Model name: model_name=EAM_Dynamo_AcklandTichyVitek_1987_Au__MO_104891429740_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.078000083565712
cohesive_energy=3.7893432929779536
mass=196.9665
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[7.82068878177786e-21, 1.174496409849942e-19, 1.9807068855488397e-19, 2.59502947232346e-19, 3.0889965503519997e-19, 3.500804010589019e-19, 3.85353921833046e-19, 4.1608206749653196e-19, 4.42644553911618e-19, 4.652112118015079e-19, 4.8492279092961e-19, 5.03077054369464e-19, 5.201290202851259e-19, 5.358431687113979e-19, 5.5003364715873595e-19, 5.62609131559002e-19, 5.73537578379516e-19, 5.828302028567159e-19, 5.90520650699916e-19, 5.96664998091306e-19, 6.013225255663439e-19, 6.04563728896926e-19, 6.0645589950168e-19, 6.0707273750577e-19, 6.063549623737379e-19, 6.038091037023119e-19, 5.987606451285779e-19, 5.904197135719739e-19, 5.77852240054878e-19, 5.59959131406366e-19, 5.354362158463619e-19, 5.02897610586456e-19, 4.622407763220719e-19, 4.1427801660664794e-19, 3.6004113319247993e-19, 2.9909112968185198e-19, 2.2933556339076e-19, 1.4811385980078359e-19, 5.206929864602939e-20, -6.351076242475019e-20, -2.0543108801148e-19, -3.8262861937861203e-19, -6.0624761653926e-19, -8.839801295132579e-19, -1.2232794840019739e-18, -1.64450614067028e-18, -2.18451977515998e-18, -2.88901286289612e-18, -3.77854133009292e-18, -4.95059762492928e-18, -6.5994456642776995e-18]
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: 0.011483840616225378
Energy: 0.012105985275877239
Energy: 0.49899182316341545
Energy: 0.012105985275877239
Energy: 0.012105985275877239
Energy: 0.6854270212429164
Energy: 0.012105985275877239
Energy: 0.685427020936538
Energy: 0.49899182315810336
Energy: 0.012105985275877239
Energy: 0.011483840616225378
Energy: 0.012105985275384363
Energy: 0.012105985275877239
Energy: 0.6854270211827032
Energy: 0.012105985275877239
Energy: 0.685427020811785

minimum gb energy = 0.011483840616225378 eV
minimum distance =  2.85714676647816 Angstroms
sigma value = 1


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

Energy: 0.9981263904775731
Energy: 0.6462235084720649
Energy: 0.6729663356429798
Energy: 0.6462235084702717
Energy: 0.6880131268987506
Energy: 0.7061118154254571
Energy: 0.6647219159312574
Energy: 0.7061118154248593
Energy: 0.6742525430986138
Energy: 0.6742776604212004
Energy: 1.077654868844798
Energy: 0.6742776604212004
Energy: 0.6623876844037023
Energy: 0.6515521255858623
Energy: 0.6751155927686514
Energy: 0.6515521255870579
Energy: 0.9275960257946261
Energy: 0.6494487895614565
Energy: 0.6497343095614538
Energy: 0.6494487895620543
Energy: 0.670157878414626
Energy: 0.7207965981128254
Energy: 0.6501308032057688
Energy: 0.7207965981122276
Energy: 0.7002120917791985
Energy: 0.7446638502314719
Energy: 0.9295341244880357
Energy: 0.7446638502320696
Energy: 0.6513779965729252
Energy: 0.6532775224792073
Energy: 0.6800718534358282
Energy: 0.6532775224786096
Energy: 0.797064565450144
Energy: 0.8272342924168691
Energy: 0.7294605386338817
Energy: 0.8272342924174667
Energy: 0.705182192932353
Energy: 0.7036569218274724
Energy: 0.7115470971085608
Energy: 0.7036569218316566
Energy: 0.8585370229426618
Energy: 0.8270481103563536
Energy: 0.7995489465985638
Energy: 0.8270481103563536
Energy: 0.7022991908690891
Energy: 0.7845283418279873
Energy: 0.6790685199794556
Energy: 0.7845283418267917
Energy: 0.6969025494964937
Energy: 0.7441653246822835
Energy: 1.0019717850171126
Energy: 0.7441653246840767
Energy: 0.670291102742944
Energy: 0.7453469932770714
Energy: 0.6884242498805152
Energy: 0.7453469932770714
Energy: 1.0000960705414828
Energy: 0.6492595243728406
Energy: 0.6504019840002095
Energy: 0.6492595243728406
Energy: 0.6435524878397364
Energy: 0.6490622782643679
Energy: 0.6488509038999437
Energy: 0.6490622782655635
Energy: 0.672754583638384
Energy: 0.670443568848466
Energy: 0.6434630221743144
Energy: 0.670443568848466
Energy: 0.6498708025705897
Energy: 0.6493401689007008
Energy: 0.6901704780519745
Energy: 0.6493401689007008
Energy: 1.076331074711133
Energy: 0.673715687290498
Energy: 0.6747078641328691
Energy: 0.6737156872899002
Energy: 0.6611618387634542
Energy: 0.6493490918527137
Energy: 0.6628136145231897
Energy: 0.6493490918533115
Energy: 0.6513196237003392
Energy: 0.6497516865361225
Energy: 0.9275334395645175
Energy: 0.6497516865337315
Energy: 0.6490473045860606
Energy: 0.6508517432982581
Energy: 0.6699949265770949
Energy: 0.6508517433024424
Energy: 0.9292155047614514
Energy: 0.7446936380925036
Energy: 0.698972586085296
Energy: 0.7446936380942968
Energy: 0.6776557799537932
Energy: 0.6543067166759304
Energy: 0.6895460775920076
Energy: 0.6543067166753327
Energy: 0.7303574174819478
Energy: 0.8275948560514544
Energy: 0.7969385348631635
Energy: 0.8275948560514544
Energy: 0.6755662816083362
Energy: 0.7450503777563516
Energy: 0.7058943039037228
Energy: 0.7450503777545857
Energy: 0.7991377907005104
Energy: 0.8296148239507377
Energy: 0.6526905151429
Energy: 0.8296148239519332
Energy: 0.6763190510975106
Energy: 0.8248333952445001
Energy: 0.7008770992883849
Energy: 0.8248333952427067
Energy: 0.6951046791941288
Energy: 0.7439966670371
Energy: 0.6962830767035487
Energy: 0.7439966670371
Energy: 0.6949818511465127
Energy: 0.7450800062538228
Energy: 0.6632660082270537
Energy: 0.7450800062550182
Energy: 0.6498445037629866
Energy: 0.6494737242357345
Energy: 0.6946882296568102
Energy: 0.6494737242363321
Energy: 0.650013820356478
Energy: 0.6496345666448731
Energy: 0.6435469589391214
Energy: 0.6496345666466663
Energy: 0.6432203875086502
Energy: 0.6531754747868977
Energy: 0.6701883398451282
Energy: 0.6531754747868977

minimum gb energy = 0.6432203875086502 eV
minimum distance =  2.63445188020619 Angstroms
sigma value = 1


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

Energy: 1.125533091416486
Energy: 0.6798864944091221
Energy: 0.7120389434401688
Energy: 0.6798864944091221
Energy: 0.7104319071073167
Energy: 0.7478363195152108
Energy: 0.6881217754684729
Energy: 0.7478363195131662
Energy: 0.7114600860484208
Energy: 0.7123742839270354
Energy: 1.0406130865791023
Energy: 0.7123742839277168
Energy: 0.7004355884958952
Energy: 0.7498248683779167
Energy: 0.7012384611614895
Energy: 0.7498248683820061
Energy: 1.0431178974013293
Energy: 0.6875975314499501
Energy: 0.6890806625390877
Energy: 0.6875975314533578
Energy: 0.7003745130555883
Energy: 0.6883995281975636
Energy: 0.7133123609903802
Energy: 0.6883995281948373
Energy: 0.7511119021952712
Energy: 0.7961542535803036
Energy: 0.8805881410347874
Energy: 0.796154253573488
Energy: 0.7320432079837894
Energy: 0.6907053707126088
Energy: 0.7175482588620986
Energy: 0.6907053707098828
Energy: 0.8831495395498691
Energy: 0.8789805707363119
Energy: 0.8062635771304608
Energy: 0.8789805707329041
Energy: 0.7144228558013846
Energy: 0.7948271677182966
Energy: 0.690615033588534
Energy: 0.7948271677142074
Energy: 0.7413900178325412
Energy: 0.795617527270719
Energy: 0.7528114694283197
Energy: 0.7956175272714004
Energy: 0.7183036324994658
Energy: 0.7961988109695658
Energy: 0.700052130116478
Energy: 0.7961988109729735
Energy: 0.6868086720408981
Energy: 0.6874675633409731
Energy: 0.9534734625443526
Energy: 0.6874675633450623
Energy: 0.687740201295266
Energy: 0.6872664316769563
Energy: 0.6772463068832867
Energy: 0.6872664316708224
Energy: 0.6764162142071413
Energy: 0.7100388327242819
Energy: 0.7098080037292617
Energy: 0.7100388327222373
Energy: 0.696614772218075
Energy: 0.688302759413673
Energy: 0.6883994431566995
Energy: 0.6883027594116284
Energy: 0.7134553709828879
Energy: 0.7128075656430148
Energy: 1.037263429938336
Energy: 0.7128075656409703
Energy: 0.7011808469449491
Energy: 0.6880931797252805
Energy: 0.708813927258029
Energy: 0.6880931797280068
Energy: 0.7131289652831247
Energy: 0.6883388873465169
Energy: 0.6879463083790776
Energy: 0.6883388873485615
Energy: 0.6997029483901999
Energy: 0.6893114377268527
Energy: 0.6887060195230665
Energy: 0.6893114377316234
Energy: 0.6913910716397675
Energy: 0.79646940066013
Energy: 0.8808857159747544
Energy: 0.7964694006621746
Energy: 0.7322919044714221
Energy: 0.6911672382706319
Energy: 0.7132448685587848
Energy: 0.6911672382706319
Energy: 0.8833518869425613
Energy: 0.8803311133301582
Energy: 0.8014415689309744
Energy: 0.8803311133342474
Energy: 0.7136382201085285
Energy: 0.8752860705737295
Energy: 0.6879402967006217
Energy: 0.8752860705737295
Energy: 0.7414784366426589
Energy: 0.7970697674657958
Energy: 0.7520730987405745
Energy: 0.7970697674678404
Energy: 0.7404364807582563
Energy: 0.7961485391089306
Energy: 0.7002826992943916
Energy: 0.7961485391068859
Energy: 0.6862667642778444
Energy: 0.6875172890343728
Energy: 0.7286865857743691
Energy: 0.6875172890343728
Energy: 0.6877967861738967
Energy: 0.6878564508784507
Energy: 0.6771957800880111
Energy: 0.6878564508770877
Energy: 0.6764692624252915
Energy: 0.6990451787078388
Energy: 0.7099476863731344
Energy: 0.6990451787085203

minimum gb energy = 0.6764162142071413 eV
minimum distance =  2.64102754467072 Angstroms
sigma value = 25


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

Energy: 1.080960144956092
Energy: 0.7188860978676868
Energy: 0.7569580219849283
Energy: 0.7188860978684791
Energy: 0.7691222103514871
Energy: 0.7947274009739833
Energy: 0.7350919378280173
Energy: 0.794727400973191
Energy: 0.7563399410574442
Energy: 0.7568521506898921
Energy: 0.9855627431678438
Energy: 0.7568521506890998
Energy: 0.7446824060462448
Energy: 0.7945426409164251
Energy: 0.7346683409288624
Energy: 0.7945426409172174
Energy: 0.9897285752636511
Energy: 0.7347680011149862
Energy: 0.7350295487031469
Energy: 0.7347680011134016
Energy: 0.7434959759730875
Energy: 0.7344469400085121
Energy: 0.7369885071566216
Energy: 0.7344469400085121
Energy: 0.818094591629894
Energy: 0.8624825910152997
Energy: 0.8212720213557005
Energy: 0.8624825910152997
Energy: 0.7275263252913063
Energy: 0.7770454465884555
Energy: 0.7413067170371772
Energy: 0.7770454465868709
Energy: 0.8225119330739898
Energy: 0.8614088376987673
Energy: 0.713097321732735
Energy: 0.8614088376971827
Energy: 0.7441155774263383
Energy: 0.8631617288577629
Energy: 0.7334494766055996
Energy: 0.8631617288577629
Energy: 0.7140884220326973
Energy: 0.73452643846647
Energy: 0.7336827342101853
Energy: 0.7345264384672623
Energy: 0.7142724287405036
Energy: 0.734243189120021
Energy: 0.7343125221062128
Energy: 0.734243189120021
Energy: 0.7576703994815037
Energy: 0.7568330355198244
Energy: 0.7123362913870717
Energy: 0.7568330355206168
Energy: 0.7348191723655568
Energy: 0.7345244082959337
Energy: 0.7691528351335847
Energy: 0.7345244082959337
Energy: 0.7429260234744345
Energy: 0.7565794081545825
Energy: 0.7565352888715453
Energy: 0.7565794081553748
Energy: 0.7549466518260871
Energy: 0.7342317019908166
Energy: 0.7576689752281267
Energy: 0.7342317019916089
Energy: 0.7343080631011552
Energy: 0.7350824991621288
Energy: 0.7428655572559383
Energy: 0.7350824991621288
Energy: 0.7347636469501811
Energy: 0.7361108142521057
Energy: 0.7438972199681063
Energy: 0.7361108142528979
Energy: 0.8212327458338379
Energy: 0.86324177943957
Energy: 0.7394501431188059
Energy: 0.8632417794387778
Energy: 0.7413094152002131
Energy: 0.8641822843255438
Energy: 0.7238896337095888
Energy: 0.8641822843247514
Energy: 0.7695426326292963
Energy: 0.861798070973122
Energy: 0.8237703279969207
Energy: 0.861798070973122
Energy: 0.7518437026388772
Energy: 0.8622025892227649
Energy: 0.7437476747555911
Energy: 0.8622025892235572
Energy: 0.7328028977768588
Energy: 0.7338590200440633
Energy: 0.7143095078850398
Energy: 0.7338590200432711
Energy: 0.7342995294298408
Energy: 0.7339987972046651
Energy: 0.7142728503957058
Energy: 0.7339987972046651
Energy: 0.7124178254022797
Energy: 0.7432798867042865
Energy: 0.7561735853452339
Energy: 0.7432798867042865

minimum gb energy = 0.7123362913870717 eV
minimum distance =  2.64379962065089 Angstroms
sigma value = 9


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

Energy: 1.005772734971224
Energy: 0.757161636421349
Energy: 0.8152332256619024
Energy: 0.757161636421349
Energy: 0.8205481829617767
Energy: 0.846183097774766
Energy: 0.7862815060816389
Energy: 0.8461830977662599
Energy: 0.8057656287301292
Energy: 0.8058415395245414
Energy: 0.7995178593843829
Energy: 0.8058415395235963
Energy: 0.8003578261259631
Energy: 0.8455686379991594
Energy: 0.8068384720462359
Energy: 0.8455686379906531
Energy: 0.7992087146027008
Energy: 0.7864573262286318
Energy: 0.7856089798528684
Energy: 0.7864573262305221
Energy: 0.7979370736960963
Energy: 0.7980215006104797
Energy: 0.7992048699906575
Energy: 0.798021500613315
Energy: 0.8140491926151181
Energy: 0.8791679803984507
Energy: 0.8028174778126382
Energy: 0.8791679803927799
Energy: 0.8033219656667434
Energy: 0.8800057256268984
Energy: 0.8097832680475945
Energy: 0.8800057256287888
Energy: 0.7838778030637757
Energy: 0.7855001600691419
Energy: 0.7501117907135372
Energy: 0.7855001600748126
Energy: 0.8129069280878058
Energy: 0.7851683937023193
Energy: 0.7747343839340486
Energy: 0.7851683937023193
Energy: 0.745349751692315
Energy: 0.8297226393385975
Energy: 0.814429770224682
Energy: 0.8297226393395426
Energy: 0.843997200470573
Energy: 0.7851165216040799
Energy: 0.7858569573989072
Energy: 0.7851165216031346
Energy: 0.8055857880945361
Energy: 0.8053355886585789
Energy: 0.8148649595606111
Energy: 0.8053355886585789
Energy: 0.8055520273863793
Energy: 0.7852898419613958
Energy: 0.7943940099371971
Energy: 0.7852898419604506
Energy: 0.7990760744678249
Energy: 0.7861617698297484
Energy: 0.7855842687047966
Energy: 0.7861617698297484
Energy: 0.7991032173533172
Energy: 0.7862543340603954
Energy: 0.7859175175918213
Energy: 0.7862543340670114
Energy: 0.815114226514695
Energy: 0.8804424328570251
Energy: 0.8029624936184551
Energy: 0.8804424328579701
Energy: 0.8154259604805572
Energy: 0.8819450121508138
Energy: 0.807189108194695
Energy: 0.8819450121498684
Energy: 0.7837277792158177
Energy: 0.7859852707954871
Energy: 0.7497721794948845
Energy: 0.7859852707954871
Energy: 0.8083990448924844
Energy: 0.7852342331873258
Energy: 0.7501518896206122
Energy: 0.7852342331854356
Energy: 0.7457116918115659
Energy: 0.7889230901066201
Energy: 0.8289433351895107
Energy: 0.7889230901000042

minimum gb energy = 0.745349751692315 eV
minimum distance =  2.61494839505355 Angstroms
sigma value = 25


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

Energy: 0.8829466550324521
Energy: 0.7785575196823836
Energy: 0.8586872943960127
Energy: 0.7785575196823836
Energy: 0.7713537978871358
Energy: 0.8334609893496226
Energy: 0.7920402717217002
Energy: 0.8334609893507914
Energy: 0.8470905460328768
Energy: 0.84797343009984
Energy: 0.8436637413475571
Energy: 0.8479734300986712
Energy: 0.8551444865625657
Energy: 0.8338353373715462
Energy: 0.7920935539760235
Energy: 0.8338353373785593
Energy: 0.785459452443683
Energy: 0.7920478441277619
Energy: 0.7921592304396844
Energy: 0.7920478441289307
Energy: 0.7746867973238145
Energy: 0.7913541246930781
Energy: 0.7910670564120975
Energy: 0.7913541246954158
Energy: 0.7709903412122812
Energy: 0.7923126483275686
Energy: 0.7919007728780025
Energy: 0.7923126483310752
Energy: 0.7706324597994031
Energy: 0.8336571614787743
Energy: 0.7911492462433645
Energy: 0.8336571614834497
Energy: 0.8540568018409367
Energy: 0.7752064322425426
Energy: 0.9138755822291419
Energy: 0.7752064322402049
Energy: 0.7919146277649598
Energy: 0.8338574460857933
Energy: 0.8524534915955881
Energy: 0.8338574460904686
Energy: 0.8448781077209464
Energy: 0.8479995446732468
Energy: 0.8587025460838551
Energy: 0.8479995446732468
Energy: 0.8499699362669487
Energy: 0.8337695770434475
Energy: 0.7754588593968501
Energy: 0.8337695770411099
Energy: 0.791216416461051
Energy: 0.9138076084955138
Energy: 0.7853087408838629
Energy: 0.9138076084978516
Energy: 0.7916114988538265
Energy: 0.7916679488029246
Energy: 0.7756633511379721
Energy: 0.7916679488029246
Energy: 0.7914130009422782
Energy: 0.7918048591916853
Energy: 0.770928968854592
Energy: 0.7918048591916853
Energy: 0.7902987374216809
Energy: 0.9016772915374133
Energy: 0.7715215249346498
Energy: 0.9016772915304002
Energy: 0.9294590285193326
Energy: 0.7757649764936703
Energy: 0.7765943223480676
Energy: 0.775764976487826

minimum gb energy = 0.7706324597994031 eV
minimum distance =  2.68785493107614 Angstroms
sigma value = 17


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

Energy: 1.2829938318791663
Energy: 0.8730042815040652
Energy: 0.922495976161734
Energy: 0.8730042815014173
Energy: 0.7759459010895037
Energy: 0.8467550750912545
Energy: 0.8431171150982248
Energy: 0.8467550750905926
Energy: 0.8294083409831949
Energy: 0.8306319049635591
Energy: 1.1567004467892628
Energy: 0.8306319049642211
Energy: 0.8331084540469958
Energy: 0.8859587595868998
Energy: 0.8428726951779626
Energy: 0.8859587595862378
Energy: 0.8325653977834861
Energy: 0.846578138306961
Energy: 0.7823610058999962
Energy: 0.8465781383062991
Energy: 0.8275072223924954
Energy: 0.857347366953178
Energy: 0.832376486620052
Energy: 0.8573473669511921
Energy: 0.8710564617377006
Energy: 0.8261293747253389
Energy: 0.8263259832091147
Energy: 0.8261293747246767
Energy: 0.9866823690755157
Energy: 0.8328411740274857
Energy: 0.7888242531270039
Energy: 0.8328411740274857
Energy: 0.9261602397312382
Energy: 0.9263637184031681
Energy: 0.9404478116790245
Energy: 0.9263637184025062
Energy: 0.9310057878046661
Energy: 0.8917034160942118
Energy: 0.8419520297818697
Energy: 0.8917034160915637
Energy: 0.8295886230087266
Energy: 0.7876208834831303
Energy: 0.7849445961675833
Energy: 0.7876208834864101
Energy: 0.895380958804443
Energy: 0.7897757138037954
Energy: 0.7892525485785378
Energy: 0.7897757138011475
Energy: 0.8802191992221586
Energy: 0.7885086017264265
Energy: 0.8035928304902633
Energy: 0.7885086017237786
Energy: 0.8725151297416
Energy: 0.7909645733499726
Energy: 0.7865234593871239
Energy: 0.790964573312902
Energy: 0.9298189913022601
Energy: 0.8826026671496676
Energy: 0.8776825717386557
Energy: 0.8826026671523154
Energy: 0.8870284644106361
Energy: 0.8739335755856004
Energy: 0.984306422347538
Energy: 0.8739335755862624
Energy: 0.9265400001783256
Energy: 0.8315597442707013
Energy: 0.7876334985544462
Energy: 0.8315597442707013
Energy: 0.8787209207458785
Energy: 0.8445838229463203
Energy: 0.8233677822014032
Energy: 0.8445838229463203
Energy: 0.8316015719312585
Energy: 0.8494376613462139
Energy: 0.829917214875834
Energy: 0.8494376613256927
Energy: 0.8345603380462059
Energy: 0.8258800415131378
Energy: 0.8328199193770514
Energy: 0.8258800415118137
Energy: 0.8274855506974828
Energy: 0.8450267269636819
Energy: 0.9597734596757271
Energy: 0.845026726961034
Energy: 0.8351593251555243
Energy: 0.8302769420345458
Energy: 0.8740919508759579
Energy: 0.8302769420358699
Energy: 0.8757229015451035
Energy: 0.8925682302768425
Energy: 0.8854547397365835
Energy: 0.8925682302768425
Energy: 0.9406149382302299
Energy: 0.9265761554430072
Energy: 0.9268369677976412
Energy: 0.9265761554423452
Energy: 0.7893915160471133
Energy: 0.8051750073347114
Energy: 0.9291443957112369
Energy: 0.8051750073300775
Energy: 0.7898625020936031
Energy: 0.7902350167974996
Energy: 0.8270107141039518
Energy: 0.7902350167974996
Energy: 0.7845326249793942
Energy: 0.7894927793926552
Energy: 0.8895815779701803
Energy: 0.7894927793926552
Energy: 0.7886603497965472
Energy: 0.789964394480435
Energy: 0.8787051366889072
Energy: 0.789964394479111
Energy: 0.789131028145973
Energy: 0.8337304689397689
Energy: 0.8802863209583791
Energy: 0.8337304689397689
Energy: 1.2800711361406205
Energy: 0.9246215205927855
Energy: 0.9228639235966871
Energy: 0.9246215205934475

minimum gb energy = 0.7759459010895037 eV
minimum distance =  2.63386044489589 Angstroms
sigma value = 53


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

Energy: 1.1821632840123892
Energy: 0.7024102037017211
Energy: 0.8511085537264728
Energy: 0.7024102037032451
Energy: 0.962182999954639
Energy: 0.7593335321552557
Energy: 0.9007592670108002
Energy: 0.7593335321735434
Energy: 0.849917259356226
Energy: 0.8510147236261866
Energy: 0.8343321782260036
Energy: 0.8510147236246972
Energy: 0.8433246601692229
Energy: 0.7562423301100553
Energy: 0.8997754975905243
Energy: 0.7562423300948155
Energy: 0.8519269728346752
Energy: 0.7587839801722178
Energy: 0.7031620652407657
Energy: 0.7587839801798378
Energy: 0.9002564004122585
Energy: 0.7557290280744716
Energy: 0.7005676056040189
Energy: 0.7557290280790435
Energy: 0.962502235727295
Energy: 0.8439655961263912
Energy: 0.8514123006182819
Energy: 0.8439655961233433
Energy: 0.9739817938249483
Energy: 0.7545559453281482
Energy: 0.8395067647373055
Energy: 0.7545559453144324
Energy: 0.8504966238137521
Energy: 0.8446095098811922
Energy: 0.8351003424182016
Energy: 0.8446095098811922
Energy: 0.8400241897012702
Energy: 0.7590528492441997
Energy: 0.9037156160278016
Energy: 0.7590528492487717
Energy: 0.9471259967134188
Energy: 0.7572511341208117
Energy: 0.701818379086625
Energy: 0.7572511341223358
Energy: 0.8436551333822111
Energy: 0.7591782513443037
Energy: 0.7033095238884951
Energy: 0.7591782513397317
Energy: 0.9735772002572557
Energy: 0.7555652229450567
Energy: 0.8371777159991606
Energy: 0.7555652229450567

minimum gb energy = 0.7005676056040189 eV
minimum distance =  2.68274277836882 Angstroms
sigma value = 9


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

Energy: 1.1279473808107885
Energy: 0.8601573422012888
Energy: 0.9489640943278184
Energy: 0.8601573421093485
Energy: 0.8147275133383265
Energy: 0.7649673461917385
Energy: 0.9665337053628524
Energy: 0.7649673461928665
Energy: 0.756541176496193
Energy: 0.7560825604025905
Energy: 0.9742516861387084
Energy: 0.7560825604020264
Energy: 0.7545700458581894
Energy: 0.7559021906496842
Energy: 1.0174442273953976
Energy: 0.7559021906485561
Energy: 0.7641814961165537
Energy: 0.7575079623635421
Energy: 0.9843658758058754
Energy: 0.7575079623635421
Energy: 0.7620309652837199
Energy: 0.7611790307751627
Energy: 0.9820608331159894
Energy: 0.7611790307757268
Energy: 0.960250109257726
Energy: 0.9188008171382072
Energy: 0.9630877445287706
Energy: 0.9188008171382072
Energy: 0.9590512092915076
Energy: 0.8433931282260142
Energy: 0.9183001794633725
Energy: 0.8433931282243222
Energy: 0.8003698251008595
Energy: 0.8452206482894444
Energy: 0.7978508330791357
Energy: 0.8452206482877522
Energy: 0.7770069767621731
Energy: 0.8319360133284663
Energy: 0.9204591160805952
Energy: 0.8319360133284663
Energy: 0.7996313761704035
Energy: 0.8007200901425681
Energy: 0.9286303069655423
Energy: 0.8007200901425681
Energy: 0.8515095927288776
Energy: 0.8099842137677015
Energy: 0.9810062375923504
Energy: 0.8099842137699577
Energy: 0.9610953491930849
Energy: 0.7998952368324833
Energy: 0.8107690639709213
Energy: 0.7998952368336113
Energy: 0.9604904201982846
Energy: 0.8016838532913192
Energy: 0.8003743388494912
Energy: 0.8016838532913192
Energy: 0.9170027495244176
Energy: 0.8054716322952038
Energy: 0.8009199871376532
Energy: 0.8054716322957679
Energy: 0.8492415187144858
Energy: 0.915426272601263
Energy: 0.8013088751246488
Energy: 0.915426272603519
Energy: 0.9203533412725714
Energy: 0.8559470975347386
Energy: 0.8009019039660163
Energy: 0.8559470975353026
Energy: 0.9463412832277776
Energy: 0.9449510675354488
Energy: 0.9789863314168451
Energy: 0.9449510675331926
Energy: 0.9670554041564862
Energy: 0.7565505203644651
Energy: 0.81609134724686
Energy: 0.7565505203661573
Energy: 1.0385498911830493
Energy: 0.7554422015261066
Energy: 0.7559826141495346
Energy: 0.7554422015227225
Energy: 0.9579102554149965
Energy: 0.7562208131882362
Energy: 0.7546049435286432
Energy: 0.7562208131893643
Energy: 0.9819696031936853
Energy: 0.76482846008059
Energy: 0.7638867410530716
Energy: 0.764828460081154
Energy: 0.9817188006467473
Energy: 0.7566271265563772
Energy: 0.7604861707402216
Energy: 0.7566271265591974
Energy: 0.9625759449208805
Energy: 0.9180450878795188
Energy: 0.9595740033989243
Energy: 0.9180450878806469
Energy: 0.9185782082628241
Energy: 0.8425705457293783
Energy: 0.9595152615412155
Energy: 0.8425705457299422
Energy: 0.8015124752450073
Energy: 0.8450599671914129
Energy: 0.8001945554524429
Energy: 0.8450599671925411
Energy: 0.9171782216014125
Energy: 0.8240577491976696
Energy: 0.7767726929697684
Energy: 0.8240577491982337
Energy: 0.9281617320219712
Energy: 0.8011748956323871
Energy: 0.8010916057986852
Energy: 0.8011748956318231
Energy: 0.9806444018346356
Energy: 0.8025906517591994
Energy: 0.8489459356100109
Energy: 0.8025906517597635
Energy: 0.8110187953798609
Energy: 0.7869946924376587
Energy: 0.962209546609622
Energy: 0.7869946924393509
Energy: 0.8013286299494086
Energy: 0.8022782028998866
Energy: 0.9123321627652502
Energy: 0.8022782029010146
Energy: 0.8054089435811204
Energy: 0.7890589562140748
Energy: 0.9171513174170779
Energy: 0.789058956214639
Energy: 0.8054358879909482
Energy: 0.9138372203069346
Energy: 0.8484928394968322
Energy: 0.9138372203069346
Energy: 0.7977749805684153
Energy: 0.7634616509812571
Energy: 0.8508227299776989
Energy: 0.7634616509818212
Energy: 0.9789564568267086
Energy: 0.9188657327309961
Energy: 0.944657796223334
Energy: 0.9188657327332523

minimum gb energy = 0.7545700458581894 eV
minimum distance =  2.6546619856946 Angstroms
sigma value = 73


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

Energy: 1.0615028150950054
Energy: 0.7555146946832312
Energy: 0.9004704999666708
Energy: 0.7555146946805669
Energy: 0.8598759585677327
Energy: 0.7659189395788397
Energy: 0.8791097899373028
Energy: 0.7659189395770498
Energy: 0.7503928245602101
Energy: 0.7514658967618875
Energy: 0.8400756544419149
Energy: 0.7514658967681517
Energy: 0.752633333044444
Energy: 0.7523135366633122
Energy: 0.9579727546415282
Energy: 0.7523135366865596
Energy: 0.7534187424016194
Energy: 0.7539200187429683
Energy: 0.9479390319233384
Energy: 0.7539200187438633
Energy: 0.7536506314450742
Energy: 0.7543576959287626
Energy: 0.9465648759473653
Energy: 0.7543576959278676
Energy: 0.8642664975126116
Energy: 0.8519692395061003
Energy: 0.8633705404151654
Energy: 0.8519692395061003
Energy: 0.8576411105920088
Energy: 0.8131089071168858
Energy: 0.8507978857136693
Energy: 0.8131089071159909
Energy: 0.852042608005822
Energy: 0.8121969738729725
Energy: 0.8544075054787883
Energy: 0.8121969738729725
Energy: 0.7822284901180782
Energy: 0.8290762128939354
Energy: 0.8514404465569356
Energy: 0.8290762128984099
Energy: 0.8510397832392327
Energy: 0.8119006784291994
Energy: 0.7397344997446316
Energy: 0.8119006784283046
Energy: 0.9014204710331988
Energy: 0.8501525799736712
Energy: 0.9438460234781378
Energy: 0.850152579994234
Energy: 0.8387942070071366
Energy: 0.75426803072685
Energy: 0.7529408226684557
Energy: 0.7542680307250603
Energy: 0.8395193058053747
Energy: 0.7533547140208587
Energy: 0.7534777387348705
Energy: 0.7533547140351571
Energy: 0.9577954758581363
Energy: 0.752150904572296
Energy: 0.7504805201544458
Energy: 0.7521509045651366
Energy: 0.9477275377840726
Energy: 0.7520942450748107
Energy: 0.7508737311314837
Energy: 0.7520942450774954
Energy: 0.9473096444768491
Energy: 0.7659984731828687
Energy: 0.7532421068356684
Energy: 0.7659984731837637
Energy: 0.8945079710909931
Energy: 0.8930051191935721
Energy: 0.8458241132153377
Energy: 0.8930051191953619
Energy: 0.8529282881566614
Energy: 0.8285535046813545
Energy: 0.8567710710770867
Energy: 0.8285535046804595
Energy: 0.9383457270540863
Energy: 0.8311515577627868
Energy: 0.8505432480033509
Energy: 0.8311515577636818
Energy: 0.8507580670208086
Energy: 0.8233080658173657
Energy: 0.7417056411532545
Energy: 0.8233080658191555
Energy: 0.9413842473527877
Energy: 0.8520440650498453
Energy: 0.8497669250876893
Energy: 0.8520440650480555

minimum gb energy = 0.7397344997446316 eV
minimum distance =  2.66577156966187 Angstroms
sigma value = 7


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

Energy: 1.301469886620927
Energy: 0.7644860399021535
Energy: 0.9018931259203588
Energy: 0.7644860398901303
Energy: 0.7623358991893819
Energy: 0.831379870812246
Energy: 0.929764527277679
Energy: 0.831379870812246
Energy: 0.7563064093108941
Energy: 0.7569437322689347
Energy: 0.8711206609039921
Energy: 0.7569437322714659
Energy: 0.757715689756873
Energy: 0.7587840316716734
Energy: 0.9406937204436088
Energy: 0.7587840316685094
Energy: 0.7553305790789486
Energy: 0.7569296795329193
Energy: 0.9065115260933301
Energy: 0.7569296795411458
Energy: 0.8548662707885373
Energy: 0.7581325594876652
Energy: 0.9065574502360163
Energy: 0.7581325594983941
Energy: 0.9281408108917257
Energy: 0.7574408097701276
Energy: 0.7671026119401023
Energy: 0.7574408097694948
Energy: 0.9254431522671139
Energy: 0.7566838753436878
Energy: 0.7561609469978327
Energy: 0.7566838753455861
Energy: 0.9429578020735327
Energy: 0.7931474101549767
Energy: 0.790137037416757
Energy: 0.7931474101581119
Energy: 1.0315604333071624
Energy: 0.7567361740389604
Energy: 0.7554006046481925
Energy: 0.7567361740326324
Energy: 0.941284422580286
Energy: 0.8306959115551563
Energy: 0.8499969693563342
Energy: 0.830695911556422
Energy: 0.892020739263563
Energy: 0.8318453849891666
Energy: 0.9243861345329305
Energy: 0.8318453849828386
Energy: 0.8330145920021077
Energy: 0.809378676942572
Energy: 0.8324080859731555
Energy: 0.8093786769368768
Energy: 0.8322100916631157
Energy: 0.8078354958746861
Energy: 0.7506052262220414
Energy: 0.8078354958696524
Energy: 0.8313746401089543
Energy: 0.8092365003179687
Energy: 0.7538952878044648
Energy: 0.809236500316703
Energy: 0.9421676295381395
Energy: 0.8335787206505854
Energy: 0.8924567044606931
Energy: 0.8335787206474213
Energy: 0.9421595619905592
Energy: 0.8292697753072755
Energy: 0.928440792173735
Energy: 0.8292697753091739
Energy: 0.7562283806274367
Energy: 0.7573034273298429
Energy: 0.9129831951538196
Energy: 0.7573034273304757
Energy: 0.7926143708560005
Energy: 0.792977707251893
Energy: 0.9426998731610496
Energy: 0.792977707251893
Energy: 0.7560661159595884
Energy: 0.7565410961072573
Energy: 0.958320349247124
Energy: 0.7565410961141893
Energy: 0.7647057896009933
Energy: 0.7565742711903612
Energy: 0.9076585729405537
Energy: 0.7565742711884629
Energy: 0.9269304654655623
Energy: 0.758407808557501
Energy: 0.8553374622112568
Energy: 0.7584078085587667
Energy: 0.9280827294327618
Energy: 0.757312389396964
Energy: 0.7544402050666773
Energy: 0.7573123893988624
Energy: 0.9402191402332398
Energy: 0.7590509443390214
Energy: 0.7581373274142529
Energy: 0.7590509443377558
Energy: 0.9090389937597366
Energy: 0.7572214469481364
Energy: 0.7558978868309201
Energy: 0.757221446949402
Energy: 0.9090645741258158
Energy: 0.8305233683422608
Energy: 0.757531700824956
Energy: 0.8305233683352999
Energy: 0.8950660907578453
Energy: 0.8944083879374666
Energy: 1.1459309285485018
Energy: 0.8944083879305057
Energy: 0.8307427195581738
Energy: 0.8326363036238813
Energy: 0.8327907192576038
Energy: 0.8326363036219829
Energy: 0.8728018432077351
Energy: 0.8095384437426353
Energy: 0.8348790383088196
Energy: 0.8095384437407369
Energy: 0.829856525106203
Energy: 0.8083559887525946
Energy: 0.7504533362634734
Energy: 0.8083559887506964
Energy: 0.9447810534073708
Energy: 0.8324610117245573
Energy: 0.8315417544241037
Energy: 0.8324610117232917

minimum gb energy = 0.7504533362634734 eV
minimum distance =  2.64950765434009 Angstroms
sigma value = 29


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

Energy: 0.7866873747312223
Energy: 0.9609146113554001
Energy: 0.7982154440682712
Energy: 0.9609146113551797
Energy: 0.6849229901657186
Energy: 0.7523130340352235
Energy: 0.6968367385416172
Energy: 0.7523130340326275
Energy: 0.799836131965229
Energy: 0.6970432513902399
Energy: 0.6902749271079974
Energy: 0.6970432513876684
Energy: 0.6856600644540833
Energy: 0.6962253673188005
Energy: 0.6940678868651246
Energy: 0.6962253673235271
Energy: 0.6937155320069055
Energy: 0.6975288705482572
Energy: 0.685684165412087
Energy: 0.6975288705439467
Energy: 0.6935674091163923
Energy: 0.75238637705088
Energy: 0.6856648426513392
Energy: 0.7523863770498024
Energy: 0.688979489808544
Energy: 0.7562234949560792
Energy: 0.8000562327641475
Energy: 0.7562234949562996
Energy: 0.6967246417646751
Energy: 0.6993699413068157
Energy: 0.684999496849468
Energy: 0.6993699413070362
Energy: 0.6845809995452612
Energy: 0.7442818519222343
Energy: 0.7428001201964541
Energy: 0.7442818519226752

minimum gb energy = 0.6845809995452612 eV
minimum distance =  2.63538168024748 Angstroms
sigma value = 5


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

Energy: 1.078506847295017
Energy: 0.7476122658992314
Energy: 0.8727201016316726
Energy: 0.7476122659022201
Energy: 0.7907873685931114
Energy: 0.7406638928718536
Energy: 0.8420115549679706
Energy: 0.7406638928712559
Energy: 0.8403578082271771
Energy: 0.7908623403908116
Energy: 0.8394019379204105
Energy: 0.7908623403878229
Energy: 0.7940889197675831
Energy: 0.7418301210404016
Energy: 0.844985044381833
Energy: 0.7418301210421948
Energy: 0.8460104364413
Energy: 0.74241229372671
Energy: 0.7933225511490042
Energy: 0.7424122937231235
Energy: 0.7434177220159887
Energy: 0.7422204124674
Energy: 0.7928900110269039
Energy: 0.7422204124638135
Energy: 0.7456637887679087
Energy: 0.7445345959548795
Energy: 0.845460420040487
Energy: 0.7445345959518906
Energy: 0.7409809045699561
Energy: 0.7419636616018995
Energy: 0.8845111068484777
Energy: 0.7419636615995084
Energy: 0.7965595444308143
Energy: 0.78038064816267
Energy: 0.885826404038251
Energy: 0.7803806481632679
Energy: 0.9571428168191684
Energy: 0.7451474479198733
Energy: 0.7454883560636713
Energy: 0.7451474479192756
Energy: 0.7944619524408026
Energy: 0.7437352277678952
Energy: 0.7467359274641587
Energy: 0.7437352277661019
Energy: 0.8846749855024268
Energy: 0.7386883252799972
Energy: 0.743379581115194
Energy: 0.7386883252793992
Energy: 0.8888016997513596
Energy: 0.7395079925045451
Energy: 0.7461382289201766
Energy: 0.7395079925045451
Energy: 0.78934926971619
Energy: 0.7796296888612996
Energy: 0.8873552542533929
Energy: 0.7796296888607018
Energy: 0.7843108072738931
Energy: 0.7318902997386721
Energy: 0.8833970649592038
Energy: 0.731890299736281
Energy: 0.786837555237936
Energy: 0.7301977055151407
Energy: 0.7436044312628752
Energy: 0.7301977055187273
Energy: 0.8211696204764204
Energy: 0.7925375154246584
Energy: 0.7486025060238191
Energy: 0.7925375154222674
Energy: 0.8829728106458148
Energy: 0.7304618104534946
Energy: 0.7322732873351359
Energy: 0.7304618104528968
Energy: 0.8809115325817759
Energy: 0.7799575900377059
Energy: 0.7441556119881987
Energy: 0.7799575900406945
Energy: 0.8834612233770176
Energy: 0.8883164682375012
Energy: 0.8438801428379729
Energy: 0.8883164682333169
Energy: 0.792509541762066
Energy: 0.7445212655640789
Energy: 0.7480861336631316
Energy: 0.7445212655610902
Energy: 0.794117310300121
Energy: 0.745348467542252
Energy: 0.7485782092155554
Energy: 0.7453484675434475
Energy: 0.9356266426892988
Energy: 0.7445127418890843
Energy: 0.7459837783463747
Energy: 0.7445127418837317
Energy: 0.8918065741847011
Energy: 0.744560148446885
Energy: 0.7436437144737155
Energy: 0.7445601484540582
Energy: 0.8871766476693324
Energy: 0.8699308201137343
Energy: 0.754205026674666
Energy: 0.8699308201155276
Energy: 0.7439845035133867
Energy: 0.7411083798664599
Energy: 0.9572394957266981
Energy: 0.741108379864069
Energy: 0.7442253196682188
Energy: 0.742826160516993
Energy: 0.7428314076380332
Energy: 0.7428261605074561
Energy: 0.7405032921554979
Energy: 0.7403791476936439
Energy: 0.7429344909874658
Energy: 0.7403791476966326
Energy: 0.743246473449066
Energy: 0.7374969761585077
Energy: 0.8825845921394467
Energy: 0.7374969761597032
Energy: 0.885229807147781
Energy: 0.7746135911015433
Energy: 0.7440222942734726
Energy: 0.7746135911003478
Energy: 0.8856714896803203
Energy: 0.7418119939996863
Energy: 0.7404397298458839
Energy: 0.7418119940014796
Energy: 0.850708945561244
Energy: 0.7409986313567045
Energy: 0.7404910828172533
Energy: 0.7409986313501564
Energy: 0.7440464393524543
Energy: 0.744573924347827
Energy: 0.7520132912178498
Energy: 0.7445739243341057

minimum gb energy = 0.7301977055151407 eV
minimum distance =  2.6559663082104 Angstroms
sigma value = 1


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

Energy: 1.0684791325562737
Energy: 0.7074715050778555
Energy: 0.843610622615255
Energy: 0.7074715050770665
Energy: 0.7338451837488833
Energy: 0.714890539802175
Energy: 0.8560741347234605
Energy: 0.714890539802175
Energy: 0.8543555530641591
Energy: 0.7830911346377963
Energy: 0.8545716241367242
Energy: 0.7830911346361433
Energy: 0.7483165664053243
Energy: 0.717238292842202
Energy: 0.8600572391214844
Energy: 0.717238292842202
Energy: 0.721757251109717
Energy: 0.7171696554187245
Energy: 0.8614443513774198
Energy: 0.7171696554203774
Energy: 0.7169338946520392
Energy: 0.7166796200276521
Energy: 0.8491304902320669
Energy: 0.7166796200243462
Energy: 0.7281105926292336
Energy: 0.7297409199602798
Energy: 0.8586647694304816
Energy: 0.7297409199619328
Energy: 0.7154224612589983
Energy: 0.7161102034858188
Energy: 0.9796178027637613
Energy: 0.7161102034882981
Energy: 0.8556416118621453
Energy: 0.7640187762486951
Energy: 0.9835976868525075
Energy: 0.7640187762544807
Energy: 0.9063290804527846
Energy: 0.7161080888374449
Energy: 0.7158296994547058
Energy: 0.7161080888349654
Energy: 0.8573889453979745
Energy: 0.728061106194957
Energy: 0.7285046233878584
Energy: 0.7280611061990894
Energy: 0.9729994151444311
Energy: 0.7163418470465158
Energy: 0.7167077898778849
Energy: 0.7163418470432099
Energy: 0.9730888724457168
Energy: 0.7188463644377099
Energy: 0.7233332492138939
Energy: 0.7188463644377099
Energy: 0.7240868683910184
Energy: 0.7162891525717917
Energy: 0.8547585690852145
Energy: 0.7162891525742714
Energy: 0.7205305860651602
Energy: 0.7812935471104657
Energy: 0.853803536722183
Energy: 0.7812935471071597
Energy: 0.7201980824511797
Energy: 0.7156548937604506
Energy: 0.726125549088253
Energy: 0.7156548937612771
Energy: 0.8453304643173323
Energy: 0.7321861127733876
Energy: 0.8491023115158154
Energy: 0.7321861127717345
Energy: 0.7136761765208763
Energy: 0.7142247725727692
Energy: 0.8498915600445042
Energy: 0.7142247725752487
Energy: 0.7271247565477474
Energy: 0.7312815906139665
Energy: 0.9828993263385231
Energy: 0.7312815906189253
Energy: 0.7174156278126714
Energy: 0.7173602784861063
Energy: 0.9808063976103809
Energy: 0.7173602784852797
Energy: 0.8481036055350584
Energy: 0.763933296551774
Energy: 0.7199377968259548
Energy: 0.7639332965526004
Energy: 0.8485001845692336
Energy: 0.716359532135831
Energy: 0.7145988498413591
Energy: 0.7163595321350046
Energy: 0.7196043891585306
Energy: 0.7164360641773485
Energy: 0.7156580368622811
Energy: 0.71643606418227
Energy: 0.9730418452006498
Energy: 0.7191683864118811
Energy: 0.7197737129575408
Energy: 0.7191683864102282

minimum gb energy = 0.7074715050770665 eV
minimum distance =  2.64849415530005 Angstroms
sigma value = 17


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

Energy: 1.1829854109301339
Energy: 0.7123086343453
Energy: 0.8505480424175094
Energy: 0.7123086343442784
Energy: 0.7159792268762731
Energy: 0.7106327865150859
Energy: 0.8048743769820842
Energy: 0.7106327865150859
Energy: 0.9230757117279349
Energy: 0.7180046778933913
Energy: 0.8031104385961875
Energy: 0.718004677892927
Energy: 0.9012700085476333
Energy: 0.7866689635661579
Energy: 0.8115822576070494
Energy: 0.7866689635620712
Energy: 0.8014983207152194
Energy: 0.7050602544332382
Energy: 0.7758338944838077
Energy: 0.7050602544327274
Energy: 0.7069527545883876
Energy: 0.7041549226151749
Energy: 0.9081361909857351
Energy: 0.7041549226172182
Energy: 0.7067111261229043
Energy: 0.7037945634091093
Energy: 0.8382109668790251
Energy: 0.7037945634085984
Energy: 0.70916819610571
Energy: 0.705584820863338
Energy: 0.7156053504333763
Energy: 0.7055848208623163
Energy: 0.8024678375130586
Energy: 0.7032471593025534
Energy: 0.8470289358879147
Energy: 0.7032471593035752
Energy: 0.8736170972356478
Energy: 0.8491080937139088
Energy: 0.8019226254225786
Energy: 0.8491080937144195
Energy: 0.7991795843003222
Energy: 0.8580659649447484
Energy: 0.7774257586554546
Energy: 0.8580659649411725
Energy: 0.9014450549536868
Energy: 0.7140192703786914
Energy: 0.7392693289195682
Energy: 0.7140192703756263
Energy: 0.7776443531751962
Energy: 0.7176202002551658
Energy: 0.7218128395112615
Energy: 0.7176202002582309
Energy: 0.7516850583647028
Energy: 0.7250764735985482
Energy: 0.7191494126453147
Energy: 0.7250764735944615
Energy: 0.9217372016266684
Energy: 0.7139602985419016
Energy: 0.7141085034080265
Energy: 0.7139602985362823
Energy: 0.7713405433400599
Energy: 0.7450007425381923
Energy: 0.7966489790669308
Energy: 0.7450007425397248
Energy: 0.7505803107141756
Energy: 0.7017021217438687
Energy: 1.0781945288536325
Energy: 0.7017021217331876
Energy: 0.7608729796917155
Energy: 0.7511434967219742
Energy: 0.887129336800305
Energy: 0.7511434967214633
Energy: 0.7479232113882308
Energy: 0.6998591804989933
Energy: 0.8835533512509492
Energy: 0.6998591804989933
Energy: 0.7593771851566599
Energy: 0.8459327145931607
Energy: 1.127667924015507
Energy: 0.8459327145967366
Energy: 0.8408129598258851
Energy: 0.7017349669265831
Energy: 0.84048470852792
Energy: 0.7017349669291373
Energy: 0.8412845192773997
Energy: 0.7032406741414526
Energy: 0.9240070901216664
Energy: 0.703240674175679
Energy: 0.8467875015497194
Energy: 0.7365641760618041
Energy: 0.8587023328600436
Energy: 0.7365641760628259
Energy: 0.7779465100479673
Energy: 0.7102148757621009
Energy: 0.8051273689871578
Energy: 0.7102148757626116
Energy: 0.9120642540357002
Energy: 0.7087201235484697
Energy: 0.7106894328651624
Energy: 0.7087201235397854
Energy: 0.8418809776308787
Energy: 0.7063675956824041
Energy: 0.7080750832799042
Energy: 0.7063675956849584
Energy: 0.7158579047502337
Energy: 0.7100441296896094
Energy: 0.7090043510528657
Energy: 0.710044129691142
Energy: 0.8405629868772883
Energy: 0.7057142650785806
Energy: 0.7333341441557409
Energy: 0.7057142650857323
Energy: 0.8007976893298491
Energy: 0.8587545815848471
Energy: 0.8774745771445117
Energy: 0.8587545815868906
Energy: 0.780352265596299
Energy: 0.8320084109347334
Energy: 0.7362473723753497
Energy: 0.832008410930136
Energy: 0.8109010869572035
Energy: 0.7124288667969716
Energy: 0.8996451881324325
Energy: 0.7124288668015694
Energy: 0.7186844907044118
Energy: 0.7132594935292433
Energy: 0.7862756358998052
Energy: 0.7132594935210699
Energy: 0.7225849365296523
Energy: 0.7182594230851087
Energy: 0.7764594904063532
Energy: 0.7182594230845978
Energy: 0.7115262180045165
Energy: 0.7108124711577515
Energy: 0.9209102109096706
Energy: 0.7108124711582623
Energy: 0.715005459038913
Energy: 0.7407112670468773
Energy: 0.7755370684441231
Energy: 0.7407112670468773
Energy: 1.0779981467642892
Energy: 0.7109636963782576
Energy: 0.7118717616224494
Energy: 0.710963696380301
Energy: 0.8022549628426879
Energy: 0.7192400285687729
Energy: 0.7194804392688118
Energy: 0.7192400285657078
Energy: 0.8440335180930075
Energy: 0.7101598693063875
Energy: 0.7118707223055057
Energy: 0.71015986930792

minimum gb energy = 0.6998591804989933 eV
minimum distance =  2.64834797124504 Angstroms
sigma value = 89


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

Energy: 1.1688280600136143
Energy: 0.6495684448527002
Energy: 0.8016362530924456
Energy: 0.6495684448540368
Energy: 0.6487826893908026
Energy: 0.7249539715915583
Energy: 0.6664726165372508
Energy: 0.7249539715902218
Energy: 0.6460518917072919
Energy: 0.7245797348100863
Energy: 0.6581205005728846
Energy: 0.7245797348100863
Energy: 0.6439426854517382
Energy: 0.7192908064045358
Energy: 0.6493569573617877
Energy: 0.7192908063938428
Energy: 0.6488298461025468
Energy: 0.6570709684090427
Energy: 0.6541404989932387
Energy: 0.6570709684063695
Energy: 0.6638435092345042
Energy: 0.6635156222946804
Energy: 0.6495560118705903
Energy: 0.663515622296017
Energy: 0.6563833383875513
Energy: 0.6542598451716498
Energy: 0.6502920136181108
Energy: 0.6542598451716498
Energy: 0.6524874658245784
Energy: 0.6528463637463547
Energy: 0.6500325770786123
Energy: 0.6528463637476914
Energy: 0.6574624991170062
Energy: 0.6496844303043321
Energy: 0.6435045717788493
Energy: 0.6496844303029954
Energy: 0.6555414139549958
Energy: 0.7167851933693461
Energy: 0.6579417145284878
Energy: 0.7167851933720194
Energy: 0.6501006740479917
Energy: 0.7138335344897165
Energy: 0.6422540114029127
Energy: 0.7138335344883798
Energy: 0.6496350280313415
Energy: 0.651698487433155
Energy: 0.6581114935971751
Energy: 0.6516984874318185
Energy: 0.657794706466702
Energy: 0.6549562068725016
Energy: 0.6540450357347791
Energy: 0.6549562068725016
Energy: 0.6498465079573481
Energy: 0.6502529731578034
Energy: 0.6571400211351323
Energy: 0.6502529731578034
Energy: 0.6564188126708537
Energy: 0.6554103089559522
Energy: 0.6508886202892384
Energy: 0.6554103089572888

minimum gb energy = 0.6422540114029127 eV
minimum distance =  2.653592915578 Angstroms
sigma value = 13


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

Energy: 1.0873263311571582
Energy: 0.6139217962363646
Energy: 0.7778170431021946
Energy: 0.6139217962380452
Energy: 0.6827234388628185
Energy: 0.6188476515882363
Energy: 0.727882460027415
Energy: 0.6188476515826339
Energy: 0.669157547441474
Energy: 0.615900896654977
Energy: 0.7243291909457085
Energy: 0.6159008966572178
Energy: 0.8746959454633967
Energy: 0.6637825731407402
Energy: 0.7263564900467523
Energy: 0.6637825731877484
Energy: 0.724688636495685
Energy: 0.7695471160484214
Energy: 0.6835043577719964
Energy: 0.7695471160529032
Energy: 0.7311778849048979
Energy: 0.6199838128061291
Energy: 0.6830689291618461
Energy: 0.6199838128094904
Energy: 0.7245025153792144
Energy: 0.6178741794020239
Energy: 0.7231909953550477
Energy: 0.6178741794042648
Energy: 0.6224566101229213
Energy: 0.6189460007483916
Energy: 0.769905709732053
Energy: 0.6189460007523131
Energy: 0.6232987651344709
Energy: 0.6220689811860695
Energy: 0.6836310246180624
Energy: 0.622068981184949
Energy: 0.6182799257399307
Energy: 0.6173884837892757
Energy: 0.7298726729111901
Energy: 0.6173884837859144
Energy: 0.6276661028743673
Energy: 0.6253901516857202
Energy: 1.0889231176672445
Energy: 0.6253901516845998
Energy: 0.6355340535465692
Energy: 0.6182274504012713
Energy: 0.7294398079011823
Energy: 0.6182274504057531
Energy: 0.6315204415987665
Energy: 0.7672298169711715
Energy: 0.7267834142553997
Energy: 0.7672298169694909
Energy: 0.6205263823710052
Energy: 0.907641856438791
Energy: 0.8773268844426122
Energy: 0.9076418564455137
Energy: 0.7696851749803862
Energy: 0.6094146198761674
Energy: 0.7242596298423829
Energy: 0.6094146198700048
Energy: 0.7692900521257352
Energy: 0.607560817605733
Energy: 0.6650205742773587
Energy: 0.6075608176023717
Energy: 0.6277701293639376
Energy: 0.606158719531669
Energy: 0.6637271676593209
Energy: 0.606158719531669
Energy: 1.0357866508901235
Energy: 0.6071777253342421
Energy: 0.6651720299890101
Energy: 0.6071777253308807
Energy: 0.8139043758175847
Energy: 0.6108902134844216
Energy: 0.7696762739634466
Energy: 0.6108902134827409
Energy: 0.6293502436995126
Energy: 0.6605507777550804
Energy: 0.7681642062012419
Energy: 0.6605507777528394
Energy: 0.8721833907416676
Energy: 0.6080552976599226
Energy: 0.7715059729348415
Energy: 0.6080552976576817
Energy: 0.6288853175381415
Energy: 0.6189414912005013
Energy: 0.6817946025520975
Energy: 0.6189414911977001
Energy: 0.7224010421150281
Energy: 0.6231486535783954
Energy: 0.6841689792499777
Energy: 0.6231486535660704
Energy: 0.6689617242016245
Energy: 0.6178430181151969
Energy: 0.7266731854849959
Energy: 0.6178430181185582
Energy: 0.6219547684681402
Energy: 0.6181172858367756
Energy: 0.7703180324261684
Energy: 0.618117285840137
Energy: 0.6178461395520689
Energy: 0.6229389661168566
Energy: 0.7704951025073633
Energy: 0.6229389661118147
Energy: 0.617332216953613
Energy: 0.6164354735990925
Energy: 0.7266530911033487
Energy: 0.6164354736035743
Energy: 0.6282825659369287
Energy: 0.6228714965101769
Energy: 0.8936391471062544
Energy: 0.6228714965129781
Energy: 0.7278742019877174
Energy: 0.6193737849058265
Energy: 0.7816555798458386
Energy: 0.6193737849069468
Energy: 0.7694546062997873
Energy: 0.6497767885902429
Energy: 0.7258135123861199
Energy: 0.6497767885852008
Energy: 0.726272486137825
Energy: 0.757114472235571
Energy: 0.8732269116439688
Energy: 0.7571144722333302
Energy: 0.7693666609014947
Energy: 0.6171788414809951
Energy: 0.7257666284566798
Energy: 0.6171788414815552
Energy: 0.774464370786618
Energy: 0.621936302344161
Energy: 0.6211393431108974
Energy: 0.6219363023436008
Energy: 0.7219707768046985
Energy: 0.6150484534918429
Energy: 0.6154764665912393
Energy: 0.6150484534935236
Energy: 0.8089741287394687
Energy: 0.6183132334259316
Energy: 0.6152060946211968
Energy: 0.6183132334214497

minimum gb energy = 0.606158719531669 eV
minimum distance =  2.62626040542835 Angstroms
sigma value = 37


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

Energy: 0.9929273549894774
Energy: 0.5651411546613081
Energy: 0.5752652059756269
Energy: 0.5651411546632359
Energy: 0.6509550815866848
Energy: 0.5765581381675076
Energy: 0.5879917129215219
Energy: 0.5765581381684713
Energy: 0.6482870356211246
Energy: 0.6480331037119808
Energy: 0.5815547691862786
Energy: 0.6480331037119808
Energy: 0.8448418658388664
Energy: 0.9149637286238946
Energy: 0.5827399974619178
Energy: 0.9149637286258224
Energy: 0.7347398412525413
Energy: 0.5555986252392902
Energy: 0.8124330091501709
Energy: 0.5555986252412178
Energy: 0.7364800657810007
Energy: 0.5588781238680217
Energy: 0.6466309260662015
Energy: 0.5588781238689855
Energy: 0.6423220372269391
Energy: 0.5617210334541829
Energy: 0.5559365431965527
Energy: 0.5617210334541829
Energy: 0.6566578335773666
Energy: 0.5586620810080299
Energy: 0.6524639812915771
Energy: 0.5586620810089938
Energy: 0.6481191669091626
Energy: 0.5553153237237185
Energy: 0.6523393610005078
Energy: 0.5553153237227546
Energy: 0.6496357055917126
Energy: 0.555736729972202
Energy: 0.5548624201160122
Energy: 0.5557367299712382
Energy: 0.6845602253877255
Energy: 0.6841460972538786
Energy: 0.9015159586047214
Energy: 0.6841460972529148
Energy: 0.6659061479842049
Energy: 0.5557510175818883
Energy: 0.5549166349453366
Energy: 0.5557510175799606
Energy: 0.6665511703527943
Energy: 0.6271711604698512
Energy: 0.6483078270956835
Energy: 0.6271711604679234
Energy: 0.6583577273498664
Energy: 0.8164547888584119
Energy: 0.8428131013355183
Energy: 0.816454788857448
Energy: 0.8124330091520986
Energy: 0.6313261088465474
Energy: 0.5559369412866588
Energy: 0.6313261088455836
Energy: 0.6466309260662015
Energy: 0.6282228655775964
Energy: 0.5561336522997786
Energy: 0.6282228655785602
Energy: 0.7370357223049485
Energy: 0.6270199170222468
Energy: 0.6458662060655687
Energy: 0.6270199170222468
Energy: 0.652463982538252
Energy: 0.6556021092476597
Energy: 0.5814527870967952
Energy: 0.655602109245732
Energy: 0.6523393609947247
Energy: 0.5738612660071045
Energy: 0.575307936367829
Energy: 0.5738612660071045
Energy: 0.7364593567590598
Energy: 0.5769535462239925
Energy: 0.575390694469458
Energy: 0.5769535462249563

minimum gb energy = 0.5548624201160122 eV
minimum distance =  2.64103770639484 Angstroms
sigma value = 25


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

Energy: 1.0330328233380557
Energy: 0.5009925374965919
Energy: 0.49769162693305663
Energy: 0.5009925375417161
Energy: 0.7767410394696672
Energy: 0.495670256613194
Energy: 0.6380199975563544
Energy: 0.4956702566109703
Energy: 0.7758462739684117
Energy: 0.49890336181623446
Energy: 0.6399642687606604
Energy: 0.4989033618169871
Energy: 0.7566359649361062
Energy: 0.49999250688054053
Energy: 0.6385004912166443
Energy: 0.49999250687828256
Energy: 0.7861176719114148
Energy: 0.5528629359818393
Energy: 0.7966662293327601
Energy: 0.5528629359833446
Energy: 0.780815579525389
Energy: 0.5516544741563563
Energy: 0.7824294826043877
Energy: 0.5516544741586142
Energy: 0.7625393292780971
Energy: 0.5530809848796661
Energy: 0.7875438058366858
Energy: 0.5530809848804187
Energy: 0.6391024573270635
Energy: 0.49935239782511953
Energy: 0.8997354833532979
Energy: 0.49935239782587215
Energy: 0.6397343265644505
Energy: 0.49662417411217474
Energy: 0.7902184544277459
Energy: 0.4966241741114221
Energy: 0.6432190873943407
Energy: 0.4996558007673069
Energy: 0.7893200360013165
Energy: 0.4996558007680596
Energy: 0.496961293408021
Energy: 0.49860819806691015
Energy: 0.8930887874525983
Energy: 0.4986081980902421
Energy: 0.5001980909420465
Energy: 0.49968942723464393
Energy: 0.7889786474627949
Energy: 0.49968942723464393
Energy: 0.4984548829122699
Energy: 0.4990875315469122
Energy: 0.7758788768818736
Energy: 0.4990875315476649
Energy: 0.5032657900919244
Energy: 0.497312740352368
Energy: 1.0358196606604435
Energy: 0.4973127403501101
Energy: 0.6340351536094332
Energy: 0.49603929296259497
Energy: 0.7861003886711437
Energy: 0.4960392929558213
Energy: 0.6391464811271566
Energy: 0.49595064768176567
Energy: 0.7759362646805081
Energy: 0.4959506476847762
Energy: 0.6389673744806821
Energy: 0.49759694370121893
Energy: 0.7766206660997582
Energy: 0.49759694370347685
Energy: 0.6261931360065849
Energy: 0.6874329932357082
Energy: 0.7849230747942207
Energy: 0.6874329932342028
Energy: 0.7849808551337115
Energy: 0.552629457039943
Energy: 0.7763955359520287
Energy: 0.552629457039943
Energy: 0.7873230160614254
Energy: 0.5507319269712427
Energy: 0.7751425946392011
Energy: 0.5507319269712427
Energy: 0.8959238342050021
Energy: 0.4979026970962391
Energy: 0.643472484666851
Energy: 0.4979026970962391
Energy: 0.7869014106987926
Energy: 0.4957442099793986
Energy: 0.49621294730654325
Energy: 0.4957442099801513
Energy: 0.7785202039639646
Energy: 0.49840916281104003
Energy: 0.637648536412706
Energy: 0.4984091628102874
Energy: 0.8939752285171287
Energy: 0.4968614427824598
Energy: 0.5025724120221667
Energy: 0.4968614427832125
Energy: 0.7863890849723304
Energy: 0.49637616365720355
Energy: 0.4969763707150901
Energy: 0.49637616365795617
Energy: 0.7711776931371985
Energy: 0.4998409799807263
Energy: 0.5009274385774415
Energy: 0.4998409799814789

minimum gb energy = 0.4956702566109703 eV
minimum distance =  2.65231067029226 Angstroms
sigma value = 41


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

Energy: 1.1144402074785797
Energy: 0.4544751247406263
Energy: 0.45234497233537524
Energy: 0.4544751247381581
Energy: 0.870614702987843
Energy: 0.45033934815281434
Energy: 0.5575482007134125
Energy: 0.4503393481546654
Energy: 0.8981080651606153
Energy: 0.44913297401584834
Energy: 0.5585978944011443
Energy: 0.44913297401708246
Energy: 0.8790282808349361
Energy: 0.448571836483042
Energy: 0.5760268329312819
Energy: 0.4485718364861272
Energy: 0.886947482422238
Energy: 0.6598783794266231
Energy: 0.7721649118963805
Energy: 0.6598783794272401
Energy: 0.87224668544591
Energy: 0.6630410945128559
Energy: 0.7768180488169223
Energy: 0.6630410945110047
Energy: 0.8720215863072875
Energy: 0.6675607896747257
Energy: 0.7990779206105304
Energy: 0.6675607896771938
Energy: 0.7956178057384984
Energy: 0.6657166637504924
Energy: 0.7700261700901069
Energy: 0.6657166637535777
Energy: 0.6641188380172006
Energy: 0.4503327958936528
Energy: 0.892629786851097
Energy: 0.45033279588624836
Energy: 0.6659780878801688
Energy: 0.449537582182906
Energy: 0.8865844791056458
Energy: 0.44953758217611856
Energy: 0.5769893670343095
Energy: 0.4489608500587223
Energy: 0.9978447217800626
Energy: 0.4489608500593394
Energy: 0.5556428586428973
Energy: 0.4487273389051319
Energy: 0.8850084315402706
Energy: 0.4487273389045148
Energy: 0.5634076121049074
Energy: 0.4526385248405628
Energy: 0.883056953331532
Energy: 0.4526385248411798
Energy: 0.45493979630420356
Energy: 0.45081204143700654
Energy: 0.9986630817998486
Energy: 0.45081204143577247
Energy: 0.4493597894425778
Energy: 0.44997237936248785
Energy: 0.8866959424845854
Energy: 0.4499723793631049
Energy: 0.45350368965971327
Energy: 0.45194872624971516
Energy: 0.8673954505941176
Energy: 0.45194872624848104
Energy: 0.5762338851534715
Energy: 0.44821010924371424
Energy: 0.8669925510548978
Energy: 0.4482101092424801
Energy: 0.5557096458331386
Energy: 0.5554115658458003
Energy: 0.8860554034079899
Energy: 0.5554115658464175
Energy: 0.5610930003744116
Energy: 0.4505851891293907
Energy: 0.8731067596685855
Energy: 0.4505851891250714
Energy: 0.7889767536362433
Energy: 0.4498513637376202
Energy: 0.8711352729525513
Energy: 0.4498513637326838
Energy: 0.7714671575337035
Energy: 0.45002270043152387
Energy: 0.886291052027053
Energy: 0.4500227004074873
Energy: 0.7845553874877107
Energy: 0.6655107578831816
Energy: 0.8936068770963639
Energy: 0.6655107578831816
Energy: 0.7914575033491379
Energy: 0.4916653593148817
Energy: 0.8723604678132234
Energy: 0.49166535931117944
Energy: 0.7698104230098854
Energy: 0.6660596812875529
Energy: 0.7906201423964552
Energy: 0.6660596812918722
Energy: 0.8872196317912694
Energy: 0.45018825382504696
Energy: 0.6593742775735858
Energy: 0.4501882538213447
Energy: 0.8822611627452163
Energy: 0.44983001253335336
Energy: 0.6915811929306356
Energy: 0.44983001253335336
Energy: 0.7852961184363019
Energy: 0.4506196968837744
Energy: 0.5673618357980107
Energy: 0.45061969688439146
Energy: 0.8833134145048264
Energy: 0.5550259988994395
Energy: 0.5538802023674586
Energy: 0.5550259988988225
Energy: 0.8754915072217841
Energy: 0.45019101500227593
Energy: 0.5764374914094095
Energy: 0.45019101500227593
Energy: 0.8737423093835205
Energy: 0.45023469739616273
Energy: 0.4515734830398429
Energy: 0.4502346973949286
Energy: 0.8867568764261339
Energy: 0.44996461522544917
Energy: 0.44984138186951617
Energy: 0.44996461522544917
Energy: 0.8671310240016251
Energy: 0.4507484076613846
Energy: 0.45192976201463964
Energy: 0.4507484076607675

minimum gb energy = 0.4482101092424801 eV
minimum distance =  2.64408100501275 Angstroms
sigma value = 15


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

Energy: 0.9634507799084466
Energy: 0.41686095468951
Energy: 0.41425949244385457
Energy: 0.4168609546832373
Energy: 0.9394897336767082
Energy: 0.4125260603855694
Energy: 0.5015418575499697
Energy: 0.41252606039027384
Energy: 0.7839948032259177
Energy: 0.4128204640032554
Energy: 0.5030649085748009
Energy: 0.4128204640043008
Energy: 0.9772229178017154
Energy: 0.4136657842684014
Energy: 0.506732995366547
Energy: 0.4136657842663105
Energy: 0.9494383196393292
Energy: 0.5001352645345156
Energy: 0.6900111161233126
Energy: 0.5001352645371293
Energy: 0.947809993115372
Energy: 0.4171885296279279
Energy: 0.689929294756118
Energy: 0.41718852962693
Energy: 0.7832795436926914
Energy: 0.4163148536217334
Energy: 0.6951606885165708
Energy: 0.41631485362905146
Energy: 0.8692847753360042
Energy: 0.44893816924363333
Energy: 0.6799617586842079
Energy: 0.4489381692425879
Energy: 0.7864347081772384
Energy: 0.4477241484678602
Energy: 0.863529050551146
Energy: 0.4477241484542695
Energy: 0.7848936024270736
Energy: 0.44860786083798954
Energy: 0.7850997831271618
Energy: 0.4486078608374668
Energy: 0.696431948372124
Energy: 0.4134457766797103
Energy: 0.8684252077780905
Energy: 0.41344577667657395
Energy: 0.5903943207678342
Energy: 0.416100919991357
Energy: 0.9518294452900216
Energy: 0.41610091991247367
Energy: 0.6901783982269395
Energy: 0.41175599405696106
Energy: 0.951456801716223
Energy: 0.4117559940433703
Energy: 0.5095264589275849
Energy: 0.413841682552642
Energy: 0.8684453072191599
Energy: 0.41384168255159653
Energy: 0.5006696220472239
Energy: 0.41205843848844864
Energy: 0.948485311388683
Energy: 0.4120584384795624
Energy: 0.507720015776002
Energy: 0.41414352182552655
Energy: 0.9478171187067544
Energy: 0.414143521826572
Energy: 0.4171130611849826
Energy: 0.41260874385376745
Energy: 0.9505949999664878
Energy: 0.41260874385376745
Energy: 0.4121107473749972
Energy: 0.4120276546785596
Energy: 0.9489748049708697
Energy: 0.41202765468012786
Energy: 0.41541683418826275
Energy: 0.41120958713622163
Energy: 0.9405165064552033
Energy: 0.41120958713569894
Energy: 0.5076874033246634
Energy: 0.4116892128019065
Energy: 0.7815285484576101
Energy: 0.41168921279824744
Energy: 0.4998829256491499
Energy: 0.41175021800215783
Energy: 0.9489934534728812
Energy: 0.4117502180047714
Energy: 0.5087993407885568
Energy: 0.413880814467397
Energy: 0.9470534032430157
Energy: 0.41388081447001057
Energy: 0.6910177857187663
Energy: 0.41209320286724194
Energy: 0.9399573543129297
Energy: 0.41209320286828743
Energy: 0.6818000371648893
Energy: 0.415527987909412
Energy: 0.94987848368381
Energy: 0.4155279879162074
Energy: 0.6978435604703368
Energy: 0.4172361047976622
Energy: 0.7704039726788164
Energy: 0.4172361049026817
Energy: 0.8680981638704471
Energy: 0.4486049361828133
Energy: 0.790253417311432
Energy: 0.4486049361849042
Energy: 0.6862347404179897
Energy: 0.4479607759040108
Energy: 0.8662880721260177
Energy: 0.44796077590662436
Energy: 0.867144374091305
Energy: 0.8247872162968157
Energy: 0.7719792516692233
Energy: 0.8247872162973383
Energy: 0.866223613498257
Energy: 0.4175984559986583
Energy: 0.7883700465532055
Energy: 0.41759845600493095
Energy: 0.8628249364845241
Energy: 0.4169237416224337
Energy: 0.6902289377207937
Energy: 0.4169237416459086
Energy: 0.8695237018326514
Energy: 0.4999694781238286
Energy: 0.5909088796056442
Energy: 0.4999694781301013
Energy: 0.8722828844426719
Energy: 0.41358109263927473
Energy: 0.6102683354295731
Energy: 0.41358109263927473
Energy: 0.9520360330553757
Energy: 0.4143681614593517
Energy: 0.5046312803846639
Energy: 0.4143681614609198
Energy: 0.9516163859482775
Energy: 0.41413275381254594
Energy: 0.503840315418936
Energy: 0.41413275381202325
Energy: 1.0664993175192181
Energy: 0.41304499936856814
Energy: 0.4143684923680124
Energy: 0.4130449993549774
Energy: 0.9467107511553212
Energy: 0.4152036152934273
Energy: 0.4143046334629329
Energy: 0.41520361529395
Energy: 0.9526682802772528
Energy: 0.4138924279511437
Energy: 0.41486048117043905
Energy: 0.4138924279516665

minimum gb energy = 0.41120958713569894 eV
minimum distance =  2.6573437487443 Angstroms
sigma value = 85


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

Energy: 1.0188404899226442
Energy: 0.3453644074111606
Energy: 0.37485608195362535
Energy: 0.34536440733186435
Energy: 0.8501601145796693
Energy: 0.3723920715515442
Energy: 0.4525057760582144
Energy: 0.37239207155109083
Energy: 0.8390345545872558
Energy: 0.3722629896212657
Energy: 0.4528608657893732
Energy: 0.37226298962171905
Energy: 0.8463139178174394
Energy: 0.373361709142469
Energy: 0.4568026824643812
Energy: 0.37336170914518924
Energy: 0.8504965359465757
Energy: 0.45063451769331264
Energy: 0.615767775112517
Energy: 0.450634517692406
Energy: 0.83687986724205
Energy: 0.3722789485454283
Energy: 0.6225220307507794
Energy: 0.3722789485463351
Energy: 0.8367653893995104
Energy: 0.3722979779972486
Energy: 0.7141693758115788
Energy: 0.3722979779995153
Energy: 0.8515619496383143
Energy: 0.37325389446924073
Energy: 0.602991129882632
Energy: 0.3732538944801213
Energy: 0.8458536754711358
Energy: 0.5667727532542454
Energy: 0.778786804199931
Energy: 0.5667727532524319
Energy: 0.8459511136652795
Energy: 0.5672854730918379
Energy: 0.8529437410013451
Energy: 0.5672854730918379
Energy: 0.7806031667524939
Energy: 0.5677775244141233
Energy: 0.7660593910697168
Energy: 0.5677775244163902
Energy: 0.6866896665132673
Energy: 0.3732145963233641
Energy: 0.8522042966243341
Energy: 0.373214596284396
Energy: 0.7800513040954551
Energy: 0.37239475980233805
Energy: 0.8415669134174353
Energy: 0.37239475982453196
Energy: 0.6257333202997261
Energy: 0.3727841649503241
Energy: 0.7641098832666364
Energy: 0.37278416496437816
Energy: 0.5244174943102682
Energy: 0.37309323877687833
Energy: 0.8515778755020443
Energy: 0.37309323877914513
Energy: 0.6251593148685185
Energy: 0.37239391227122526
Energy: 0.9093076174267641
Energy: 0.3723939122698651
Energy: 0.4562874198947642
Energy: 0.37273596859915603
Energy: 0.9075552021020522
Energy: 0.37273596859915603
Energy: 0.4499627679584402
Energy: 0.37218745423711636
Energy: 0.8500517535656354
Energy: 0.37218745423711636
Energy: 0.4561500199423911
Energy: 0.3728806719870505
Energy: 0.9067307654623672
Energy: 0.3728806719875039
Energy: 0.37361907008557627
Energy: 0.3726835832831072
Energy: 0.9069894586996403
Energy: 0.3726835832817471
Energy: 0.3721721275506
Energy: 0.37235593452960447
Energy: 0.8507622993161253
Energy: 0.37235593452869775
Energy: 0.373445244898676
Energy: 0.37365124838932545
Energy: 0.9773708643066692
Energy: 0.37365124838932545
Energy: 0.4535346260831236
Energy: 0.37263428175316693
Energy: 0.837390624552555
Energy: 0.3726342817540736
Energy: 0.4503947464618814
Energy: 0.37203362610223983
Energy: 0.8516122813542913
Energy: 0.3720336261017864
Energy: 0.45907518259126473
Energy: 0.3740012130320705
Energy: 0.845187711041838
Energy: 0.3740012130343373
Energy: 0.6207248892185191
Energy: 0.37293951580001033
Energy: 0.8449924047569772
Energy: 0.3729395157972902
Energy: 0.6208986187011648
Energy: 0.37226166026625557
Energy: 0.8484588786361588
Energy: 0.3722616602648955
Energy: 0.6233812052083875
Energy: 0.373274302370057
Energy: 0.8491979661836355
Energy: 0.3732743023682435
Energy: 0.7784755169502103
Energy: 0.3736053414646334
Energy: 0.8520714387023577
Energy: 0.37360534146327334
Energy: 0.7792598172968429
Energy: 0.3724399421221472
Energy: 0.8492092853453421
Energy: 0.37243994200295555
Energy: 0.7891299254385545
Energy: 0.5676454830555033
Energy: 0.6827293176742052
Energy: 0.5676454830573168
Energy: 0.7678410121220044
Energy: 0.5677889491488459
Energy: 0.78715590220377
Energy: 0.5677889491497319
Energy: 0.8504802626722394
Energy: 0.372471000209576
Energy: 0.7096517732615164
Energy: 0.37247100023269725
Energy: 0.8525908359931856
Energy: 0.3724447104359446
Energy: 0.7102236373675664
Energy: 0.3724447104359446
Energy: 0.7626665576121578
Energy: 0.3730939384128679
Energy: 0.6256639481882162
Energy: 0.37309393841196126
Energy: 0.8527858709561044
Energy: 0.3730610581656647
Energy: 0.6206006484948848
Energy: 0.37306105817155844
Energy: 0.8460719902381806
Energy: 0.3731624884384098
Energy: 0.6220957004598279
Energy: 0.37316248843568967
Energy: 0.9366156864494413
Energy: 0.3738360701579247
Energy: 0.45861132278109584
Energy: 0.3738360701579247
Energy: 0.8502717652431402
Energy: 0.3723196840347148
Energy: 0.4501985845759235
Energy: 0.3723196840347148
Energy: 0.9074294919706012
Energy: 0.37244082521601823
Energy: 0.4537864509666388
Energy: 0.37244082521465816
Energy: 0.9004493100373702
Energy: 0.37340201185430355
Energy: 0.3736847388612321
Energy: 0.3734020118547569
Energy: 0.8509026872778359
Energy: 0.3724502734823228
Energy: 0.3723544035075399
Energy: 0.37245027348096277
Energy: 0.9787297683237063
Energy: 0.3727998851225068
Energy: 0.37302010154898796
Energy: 0.37279988512296014

minimum gb energy = 0.34536440733186435 eV
minimum distance =  2.66417731991781 Angstroms
sigma value = 113


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

Energy: 0.01299248255255754
Energy: 0.014307594473595713
Energy: 0.7711441981141552
Energy: 0.014307594473944233
Energy: 0.013946656400061142
Energy: 0.079281595953523
Energy: 0.5857862624061734
Energy: 0.07928159595387152
Energy: 0.013570590112063506
Energy: 0.07858411037858756
Energy: 0.584714406438621
Energy: 0.07858411037926523
Energy: 0.014214049958827957
Energy: 0.07828086764226329
Energy: 0.5841245309350486
Energy: 0.07828086764191476
Energy: 0.5837070073513774
Energy: 0.07832549876310615
Energy: 0.5849144486832019
Energy: 0.07832549876345467
Energy: 0.013458458582288875
Energy: 0.0779889511305659
Energy: 0.584446183485617
Energy: 0.07798895113159209

minimum gb energy = 0.01299248255255754 eV
minimum distance =  2.85056462026557 Angstroms
sigma value = 1