8351863466237537
Energy: 0.8064074694132078
Energy: 0.8968946296910334
Energy: 0.8170275497455012
Energy: 0.8064074694116706
Energy: 0.8722817496146704
Energy: 0.835186346624266
Energy: 0.8064074694078045
Energy: 0.8260711689389816
Energy: 0.8408364504674211
Energy: 0.840448191990112
Energy: 0.8260711689302709
Energy: 0.8408360982951707
Energy: 0.8404913512355533
Energy: 0.826071168930038
Energy: 0.8408364504855879
Energy: 0.8404481919882952
Energy: 0.8260711689336248
Energy: 0.818269563754215
Energy: 0.849573178542568
Energy: 0.8142588383582254
Energy: 0.8182695637616215
Energy: 0.849557829202006
Energy: 0.8142588383799788
Energy: 0.8182695637667455
Energy: 0.8495731785630637
Energy: 0.8142588383758798
Energy: 0.8182695637613886
Energy: 0.9424998993188183
Energy: 0.8413474441478668
Energy: 0.8586395872138702
Energy: 0.9424998993111325
Energy: 0.8413094283078405
Energy: 0.8586395872085135
Energy: 0.9424998993152315
Energy: 0.8413474441358488
Energy: 0.8586395872041348
Energy: 0.9424998993213802
Energy: 0.8937966357738577
Energy: 0.8873611882103167
Energy: 0.8318907826092248
Energy: 0.8937966357712956
Energy: 0.8873611882123663
Energy: 0.8318907826102495
Energy: 0.8937966357810311
Energy: 0.8873611882103167
Energy: 0.8318907826002812
Energy: 0.8937966357751619

minimum gb energy = 0.7973668512122737 eV
minimum distance =  2.18115513663584 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

Energy: 0.3813920323899869
Energy: 0.43065608273591466
Energy: 0.43066478235756056
Energy: 0.3813920323918117
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Energy: 0.3816965077021946
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Energy: 0.3816965077082492
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Energy: 0.3816965077131151
Energy: 0.42838328003867227
Energy: 0.4307287108460514
Energy: 0.3816965077115945
Energy: 0.4283862413750547
Energy: 0.4307287108436184
Energy: 0.4075006490210511
Energy: 0.4172028411449359
Energy: 0.4307306296906916
Energy: 0.40750064902226757
Energy: 0.41720284115768114
Energy: 0.43073062967335685
Energy: 0.4075006490219635
Energy: 0.41720284115068645
Energy: 0.43073062970255216
Energy: 0.4075006490219635
Energy: 0.3811230075209604
Energy: 0.41724428676449754
Energy: 0.45179536020025163
Energy: 0.381123007522481
Energy: 0.41724427696863503
Energy: 0.4517963169034525
Energy: 0.3811230075288675
Energy: 0.4172442450227512
Energy: 0.4517953290714776
Energy: 0.3811230075200481
Energy: 0.39187937229070874
Energy: 0.4328160015568588
Energy: 0.4526298515741462
Energy: 0.39187937228374164
Energy: 0.432816001557467
Energy: 0.45262971804687235
Energy: 0.3918793722886076
Energy: 0.43281600155473
Energy: 0.4526296596663314
Energy: 0.39187937229527053

minimum gb energy = 0.381115966225069 eV
minimum distance =  2.43566112157227 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 0.8179758370477208
Energy: 0.8152350606452446
Energy: 0.8150799867733101
Energy: 0.7709899480375851
Energy: 0.8152350606452446
Energy: 0.8150799867766492
Energy: 0.8179758370460513
Energy: 0.8152350606452446
Energy: 0.8150799867783187
Energy: 0.7709899480392546
Energy: 0.7975414005027079
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Energy: 0.7975414005077164
Energy: 0.8472617147525708
Energy: 0.7943396259554437
Energy: 0.8077180882050176
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Energy: 0.8077180882116957
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Energy: 0.907912394783426
Energy: 0.7540940943985592
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Energy: 0.7540940944052373
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Energy: 0.8258495840691586
Energy: 0.8053987829367693
Energy: 0.75400832034808
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Energy: 0.7900174039235865
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Energy: 0.814943845067151
Energy: 0.8018772521810064
Energy: 0.8158169091934899
Energy: 0.8149438450621425
Energy: 0.7920238821460567
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Energy: 0.8175466058995579
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Energy: 0.7958250791554112
Energy: 0.7831174241071509
Energy: 0.8515336338261129
Energy: 0.7958250791570806

minimum gb energy = 0.7506313566364411 eV
minimum distance =  2.20346515798136 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 0.9272197029613054
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Energy: 1.041640606238111
Energy: 0.9272197029602005
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Energy: 1.0419731582346141
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Energy: 1.0419731582346141
Energy: 0.9239711918887369
Energy: 0.9706678981895279
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Energy: 0.9833488329955443
Energy: 1.017826117775609
Energy: 0.9706678981906328
Energy: 0.9833488329955443
Energy: 1.017826117774504
Energy: 0.9706678981906328

minimum gb energy = 0.923689725097453 eV
minimum distance =  2.30001748694268 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

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Energy: 1.1215290347796993
Energy: 1.121533010056948
Energy: 1.0765866484615787
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Energy: 1.0537435038445975
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minimum gb energy = 1.033186755172493 eV
minimum distance =  2.17103625144075 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 1.1380413481165415
Energy: 1.1210965449960224
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Energy: 1.1380413481330136
Energy: 1.1210965449882855
Energy: 1.119966451404205
Energy: 1.1380413481272735
Energy: 1.121096544986788
Energy: 1.1747078939536524
Energy: 1.0695682623447287
Energy: 1.0398824660818793
Energy: 1.1747078939466642
Energy: 1.0695682623447287
Energy: 1.0398824660706483
Energy: 1.1747078939471634
Energy: 1.0695682623342468
Energy: 1.0398824660841255
Energy: 1.174707893953902
Energy: 1.1099541812983584
Energy: 1.1095187302924332
Energy: 1.0314363609316257
Energy: 1.109954181296861
Energy: 1.109518730301418
Energy: 1.0314363609256358
Energy: 1.1099541812978593
Energy: 1.1095187302946794
Energy: 1.031436360941359
Energy: 1.1099541812973601
Energy: 1.0693864491545262
Energy: 1.0734072483391013
Energy: 1.0475162669984794
Energy: 1.069386449157022
Energy: 1.0734072483378534
Energy: 1.0475162670051954
Energy: 1.0693864491577707
Energy: 1.0734072483483357
Energy: 1.0475162670051954
Energy: 1.0693864491515315
Energy: 1.1045035985739242
Energy: 1.0984331811919328
Energy: 1.0410754368415964
Energy: 1.1045036017131693
Energy: 1.0984331811961527
Energy: 1.041075436857047
Energy: 1.1045035964679422
Energy: 1.0984331811884387
Energy: 1.0410754368495827
Energy: 1.1045036010900031
Energy: 1.0536792486429214
Energy: 1.1403063540084575
Energy: 1.140309537577492
Energy: 1.0536792486431708
Energy: 1.1403063540151959
Energy: 1.1403095375695058
Energy: 1.053679248641923
Energy: 1.1403063540042147
Energy: 1.140309537571003
Energy: 1.05367924864367
Energy: 1.1047022144103789
Energy: 1.041081547822577
Energy: 1.0985573780766007
Energy: 1.104702214162914
Energy: 1.04108154782657
Energy: 1.098557378056657
Energy: 1.1047022144682574
Energy: 1.0410815478275683
Energy: 1.0985573780743545
Energy: 1.1047022144911958
Energy: 1.0693133833953359
Energy: 1.0476653237998632
Energy: 1.0734297227444614
Energy: 1.0693133833960846
Energy: 1.047665323802858
Energy: 1.0734297227315062
Energy: 1.0693133833873494
Energy: 1.0476653238056033
Energy: 1.0734297227382221
Energy: 1.069313383395835
Energy: 1.109945200899606
Energy: 1.0314387928375903
Energy: 1.1096113396854859
Energy: 1.1099452008998556
Energy: 1.0314387928355935
Energy: 1.1096113399257133
Energy: 1.1099452009011035
Energy: 1.0314387928348447
Energy: 1.109611339694221
Energy: 1.1099452009011035
Energy: 1.1746721086451526
Energy: 1.03988561552421
Energy: 1.0695503890026379
Energy: 1.1746721086436551
Energy: 1.0398856155546352
Energy: 1.069550389005633
Energy: 1.1746721086498946
Energy: 1.0398856155880556
Energy: 1.069550389012621
Energy: 1.174672108647898
Energy: 1.1210778593962514
Energy: 1.137881582955724
Energy: 1.1200184638839716
Energy: 1.1210778593917592
Energy: 1.1378815829577207
Energy: 1.120018463885968
Energy: 1.121077859399496
Energy: 1.1378815829554747
Energy: 1.1200184638849697
Energy: 1.1210778593872668
Energy: 1.0428749977621932
Energy: 1.0398706518621468
Energy: 1.0481786397697215
Energy: 1.0428749977739233
Energy: 1.0398761459226737
Energy: 1.0481786390674854
Energy: 1.0428749977684326
Energy: 1.039868403425119
Energy: 1.0481786390984327
Energy: 1.0428749977724256
Energy: 1.1565401442217678
Energy: 1.075602783333635
Energy: 1.0756071164019967
Energy: 1.1565401442260106
Energy: 1.075602782570775
Energy: 1.0756071173340007
Energy: 1.1565401442310022
Energy: 1.075602782662074
Energy: 1.075607117892799
Energy: 1.1565401442247627
Energy: 1.042824352432551
Energy: 1.0481769196898925
Energy: 1.039858766496477
Energy: 1.0428243524245644
Energy: 1.0481769196953832
Energy: 1.0398464729465124
Energy: 1.0428243524280583
Energy: 1.048176919915168
Energy: 1.039855616708644
Energy: 1.042824352432551
Energy: 1.1210965449887846
Energy: 1.1199664514062015
Energy: 1.1380413481367573
Energy: 1.1210965449798
Energy: 1.1199664514059517
Energy: 1.1380413481215332
Energy: 1.1210965449897832
Energy: 1.1199664514071999
Energy: 1.138041348121034
Energy: 1.1210965449820463
Energy: 1.1747078939419224
Energy: 1.0695682623280074
Energy: 1.0398824660811306
Energy: 1.1747078939481617
Energy: 1.0695682623374914
Energy: 1.0398824660871202
Energy: 1.174707893950158
Energy: 1.0695682623357443
Energy: 1.0398824660818793
Energy: 1.1747078939436695
Energy: 1.1099541812983584
Energy: 1.109518730290187
Energy: 1.031436360927882
Energy: 1.1099541812971108
Energy: 1.1095187302859444
Energy: 1.0314363609321249
Energy: 1.1099541812991072
Energy: 1.1095187303024163
Energy: 1.0314363609186705
Energy: 1.1099541812978593

minimum gb energy = 1.0314363609186705 eV
minimum distance =  2.31288999232958 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 1.0582042911194443
Energy: 1.0542113000022635
Energy: 1.0541126748851088
Energy: 1.058204291118993
Energy: 1.0542112999977524
Energy: 1.0541126748864618
Energy: 1.0582042911203464
Energy: 1.054211300001361
Energy: 1.0541126748855596
Energy: 1.058204291118542
Energy: 1.0515636288970232
Energy: 1.058462967862748
Energy: 1.0545020780673415
Energy: 1.0515636288938657
Energy: 1.0584629678600412
Energy: 1.0545020780677925
Energy: 1.051563628894768
Energy: 1.0584629678631987
Energy: 1.0545020780664391
Energy: 1.0515636288907084
Energy: 1.0525514868639987
Energy: 1.0524850666545902
Energy: 1.119752913933015
Energy: 1.0525514868658028
Energy: 1.0524850666559435
Energy: 1.1197529139271512
Energy: 1.0525514868639987
Energy: 1.0524850666545902
Energy: 1.1197529139303088
Energy: 1.0525514868649004
Energy: 1.1197230901351145
Energy: 1.052559775587516
Energy: 1.0525704429802705
Energy: 1.1197230901346633
Energy: 1.0525597755884182
Energy: 1.0525704429798195
Energy: 1.1197230901346633
Energy: 1.0525597755879672
Energy: 1.0525704429811726
Energy: 1.119723090131957
Energy: 1.0556269342439
Energy: 1.058705933046369
Energy: 1.05155180078044
Energy: 1.0556269342398608
Energy: 1.0587059330432114
Energy: 1.0515518007826954
Energy: 1.0556269342439
Energy: 1.058705933046369
Energy: 1.0515518007799889
Energy: 1.0556269342407631
Energy: 1.0542112999977524
Energy: 1.0541126748869132
Energy: 1.0582042911194443
Energy: 1.054211300001361
Energy: 1.0541126748846574
Energy: 1.0582042911207974
Energy: 1.0542112999977524
Energy: 1.054112674887364
Energy: 1.058204291118993
Energy: 1.054211300001361
Energy: 1.0584629678600412
Energy: 1.0545020780677925
Energy: 1.0515636288952188
Energy: 1.058462967862748
Energy: 1.0545020780668903
Energy: 1.0515636288943169
Energy: 1.0584629678600412
Energy: 1.0545020780664391
Energy: 1.0515636288943169
Energy: 1.058462967862748
Energy: 1.0524850666563945
Energy: 1.1197529139289555
Energy: 1.0525514868639987
Energy: 1.0524850666550414
Energy: 1.1197529139303088
Energy: 1.0525514868653518
Energy: 1.0524850666559435
Energy: 1.1197529139271512
Energy: 1.0525514868639987
Energy: 1.0524850666545902
Energy: 1.0525597755879672
Energy: 1.0525704429793683
Energy: 1.1197230901360165
Energy: 1.0525597755879672
Energy: 1.0525704429811726
Energy: 1.119723090132859
Energy: 1.0525597755884182
Energy: 1.0525704429793683
Energy: 1.1197230901333102
Energy: 1.0525597755879672
Energy: 1.0587059330432114
Energy: 1.0515518007813422
Energy: 1.0556269342429978
Energy: 1.058705933046369
Energy: 1.0515518007826954
Energy: 1.0556269342398608
Energy: 1.0587059330427604
Energy: 1.0515518007799889
Energy: 1.055626934243449
Energy: 1.058705933046369
Energy: 1.0541126748860108
Energy: 1.0582042911171887
Energy: 1.0542112999968505
Energy: 1.0541126748864618
Energy: 1.0582042911194443
Energy: 1.054211300001361
Energy: 1.0541126748855596
Energy: 1.0582042911194443
Energy: 1.0542112999977524
Energy: 1.0541126748864618
Energy: 1.0545020780664391
Energy: 1.0515636288925125
Energy: 1.0584629678595903
Energy: 1.0545020780668903
Energy: 1.0515636288974743
Energy: 1.0584629678631987
Energy: 1.0545020780677925
Energy: 1.0515636288907084
Energy: 1.0584629678595903
Energy: 1.0545020780664391
Energy: 1.1197529139325642
Energy: 1.0525514868658028
Energy: 1.0524850666554924
Energy: 1.1197529139276021
Energy: 1.0525514868635475
Energy: 1.0524850666545902
Energy: 1.1197529139303088
Energy: 1.0525514868653518
Energy: 1.0524850666563945
Energy: 1.1197529139289555
Energy: 1.0525704429807212
Energy: 1.1197230901346633
Energy: 1.0525597755879672
Energy: 1.0525704429793683
Energy: 1.1197230901346633
Energy: 1.0525597755879672
Energy: 1.0525704429811726
Energy: 1.1197230901324078
Energy: 1.0525597755879672
Energy: 1.0525704429793683
Energy: 1.0515518007799889
Energy: 1.0556269342420956
Energy: 1.0587059330427604
Energy: 1.0515518007822444
Energy: 1.055626934243449
Energy: 1.0587059330459179
Energy: 1.0515518007817932
Energy: 1.0556269342411932
Energy: 1.0587059330432114
Energy: 1.0515518007831466
Energy: 1.0582042911212484
Energy: 1.054211300001361
Energy: 1.0541126748851088
Energy: 1.0582042911194443
Energy: 1.0542112999977524
Energy: 1.0541126748860108
Energy: 1.058204291118993
Energy: 1.0542113000009103
Energy: 1.0541126748855596
Energy: 1.058204291118542
Energy: 1.0515636288974743
Energy: 1.0584629678631987
Energy: 1.0545020780664391
Energy: 1.0515636288952188
Energy: 1.0584629678600412
Energy: 1.0545020780668903
Energy: 1.0515636288952188
Energy: 1.0584629678631987
Energy: 1.0545020780673415
Energy: 1.0515636288911592
Energy: 1.0525514868635475
Energy: 1.0524850666550414
Energy: 1.1197529139298577
Energy: 1.0525514868658028
Energy: 1.0524850666559435
Energy: 1.1197529139276021
Energy: 1.0525514868644497
Energy: 1.0524850666550414
Energy: 1.119752913932113
Energy: 1.0525514868653518
Energy: 1.1197230901360165
Energy: 1.052559775587516
Energy: 1.0525704429807212
Energy: 1.1197230901333102
Energy: 1.0525597755884182
Energy: 1.0525704429793683
Energy: 1.1197230901346633
Energy: 1.0525597755879672
Energy: 1.0525704429811726
Energy: 1.1197230901315058
Energy: 1.055626934243449
Energy: 1.0587059330459179
Energy: 1.0515518007826954
Energy: 1.0556269342407631
Energy: 1.0587059330427604
Energy: 1.051551800786304
Energy: 1.055626934243449
Energy: 1.058705933046369
Energy: 1.0515518007813422
Energy: 1.0556269342407631
Energy: 1.0542112999977524
Energy: 1.054112674887364
Energy: 1.0582042911198954
Energy: 1.0542113000009103
Energy: 1.0541126748855596
Energy: 1.0582042911212484
Energy: 1.0542112999973017
Energy: 1.0541126748860108
Energy: 1.0582042911216998
Energy: 1.0542113000018123
Energy: 1.0584629678595903
Energy: 1.0545020780664391
Energy: 1.0515636288974743
Energy: 1.058462967862748
Energy: 1.0545020780677925
Energy: 1.0515636288929635
Energy: 1.0584629678600412
Energy: 1.0545020780673415
Energy: 1.0515636288983767
Energy: 1.0584629678631987

minimum gb energy = 1.0515518007799889 eV
minimum distance =  2.32648376199126 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.0332401751316331
Energy: 1.0182820383977293
Energy: 1.0368111594353853
Energy: 1.017987367640263
Energy: 1.0182820383915951
Energy: 1.0368111594292508
Energy: 1.033240175139812
Energy: 1.0182820383895503
Energy: 1.0368111594353853
Energy: 1.0179873676382554
Energy: 1.0217507241212656
Energy: 1.0236764658892548
Energy: 1.099434705563055
Energy: 1.0217507241110417
Energy: 1.0236764658851651
Energy: 1.0994347055752862
Energy: 1.0217507241130868
Energy: 1.0236764658912996
Energy: 1.0994347055712341
Energy: 1.0217507241151313
Energy: 1.0100120997460513
Energy: 1.0207464250895952
Energy: 1.1749493470548076
Energy: 1.0100120997440063
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Energy: 1.174949347058897
Energy: 1.0100120997480961
Energy: 1.0207464250957294
Energy: 1.174949347058897
Energy: 1.0100120997440063
Energy: 1.0000837798479911
Energy: 1.0207315188976451
Energy: 1.0005782916924273
Energy: 1.0000837798398121
Energy: 1.0207315189119583
Energy: 1.0005782916863304
Energy: 1.0000837798377675
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Energy: 1.0005782916924273
Energy: 1.000083779841857
Energy: 1.121951225867033
Energy: 1.0234968452159938
Energy: 1.1020977236317329
Energy: 1.1219512258629436
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Energy: 1.1219512258629436
Energy: 1.0234968452200834
Energy: 1.1020977236235538
Energy: 1.1219512258629436
Energy: 1.0529767213939287
Energy: 1.1044056027235711
Energy: 0.9921355387767788
Energy: 1.0529767213980183
Energy: 1.104405602725616
Energy: 0.9921355387788237
Energy: 1.0529767213959735
Energy: 1.104405602725616
Energy: 0.9921355387808685
Energy: 1.0529767213959735
Energy: 1.024299211031906
Energy: 1.116207068893624
Energy: 1.0209459538414793
Energy: 1.0242903807468877
Energy: 1.1162070688895347
Energy: 1.0209459538435244
Energy: 1.0242992110298612
Energy: 1.116207068895669
Energy: 1.0209459538455687
Energy: 1.0242903807509771
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Energy: 1.109555018342605
Energy: 1.1004298657529257
Energy: 1.0250453156644417
Energy: 1.1095550183446496
Energy: 1.10042986575906
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Energy: 1.1095550183548735
Energy: 1.100429865750881
Energy: 1.025045315654218
Energy: 1.1466362843444349
Energy: 1.0175932290297014
Energy: 1.014001695852015
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Energy: 1.017593229025612
Energy: 1.0140016958499705
Energy: 1.146636284334211
Energy: 1.0175932290297014
Energy: 1.0140016958479257
Energy: 1.1466362843526137
Energy: 1.0240704097190672
Energy: 1.163756251028751
Energy: 1.0486030810643978
Energy: 1.0240706048803234
Energy: 1.1637562510267065
Energy: 1.0486030810643978
Energy: 1.024070409727246
Energy: 1.163756251028751
Energy: 1.0486030810623532
Energy: 1.0240706048823682
Energy: 1.0310213871426552
Energy: 0.9883841302576516
Energy: 1.0794434656286416
Energy: 1.0310213871467446
Energy: 0.9883841302556068
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Energy: 1.0310213871447
Energy: 0.9883841302556068
Energy: 1.0794434656204626
Energy: 1.0310213871508342
Energy: 1.0822592935650917
Energy: 0.9923889665055033
Energy: 1.1351884022062158
Energy: 1.082259293563047
Energy: 0.9923890005618435
Energy: 1.1351884022184469
Energy: 1.0822592935650917
Energy: 0.9923889665034588
Energy: 1.1351884022143575
Energy: 1.082259293563047
Energy: 1.1595295554304017
Energy: 0.9987471134616362
Energy: 1.1124805360804295
Energy: 1.159529555436536
Energy: 0.9987471134657259
Energy: 1.1124805360722507
Energy: 1.159529555426312
Energy: 0.9987471134575467
Energy: 1.112480536082474
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Energy: 0.9891492865098777
Energy: 0.990324417750299
Energy: 1.2465312097826275
Energy: 0.9891492865078331
Energy: 0.9903244177441648
Energy: 1.2465312097846726
Energy: 0.9891492865139673
Energy: 0.9903244177421199
Energy: 1.2465312097785382
Energy: 0.9891492865139673
Energy: 1.0864720281597158
Energy: 1.1476953139892039
Energy: 1.0027919001684802
Energy: 1.0864720281535816
Energy: 1.1476953139892039
Energy: 1.0027915130465777
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Energy: 1.1476953139789803
Energy: 1.0027919001643908
Energy: 1.0864720281597158
Energy: 1.0101267495103503
Energy: 1.1288345038153431
Energy: 1.1113356685083917
Energy: 1.0101267495144397
Energy: 1.1288345038173877
Energy: 1.1113356685063471
Energy: 1.0101267495144397
Energy: 1.1288345038173877
Energy: 1.1113356685104365
Energy: 1.0101267495083053
Energy: 1.0157164410987527
Energy: 1.0692918930902895
Energy: 1.1420946659016564
Energy: 1.0157164411007975
Energy: 1.0692918930861999
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Energy: 1.0157164411069317
Energy: 1.0692918930861999
Energy: 1.1420946658975668
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Energy: 1.1644186224581339
Energy: 1.0237282127764764
Energy: 1.1029391346970203
Energy: 1.1644186224540443
Energy: 1.023728212770342
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Energy: 1.164418622456089
Energy: 1.0237282127662526
Energy: 1.102939134692931
Energy: 1.1644186224519997
Energy: 1.008209414262989
Energy: 1.1225296094116501
Energy: 1.05659540464719
Energy: 1.0082094142588993
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Energy: 1.0082094142588993
Energy: 1.1225296094157398
Energy: 1.0565954046492347
Energy: 1.0082094142568545
Energy: 1.1095531686172226
Energy: 1.0031961371238685
Energy: 1.0557301200167313
Energy: 1.1095531686172226
Energy: 1.0031961371177345
Energy: 1.0557301200167313
Energy: 1.1095531686090436
Energy: 1.003196137113645
Energy: 1.0557301200167313
Energy: 1.109553168613133
Energy: 1.0681623228673394
Energy: 1.0239101236842423
Energy: 1.1293281154182817
Energy: 1.0681623228652946
Energy: 1.0239101236903767
Energy: 1.1293281154182817
Energy: 1.0681623228673394
Energy: 1.0239101236883317
Energy: 1.1293281154162367
Energy: 1.0681623228652946
Energy: 1.0043983473622027
Energy: 1.1731225627614577
Energy: 0.992293036816238
Energy: 1.0043983473581133
Energy: 1.1731225627594126
Energy: 0.9922930368141932
Energy: 1.0043983473581133
Energy: 1.1731225627716813
Energy: 0.992293036816238
Energy: 1.0043983473642473
Energy: 1.0249326308791595
Energy: 1.030129443305785
Energy: 1.0201978559143932
Energy: 1.0249395542705202
Energy: 1.0301377456551475
Energy: 1.020197855916438
Energy: 1.0249326308730256
Energy: 1.030129443305785
Energy: 1.0201978559123484
Energy: 1.0249395542623414
Energy: 0.9989389792859994
Energy: 1.0180834703650081
Energy: 0.9887025398479589
Energy: 0.9989389792880442
Energy: 1.0180834703650081
Energy: 0.9887025398459143
Energy: 0.9989389792962232
Energy: 1.018083470358874
Energy: 0.9887025398561379
Energy: 0.998938979298268
Energy: 1.0938996587477863
Energy: 1.0348968637987128
Energy: 1.030904466882898
Energy: 1.0938996587436969
Energy: 1.0348968638028022
Energy: 1.0309044668869873
Energy: 1.0938996587457412
Energy: 1.034896863796668
Energy: 1.0309044668808531
Energy: 1.0938996587518757
Energy: 1.0241820034095983
Energy: 1.1068210768800992
Energy: 1.081701392639949
Energy: 1.0241781883346552
Energy: 1.1068210768821438
Energy: 1.081701392639949
Energy: 1.0241820033993745
Energy: 1.1068210768862334
Energy: 1.0817013926338148
Energy: 1.0241781883346552
Energy: 1.0563036716971401
Energy: 0.98797718255175
Energy: 1.0780027845956797
Energy: 1.0563036716889982
Energy: 0.9879771825415264
Energy: 1.0780027845956797
Energy: 1.0563036717012295
Energy: 0.98797718255175
Energy: 1.0780027845977247
Energy: 1.0563036717012295
Energy: 1.1326004710585331
Energy: 1.1187099309906667
Energy: 1.1336563039976517
Energy: 1.1326004710646673
Energy: 1.1187099310008901
Energy: 1.1336563039915175
Energy: 1.1326004710708013
Energy: 1.1187099309988455
Energy: 1.133656303995607
Energy: 1.132600471074891
Energy: 1.147176395635522
Energy: 0.9921296294195664
Energy: 1.0773863103196055
Energy: 1.1470795615023017
Energy: 0.992153656512858
Energy: 1.0773863103236954
Energy: 1.1471763956232537
Energy: 0.9921296294195664
Energy: 1.0773863103277848
Energy: 1.1470795615063911
Energy: 1.0894586533642459
Energy: 0.9911927114184109
Energy: 1.1134649604317086
Energy: 1.0894586533560668
Energy: 0.9911927114143215
Energy: 1.1134649604235294
Energy: 1.0894586533683353
Energy: 0.99119271142659
Energy: 1.113464960435798
Energy: 1.0894586533703798
Energy: 1.0623400348456802
Energy: 1.1303471355151051
Energy: 1.003308870466439
Energy: 1.0623400348436356
Energy: 1.1303471355110157
Energy: 1.0045235425247283
Energy: 1.0623400348415906
Energy: 1.1303471355048815
Energy: 1.0033088704643942
Energy: 1.0623400348456802
Energy: 0.9885014580163165
Energy: 1.1213061745086015
Energy: 1.114046649489592
Energy: 0.9885014580183613
Energy: 1.1213061745106463
Energy: 1.1140466494855026
Energy: 0.9885014580224507
Energy: 1.1213061745106463
Energy: 1.1140466494814132
Energy: 0.9885014580183613
Energy: 1.0310123820263195
Energy: 1.1035719875574663
Energy: 0.99555818359556
Energy: 1.0158637654762372
Energy: 1.1035719875636005
Energy: 0.9955581835935152
Energy: 1.0310123820324537
Energy: 1.1035719875636005
Energy: 0.9955581835976046
Energy: 1.0158637654803266
Energy: 1.0302904364755898
Energy: 1.1222781837288807
Energy: 1.100805663397325
Energy: 1.0151620980372278
Energy: 1.1222781837268359
Energy: 1.0993116749414875
Energy: 1.0302904364715002
Energy: 1.1222781837247913
Energy: 1.1008056633952805
Energy: 1.015162098035183
Energy: 0.9882320310000219
Energy: 1.2174992623311667
Energy: 1.1406141742239875
Energy: 0.9882320309959696
Energy: 1.2174992623311667
Energy: 1.140614174217853
Energy: 0.9882320310020667
Energy: 1.2174992623332115
Energy: 1.1406141742239875
Energy: 0.9882320310020667
Energy: 1.034969829645941
Energy: 1.0032441511062535
Energy: 1.1200427737547758
Energy: 1.0349698296438965
Energy: 1.0032441511123877
Energy: 1.1200427737506864
Energy: 1.0349698296398442
Energy: 1.0032441511164771
Energy: 1.120042773746597
Energy: 1.0349698296377994
Energy: 1.1068295274562083
Energy: 1.1128186730379335
Energy: 0.9891396328984539
Energy: 1.1068295274602977
Energy: 1.1128186730297545
Energy: 0.9892755238950508
Energy: 1.1068295274521187
Energy: 1.1128186730317993
Energy: 0.9891396328943645
Energy: 1.1068295274562083
Energy: 1.1381635983823248
Energy: 1.0947133020079123
Energy: 0.9923762008722248
Energy: 1.1381635983843699
Energy: 1.094713302009957
Energy: 0.992376200859956
Energy: 1.1381635983803176
Energy: 1.094713302016091
Energy: 0.9923762008640457
Energy: 1.1381635983803176
Energy: 1.1157409848504203
Energy: 1.1159236529605123
Energy: 1.1045559409430996
Energy: 1.1157409848504203
Energy: 1.1159236529625571
Energy: 1.104555940949234
Energy: 1.11574098485451
Energy: 1.1159236529707361
Energy: 1.1045559409451446
Energy: 1.1157409848483757
Energy: 1.1206002253145888
Energy: 1.0731600548930715
Energy: 0.9883110574073815
Energy: 1.1206002253023204
Energy: 1.073160054903295
Energy: 0.9883110574114709
Energy: 1.1206002253023204
Energy: 1.0731600548992055
Energy: 0.9883110574135157
Energy: 1.1206002253166332
Energy: 1.0242937556502756
Energy: 1.074410973224049
Energy: 1.0313532932624168
Energy: 1.0242937556584544
Energy: 1.074410973224049
Energy: 1.031353293260372
Energy: 1.024293755654365
Energy: 1.074410973222004
Energy: 1.031353293260372
Energy: 1.02429375565232
Energy: 1.1109521176438848
Energy: 1.017320365682703
Energy: 1.019147874659682
Energy: 1.1109521176500188
Energy: 1.017320365682703
Energy: 1.0191478746617266
Energy: 1.11095211764184
Energy: 1.017320365682703
Energy: 1.0191478746576372
Energy: 1.1109521176397952
Energy: 1.1851155578085728
Energy: 0.9887412611552744
Energy: 1.075613824772819
Energy: 1.1851155578085728
Energy: 0.9887412611654982
Energy: 1.0756138247769087
Energy: 1.1851155578126622
Energy: 0.9887412611654982
Energy: 1.075613824780998
Energy: 1.185115557806528
Energy: 1.0246199908296978
Energy: 1.3153916794956069
Energy: 1.024723434575236
Energy: 1.0246199908296978
Energy: 1.3153916794935623
Energy: 1.0247234345711465
Energy: 1.0246199908337872
Energy: 1.3153916794935623
Energy: 1.0247234345731915
Energy: 1.0246199908419662
Energy: 1.0264118687483985
Energy: 0.9914162663496634
Energy: 1.1598338094451695
Energy: 1.026411868746354
Energy: 0.9914159809185353
Energy: 1.1598338094451695
Energy: 1.0264118687565402
Energy: 0.9914162663598869
Energy: 1.15983380944108
Energy: 1.0264118687524508
Energy: 1.0461157524198998
Energy: 1.0065232352239482
Energy: 1.1111183935809072
Energy: 1.0461157524178548
Energy: 1.0065232352219031
Energy: 1.1111183935788627
Energy: 1.0461157524137654
Energy: 1.0065232352219031
Energy: 1.1111183935788627
Energy: 1.0461157524219444
Energy: 1.006024732079372
Energy: 1.0344740618841322
Energy: 1.0034380474763918
Energy: 1.0060247320773272
Energy: 1.0344740618943187
Energy: 1.0034544491144421
Energy: 1.0060247320773272
Energy: 1.0344740618882216
Energy: 1.003438047482526
Energy: 1.006024732079372
Energy: 0.9888687215010662
Energy: 1.0575494701778254
Energy: 1.1726861110198743
Energy: 0.9888687215031109
Energy: 1.0575494701778254
Energy: 1.1726861110260085
Energy: 0.9888687214969768
Energy: 1.0575494701860044
Energy: 1.1726861110219189
Energy: 0.9888687214990215
Energy: 1.0154529543383402
Energy: 1.1033211776626743
Energy: 1.1292117336274068
Energy: 1.0154529543362956
Energy: 1.1033211776708163
Energy: 1.1292117336233545
Energy: 1.0154529543424298
Energy: 1.1033211776606298
Energy: 1.1292117336233545
Energy: 1.0154529543342508

minimum gb energy = 0.9879771825415264 eV
minimum distance =  2.20183538066664 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 0.9628609434164954
Energy: 0.9571229219343593
Energy: 0.9570735457903986
Energy: 0.9628609434187301
Energy: 0.9571229219358492
Energy: 0.957073545786674
Energy: 0.9628609434157503
Energy: 0.9571229219395738
Energy: 0.9570735457889088
Energy: 0.9628609434187301
Energy: 1.0640956332439668
Energy: 0.9424963187942694
Energy: 0.94064789003874
Energy: 1.0640956332402423
Energy: 0.9424963187942694
Energy: 0.9406478900379952
Energy: 1.0640956332439668
Energy: 0.9424963187942694
Energy: 0.940647890039485
Energy: 1.0640956332394973
Energy: 1.0472327625843416
Energy: 0.9294038061503186
Energy: 1.1712907873439433
Energy: 1.0472327625850864
Energy: 0.9294038061510635
Energy: 1.1712907873417084
Energy: 1.0472327625835964
Energy: 0.9294038061510635
Energy: 1.1712907873439433
Energy: 1.0472327625843416
Energy: 1.0409811473718364
Energy: 1.1176066755589318
Energy: 1.0265793699799755
Energy: 1.0409811473733264
Energy: 1.117606675553717
Energy: 1.0265793699799755
Energy: 1.0409811473718364
Energy: 1.117606675558187
Energy: 1.0265793699799755
Energy: 1.0409811473725812
Energy: 1.0357524331467631
Energy: 0.9547512988229102
Energy: 1.1483848102853749
Energy: 1.0357524331527224
Energy: 0.9547512988243662
Energy: 1.1483848102823948
Energy: 1.0357524331489978
Energy: 0.9547512988243662
Energy: 1.1483848102853749
Energy: 1.0357524331557022
Energy: 1.0010863003737918
Energy: 1.0804498489584897
Energy: 0.9426588522139053
Energy: 1.0010863003767716
Energy: 1.0804498489584897
Energy: 0.942658852207201
Energy: 1.0010863003730468
Energy: 1.0804498489584897
Energy: 0.9426588522139053
Energy: 1.0010863003767716
Energy: 1.087004532659091
Energy: 0.9764940904996255
Energy: 0.9294529174337179
Energy: 1.087004532658346
Energy: 0.976494090494411
Energy: 0.9294529174307382
Energy: 1.087004532658346
Energy: 0.9764940904996255
Energy: 0.929452917432228
Energy: 1.087004532658346
Energy: 1.0211209497094234
Energy: 1.099444023300556
Energy: 1.0209396092211382
Energy: 1.0211209497079334
Energy: 1.099444023300556
Energy: 1.0209396092241179
Energy: 1.0211209497086784
Energy: 1.099444023300556
Energy: 1.0209396092189034
Energy: 1.0211209497079334
Energy: 1.1400987238385905
Energy: 1.0718279021542545
Energy: 0.955035214653471
Energy: 1.1400987238430602
Energy: 1.071827902156489
Energy: 0.9550352146512362
Energy: 1.1400987238460398
Energy: 1.0718279021535093
Energy: 0.955035214653471
Energy: 1.1400987238393354
Energy: 1.0271526503021406
Energy: 1.0621880523219542
Energy: 1.0361629575342994
Energy: 1.0271526503036308
Energy: 1.0621880523241891
Energy: 1.0361629575335543
Energy: 1.0271526503013957
Energy: 1.0621880523234442
Energy: 1.0361629575350442
Energy: 1.0271526503036308
Energy: 1.011450230863969
Energy: 1.0115806812661223
Energy: 1.0965776365238031
Energy: 1.0114502308587543
Energy: 1.0115806812653776
Energy: 1.096577636526038
Energy: 1.011450230863969
Energy: 1.0115806812661223
Energy: 1.0965776365245479
Energy: 1.0114502308587543
Energy: 1.062234968334047
Energy: 0.9390223808057206
Energy: 1.0583051853991214
Energy: 1.062234968334792
Energy: 0.939022380802741
Energy: 1.0583051853998664
Energy: 1.062234968334047
Energy: 0.9390223808057206
Energy: 1.0583051853998664
Energy: 1.062234968334047
Energy: 0.937825254842868
Energy: 1.0120599207174623
Energy: 0.9379997041785854
Energy: 0.9378252548465926
Energy: 1.0120599207189522
Energy: 0.9379997041823099
Energy: 0.9378252548465926
Energy: 1.0120599207174623
Energy: 0.9379997041770954
Energy: 0.9378252548443579
Energy: 1.051573520987448
Energy: 0.9656850143274646
Energy: 1.0224487643838849
Energy: 1.0515735209829784
Energy: 0.9656850143282095
Energy: 1.0224487643838849
Energy: 1.051573520987448
Energy: 0.9656850143274646
Energy: 1.02244876438463
Energy: 1.0515735209837231

minimum gb energy = 0.9294038061503186 eV
minimum distance =  2.22610105303797 Angstroms
sigma value = 33