Model name: model_name=MEAM_LAMMPS_KangSaLee_2009_ZrAgCu__MO_813575892799_002
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ag
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.072935052216053
cohesive_energy=2.8502241669002406
mass=107.8682
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=[1.210969960922952e-19, 1.69180239490596e-19, 2.06962768873584e-19, 2.38701887993124e-19, 2.66212862975538e-19, 2.90473021567566e-19, 3.1208318000695797e-19, 3.3144708680548195e-19, 3.4884992940399e-19, 3.64509603824706e-19, 3.7858953208429793e-19, 3.9122269484338795e-19, 4.0251483575982e-19, 4.12557278901732e-19, 4.21422122217654e-19, 4.2917505494958e-19, 4.35870551103066e-19, 4.41558278153766e-19, 4.46281494870798e-19, 4.500770513167439e-19, 4.52978593200918e-19, 4.55018164056e-19, 4.562230008847679e-19, 4.5662034069e-19, 4.5618775299882e-19, 4.54774633207632e-19, 4.5218391359045395e-19, 4.481704611222839e-19, 4.424442818323679e-19, 4.3464648815469e-19, 4.2433808369153395e-19, 4.10972726210706e-19, 3.9387910370255997e-19, 3.72212869080978e-19, 3.4491017706098392e-19, 3.1062199491674996e-19, 2.6761957406018996e-19, 2.1366627591023998e-19, 1.4584469703404937e-19, 6.02895863020932e-20, -4.8170401807190393e-20, -1.8655904943959397e-19, -3.64573690890066e-19, -5.95847888007966e-19, -8.99952228377604e-19, -1.305634567342842e-18, -1.8563138916850798e-18, -2.6196709489543796e-18, -3.7052737926201e-18, -5.29878265103016e-18, -7.73263315397322e-18, -1.164554903835972e-17, -1.83808112159016e-17, -3.11322146105808e-17]
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: 0.008660185756002433
Energy: 0.07197726355537463
Energy: 0.46190766494907426
Energy: 0.07197726355537463
Energy: 0.07197726355489427
Energy: 0.45123966166840795
Energy: 0.07197726355537463
Energy: 0.45123966166986285
Energy: 0.4619076649423078
Energy: 0.07197726355585501
Energy: 0.008660185756002433
Energy: 0.07197726355537463
Energy: 0.07197726355585501
Energy: 0.45123966166551194
Energy: 0.07197726355489427
Energy: 0.4512396616587592

minimum gb energy = 0.008660185756002433 eV
minimum distance =  2.79385440935127 Angstroms
sigma value = 1


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

Energy: 0.8685558906175164
Energy: 0.6573143266672155
Energy: 0.6571959870802527
Energy: 0.6573143266666162
Energy: 0.6303961759633001
Energy: 0.6115533512125902
Energy: 0.6303385138846099
Energy: 0.6115533512407547
Energy: 0.6517083133428896
Energy: 0.6511137187801206
Energy: 0.9461704474186677
Energy: 0.6511137187801206
Energy: 0.6443921037078004
Energy: 0.7276082097872365
Energy: 0.6239954577946559
Energy: 0.7276082097872365
Energy: 0.8075153759231705
Energy: 0.6107745244378101
Energy: 0.5850874969307259
Energy: 0.6107745244378101
Energy: 0.6478581072797173
Energy: 0.8076904254926712
Energy: 0.621203219048905
Energy: 0.8076904254932705
Energy: 0.6173780913467223
Energy: 0.6915709317263563
Energy: 0.8075360100786527
Energy: 0.6915709317263563
Energy: 0.6248098585896417
Energy: 0.8450060935193401
Energy: 0.6354604308045664
Energy: 0.845006093518741
Energy: 0.6965651267563331
Energy: 0.6933276715014559
Energy: 0.7001943134152586
Energy: 0.6933276715008566
Energy: 0.6335917102693119
Energy: 0.8279433590358632
Energy: 0.6245592977600597
Energy: 0.8279433590358632
Energy: 0.7463052132950844
Energy: 0.693919815488492
Energy: 0.6966442224855812
Energy: 0.6939198154890913
Energy: 0.6231065052444743
Energy: 0.8406885904391745
Energy: 0.6371695800465873
Energy: 0.8406885904385751
Energy: 0.6148963858490215
Energy: 0.6654528655733271
Energy: 0.8707200512874308
Energy: 0.6654528655733271
Energy: 0.6484884635680953
Energy: 0.8477604234093864
Energy: 0.6268455378213872
Energy: 0.8477604234099858
Energy: 0.8698734565387406
Energy: 0.610308211861158
Energy: 0.5840244442287454
Energy: 0.610308211861158
Energy: 0.6275101013013263
Energy: 0.7273170107405206
Energy: 0.6243964198557282
Energy: 0.7273170107405206
Energy: 0.6568589008376384
Energy: 0.6537883075744972
Energy: 1.0220864245818357
Energy: 0.6537883075738979
Energy: 0.6301363023790988
Energy: 0.6110439879344035
Energy: 0.6626524938154879
Energy: 0.611043987933205
Energy: 0.9466252060539293
Energy: 0.6520442945796111
Energy: 0.6533625983977166
Energy: 0.6520442945796111
Energy: 0.6779287905651158
Energy: 0.727778833791863
Energy: 0.6449060986423558
Energy: 0.7277788337930614
Energy: 0.5838865196041794
Energy: 0.6104633603293078
Energy: 0.8080370990707992
Energy: 0.6104633603287085
Energy: 0.6207733834564826
Energy: 0.8078756453262381
Energy: 0.6474585136693024
Energy: 0.8078756453274366
Energy: 0.8075590392080194
Energy: 0.6656698900588357
Energy: 0.615071848842106
Energy: 0.6656698900594349
Energy: 0.6351766929328839
Energy: 0.6841861205005214
Energy: 0.6234646413866661
Energy: 0.6841861205005214
Energy: 0.6969426571831959
Energy: 0.6951996307370583
Energy: 0.6962571806847214
Energy: 0.6951996307370583
Energy: 0.6255557973769077
Energy: 0.8218235370741657
Energy: 0.6350171732953787
Energy: 0.821823537074765
Energy: 0.6968529754038397
Energy: 0.6939555160131224
Energy: 0.7488399899982086
Energy: 0.6939555160137219
Energy: 0.6356938011205895
Energy: 0.8342224954700824
Energy: 0.6234149742074429
Energy: 0.8342224954706816
Energy: 0.8736742752669205
Energy: 0.6653802017172529
Energy: 0.6143847191564465
Energy: 0.6653802017166536
Energy: 0.6265422743017882
Energy: 0.7440035631390427
Energy: 0.6488711203571823
Energy: 0.744003563139642
Energy: 0.5836428068224767
Energy: 0.6103395725931997
Energy: 0.8723078600602236
Energy: 0.610339572593799
Energy: 0.6241003306248806
Energy: 0.6116788839859849
Energy: 0.6359489412146425
Energy: 0.6116788839853855
Energy: 1.0246601119243874
Energy: 0.6116007822759947
Energy: 0.6528545360847361
Energy: 0.6116007817632612

minimum gb energy = 0.5836428068224767 eV
minimum distance =  2.57980199601597 Angstroms
sigma value = 1


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

Energy: 0.986399299765667
Energy: 0.6918772681520655
Energy: 0.6913874009734653
Energy: 0.6918772681513823
Energy: 0.6607823329044926
Energy: 0.6756265480655338
Energy: 0.6606966881464679
Energy: 0.6756265480648507
Energy: 0.6926582243360206
Energy: 0.6919776028040595
Energy: 0.9048574451668114
Energy: 0.6919776028047427
Energy: 0.6777424523200619
Energy: 0.7431162212648827
Energy: 0.6542695454482551
Energy: 0.7431162212635162
Energy: 0.9049390172939075
Energy: 0.640263940893929
Energy: 0.6103314872287455
Energy: 0.6402639408946122
Energy: 0.6821783833364475
Energy: 0.8071054397381633
Energy: 0.6516935937121331
Energy: 0.8071054397388464
Energy: 0.6528655234063695
Energy: 0.7311559080364426
Energy: 0.7584768179834689
Energy: 0.7311559080364426
Energy: 0.6528174967580159
Energy: 0.8592846852234762
Energy: 0.6677368465002418
Energy: 0.859284685222793
Energy: 0.7586249590806917
Energy: 0.7316447764043866
Energy: 0.6962069107918816
Energy: 0.7316447764030203
Energy: 0.668496019190795
Energy: 0.8562333131115384
Energy: 0.6534978858260535
Energy: 0.8562333131122216
Energy: 0.8239341133776695
Energy: 0.731036526357754
Energy: 0.6531806630758689
Energy: 0.7310365263584373
Energy: 0.6591995795455805
Energy: 0.8537496835353896
Energy: 0.687414425508642
Energy: 0.8537496835353896
Energy: 0.6108813719748415
Energy: 0.6402959847290515
Energy: 0.8226777487897481
Energy: 0.6402959847290515
Energy: 0.6543950986520564
Energy: 0.640041640012757
Energy: 0.6577473213217148
Energy: 0.6400416400120736
Energy: 0.9877890034681646
Energy: 0.6858613371810305
Energy: 0.6906290003198344
Energy: 0.6858613371817137
Energy: 0.6982497293935903
Energy: 0.7911260568046993
Energy: 0.6608608100285024
Energy: 0.7911260568053826
Energy: 0.6861140237482473
Energy: 0.6861054175126164
Energy: 0.9058156324357809
Energy: 0.6861054175119331
Energy: 0.6783817710105997
Energy: 0.7429849052928602
Energy: 0.7157108074480291
Energy: 0.7429849051077949
Energy: 0.9052095913039617
Energy: 0.6401988260847824
Energy: 0.6107194790893596
Energy: 0.6401988260847824
Energy: 0.6816473621730247
Energy: 0.8801623913930996
Energy: 0.6515988338578644
Energy: 0.8801623913924165
Energy: 0.653617098155184
Energy: 0.7314900546318609
Energy: 0.758775437926131
Energy: 0.7314900546311777
Energy: 0.6628146231228712
Energy: 0.7289442608369157
Energy: 0.6686596501339189
Energy: 0.7289442608355491
Energy: 0.7592433321343172
Energy: 0.7333711864362521
Energy: 0.6944592177755947
Energy: 0.7333711864362521
Energy: 0.6682635224836584
Energy: 0.8362289736204516
Energy: 0.6612773381699107
Energy: 0.8362289736197683
Energy: 0.8216867331810684
Energy: 0.7320101867441411
Energy: 0.6530545917242155
Energy: 0.7320101867441411
Energy: 0.6587515130606928
Energy: 0.791423951598224
Energy: 0.682694837982099
Energy: 0.791423951598224
Energy: 0.6101214763191631
Energy: 0.639958722162333
Energy: 0.82525508059354
Energy: 0.639958722162333
Energy: 0.6538592777826343
Energy: 0.6402107150931845
Energy: 0.6673185095152979
Energy: 0.6402107150938678
Energy: 0.9912299462194378
Energy: 0.6401663566405875
Energy: 0.6843598798223122
Energy: 0.640166356639221

minimum gb energy = 0.6101214763191631 eV
minimum distance =  2.59191799995577 Angstroms
sigma value = 25


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

Energy: 0.9350261265534578
Energy: 0.7282286755582504
Energy: 0.7284974135060777
Energy: 0.7282286755582504
Energy: 0.6930825290346238
Energy: 0.7058460062109895
Energy: 0.6933217616640744
Energy: 0.7058460062070181
Energy: 0.728082543680058
Energy: 0.728253971980022
Energy: 0.846851029890808
Energy: 0.7282539719792277
Energy: 0.6873535257563309
Energy: 0.7570504460373608
Energy: 0.6931140209346611
Energy: 0.7570504460373608
Energy: 0.8483393098198949
Energy: 0.7085003488459575
Energy: 0.6388624677678032
Energy: 0.7085003488459575
Energy: 0.7197168494707417
Energy: 0.8910101444393154
Energy: 0.6817790340986664
Energy: 0.8910101444393154
Energy: 0.7023381102466801
Energy: 0.7748624664475556
Energy: 0.7007979823738756
Energy: 0.7748624664475556
Energy: 0.6861423515130374
Energy: 0.8843630175570445
Energy: 0.7036307233471657
Energy: 0.8843630175570445
Energy: 0.7015498043016576
Energy: 0.7813842425601955
Energy: 0.7614524286687557
Energy: 0.7813842425601955
Energy: 0.7242146557799103
Energy: 0.8601675696043638
Energy: 0.6966727488395978
Energy: 0.8601675696043638
Energy: 0.9382812579904657
Energy: 0.7085397628609853
Energy: 0.6377389047098134
Energy: 0.7085397628609853
Energy: 0.6871015760340891
Energy: 0.671560411479754
Energy: 0.6870200108881875
Energy: 0.671560411479754
Energy: 0.7278445492153428
Energy: 0.7280769191623424
Energy: 0.9366728632806275
Energy: 0.728076919163931
Energy: 0.693062974838864
Energy: 0.81064507836933
Energy: 0.7374674371808818
Energy: 0.81064507836933
Energy: 0.8476005797276183
Energy: 0.7225431669768377
Energy: 0.7232417896900369
Energy: 0.722543166977632
Energy: 0.7585976987063129
Energy: 0.7570322828144901
Energy: 0.6874908366380393
Energy: 0.7570322828152842
Energy: 0.6382332765404409
Energy: 0.7082996057936277
Energy: 0.8483498831746845
Energy: 0.7082996057936277
Energy: 0.6378179350230646
Energy: 0.8912352527265699
Energy: 0.7203202917266667
Energy: 0.8912352527265699
Energy: 0.701360731979448
Energy: 0.7456527123572705
Energy: 0.7031245962114646
Energy: 0.7456527123580646
Energy: 0.7049033648044655
Energy: 0.7821354274661998
Energy: 0.7127618550773798
Energy: 0.7821354274661998
Energy: 0.7597200527126768
Energy: 0.7828871854707184
Energy: 0.7015225659955886
Energy: 0.7828871854707184
Energy: 0.6952282591420577
Energy: 0.814142859994828
Energy: 0.7200832087211841
Energy: 0.814142859994828
Energy: 0.6372172408658124
Energy: 0.7084938837951926
Energy: 0.9370078222026604
Energy: 0.7084938837959868
Energy: 0.6871039200356114
Energy: 0.671631950695508
Energy: 0.7021755420022409
Energy: 0.6716319506963022
Energy: 0.9357123327727922
Energy: 0.6711881682303579
Energy: 0.7283881293360763
Energy: 0.6711881682303579

minimum gb energy = 0.6372172408658124 eV
minimum distance =  2.58611215026198 Angstroms
sigma value = 9


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

Energy: 0.8578391700646202
Energy: 0.7654311216796903
Energy: 0.7663602454914006
Energy: 0.7654311216806379
Energy: 0.7254391281574228
Energy: 0.7319211323593642
Energy: 0.7254702672832779
Energy: 0.7319211323593642
Energy: 0.7660437283187391
Energy: 0.7657782743850452
Energy: 1.0174420449087427
Energy: 0.7657782743850452
Energy: 0.716519194518002
Energy: 0.732169551991739
Energy: 0.7255523687705574
Energy: 0.732169551991739
Energy: 0.7706041733390998
Energy: 0.7454903733667984
Energy: 0.6676902260422675
Energy: 0.7454903733677459
Energy: 0.7633868941558427
Energy: 0.9052761772180575
Energy: 0.7177683462618578
Energy: 0.9052761772180575
Energy: 0.682981567975245
Energy: 0.8194424160562419
Energy: 0.7724111217823542
Energy: 0.8194424160562419
Energy: 0.7359515002823485
Energy: 0.8204954046627586
Energy: 0.7628641599259361
Energy: 0.8204954046608636
Energy: 0.6677015070124188
Energy: 0.7478163311622773
Energy: 0.8599621790428342
Energy: 0.7478163311632249
Energy: 0.7254516744250056
Energy: 0.706137368189794
Energy: 0.7214666513346709
Energy: 0.706137368189794
Energy: 0.8598406576980299
Energy: 0.7657370545524722
Energy: 0.7654768799563574
Energy: 0.7657370545515247
Energy: 0.7811424771563864
Energy: 0.8261990369371439
Energy: 0.760205533947822
Energy: 0.8261990369380914
Energy: 0.7657129870756811
Energy: 0.7575932401581128
Energy: 1.0184406011029963
Energy: 0.7575932401581128
Energy: 0.7581846589483539
Energy: 0.7313696659354706
Energy: 0.8063692310378875
Energy: 0.7313696659364181
Energy: 0.7707310017447985
Energy: 0.7455157217136325
Energy: 0.6674898753852861
Energy: 0.7455157217136325
Energy: 0.7628573041290332
Energy: 0.9054358364155795
Energy: 0.6679022534790132
Energy: 0.9054358364155795
Energy: 0.683031358958685
Energy: 0.7980679627876727
Energy: 0.7721447491882877
Energy: 0.7980679627876727
Energy: 0.7270553999844271
Energy: 0.8477221676951189
Energy: 0.7628674038566067
Energy: 0.8477221676941714
Energy: 0.6669704576226682
Energy: 0.7477416764279965
Energy: 0.8603778831086144
Energy: 0.7477416764279965
Energy: 0.7211628050889324
Energy: 0.7065642096118753
Energy: 0.7213253151937217
Energy: 0.7065642096118753
Energy: 0.8578971728352014
Energy: 0.7165726580385452
Energy: 0.7659898530419085
Energy: 0.7165726580385452

minimum gb energy = 0.6669704576226682 eV
minimum distance =  2.5940413304432 Angstroms
sigma value = 25


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

Energy: 0.744152406133321
Energy: 0.7998659310378629
Energy: 0.8009308008647736
Energy: 0.7998659310378629
Energy: 0.7965134409613065
Energy: 0.7190637284950087
Energy: 0.7507257125149747
Energy: 0.7190637284950087
Energy: 0.8001589550124744
Energy: 0.8000621721449521
Energy: 0.9236742620308732
Energy: 0.8000621721449521
Energy: 0.7394784278246863
Energy: 0.7195163714284037
Energy: 0.7504739016048311
Energy: 0.719516371427232
Energy: 0.7010326340839068
Energy: 0.7758623197170704
Energy: 0.7038169837162458
Energy: 0.7758623197170704
Energy: 0.8226923262035405
Energy: 0.8532216753173676
Energy: 0.7916222625704238
Energy: 0.8532216753173676
Energy: 0.745723956444441
Energy: 0.7732795203081545
Energy: 0.7026517132003299
Energy: 0.7732795203069828
Energy: 0.782553831175086
Energy: 0.7834436045870727
Energy: 0.7503261368099136
Energy: 0.7834436045870727
Energy: 0.7992954842184284
Energy: 0.7999308125438466
Energy: 1.106810298082067
Energy: 0.7999308125438466
Energy: 0.796617350384695
Energy: 0.7408109935119492
Energy: 0.8201506368892707
Energy: 0.7408109935119492
Energy: 0.9246586858674355
Energy: 0.8002446935356007
Energy: 0.8000304196114855
Energy: 0.8002446935367724
Energy: 0.8781431273729853
Energy: 0.7188530383951328
Energy: 0.7941749188049491
Energy: 0.7188530383951328
Energy: 0.7567416072744405
Energy: 0.7784357700573534
Energy: 0.7010991637939503
Energy: 0.7784357700573534
Energy: 0.7424314905616256
Energy: 0.7742191964300974
Energy: 0.8233365054785075
Energy: 0.7742191964300974
Energy: 0.7017156949863756
Energy: 0.7614165117104438
Energy: 0.7469195743127722
Energy: 0.7614165117104438
Energy: 0.7503407239714477
Energy: 0.7836511305317065
Energy: 0.7457483237888539
Energy: 0.7836511305317065
Energy: 0.8201053638584382
Energy: 0.9057104892495614
Energy: 0.8002622585824378
Energy: 0.9057104892495614

minimum gb energy = 0.7010326340839068 eV
minimum distance =  2.57334189715112 Angstroms
sigma value = 17


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

Energy: 1.0598705651613924
Energy: 0.9107363077173386
Energy: 0.9101941601721603
Energy: 0.9107363076901603
Energy: 0.8771783693851883
Energy: 0.961518125515395
Energy: 0.8896768533838767
Energy: 0.961518125515395
Energy: 0.7394399486803919
Energy: 0.7486438814393944
Energy: 0.9568712885574766
Energy: 0.7486438814393944
Energy: 0.7067530144418714
Energy: 0.7976411250440989
Energy: 0.8498954458902399
Energy: 0.7976411250440989
Energy: 0.7859898148084924
Energy: 0.871541113927919
Energy: 0.7147017758139859
Energy: 0.871541113927919
Energy: 0.8500571702772416
Energy: 0.890392845892812
Energy: 0.7296568959395705
Energy: 0.8903928458934756
Energy: 0.8561736748983438
Energy: 0.754091094322592
Energy: 0.7471092699867546
Energy: 0.754091094322592
Energy: 0.8703206537292786
Energy: 0.9763970081604769
Energy: 0.7395806680767907
Energy: 0.9763970081611405
Energy: 0.9052139496142714
Energy: 0.9109405657372859
Energy: 0.9579054048670524
Energy: 0.9109405657366223
Energy: 0.8962875359752359
Energy: 0.8319955210171174
Energy: 0.8892821847687528
Energy: 0.8319955210151265
Energy: 0.7850059200037606
Energy: 0.7214468442878906
Energy: 0.738084942892389
Energy: 0.7214468437937027
Energy: 0.871821376060241
Energy: 0.7791734894214793
Energy: 0.7136683618162739
Energy: 0.7791734894214793
Energy: 0.9157661559221232
Energy: 0.7802963441394074
Energy: 0.6920155553956229
Energy: 0.7802963441394074
Energy: 0.8535251959389292
Energy: 0.8078192396506982
Energy: 0.7381199755446843
Energy: 0.8078192396487075
Energy: 0.8964428740228672
Energy: 0.9734229255552208
Energy: 0.9881174769714361
Energy: 0.9734229255545572
Energy: 0.9092587270769258
Energy: 0.9439777154096994
Energy: 1.0605529079523668
Energy: 0.9439777154090359
Energy: 0.9574929081720122
Energy: 0.8010449947884719
Energy: 0.7488587441761351
Energy: 0.8010449947891355
Energy: 0.9519430314847849
Energy: 0.8012185038057308
Energy: 0.7391137025177509
Energy: 0.8012185038050671
Energy: 0.8414756058391685
Energy: 0.9001363060681752
Energy: 0.7854817249406747
Energy: 0.9001363060681752
Energy: 0.7144498809298208
Energy: 0.9087196827438698
Energy: 0.8578156502009276
Energy: 0.9087196827438698
Energy: 0.7623986053211524
Energy: 0.827086259994738
Energy: 0.8932858735088863
Energy: 0.827086259994738
Energy: 0.7480918534268747
Energy: 0.7540059645486263
Energy: 0.8520287493101784
Energy: 0.75400596454929
Energy: 0.9107321075302677
Energy: 0.8135825925537226
Energy: 0.8989763488701532
Energy: 0.8135825925543861
Energy: 0.9574077576789297
Energy: 0.9111389180548127
Energy: 0.9073578402737742
Energy: 0.9111389180548127
Energy: 0.7478713105478069
Energy: 0.9252006848716088
Energy: 0.8088880157565809
Energy: 0.9252006848716088
Energy: 0.6923690105081154
Energy: 0.7753281340070225
Energy: 0.7854990092866314
Energy: 0.7753281340070225
Energy: 0.7544788132861272
Energy: 0.8901515356717262
Energy: 0.872106051368209
Energy: 0.8901515356730534
Energy: 0.6916120563417738
Energy: 0.7746453142055251
Energy: 0.8547448192038586
Energy: 0.7746453142055251
Energy: 0.9030161006764104
Energy: 0.7690330075117222
Energy: 0.8083429265421902
Energy: 0.7690330075117222
Energy: 1.0604050554709976
Energy: 0.9108898458506721
Energy: 0.9092323105069938
Energy: 0.9108898458519995

minimum gb energy = 0.6916120563417738 eV
minimum distance =  2.60998444569669 Angstroms
sigma value = 53


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

Energy: 0.9427021349122664
Energy: 0.8272715112913898
Energy: 0.8276498625613887
Energy: 0.8272715112858864
Energy: 0.8130752131277407
Energy: 0.7891566748388341
Energy: 0.7654729479650471
Energy: 0.7891566748388341
Energy: 0.8134319066703538
Energy: 0.8274538628108832
Energy: 0.7802699632770597
Energy: 0.8274538628108832
Energy: 0.7506505438533664
Energy: 0.7890687396615497
Energy: 0.765163994148951
Energy: 0.7890687396612545
Energy: 0.7847590078770261
Energy: 0.6752046888236065
Energy: 0.6195459574385968
Energy: 0.6752046888234503
Energy: 0.7489736383133332
Energy: 0.9991848405593522
Energy: 0.6200046260865658
Energy: 0.9991848405598209
Energy: 0.9461797600202347
Energy: 0.8726803673692262
Energy: 0.8261493350394209
Energy: 0.8726803673705977
Energy: 0.8743824476319847
Energy: 1.0303405023485912
Energy: 0.8139318910975626
Energy: 1.0303405023485912
Energy: 0.8134374777311361
Energy: 1.001212339669678
Energy: 0.781606577083942
Energy: 1.0012123397063273
Energy: 0.8125702542219497
Energy: 0.868326905647316
Energy: 0.7648279326450532
Energy: 0.8683269056479235
Energy: 0.7833575064671489
Energy: 0.675529474881747
Energy: 0.6197684593138564
Energy: 0.6755294748822157
Energy: 0.7510572429099394
Energy: 0.8232605541102463
Energy: 0.6196561347549742
Energy: 0.8232605541106977
Energy: 0.8745482463018391
Energy: 0.8682756267182185
Energy: 0.8138090348328264
Energy: 0.868275626717767

minimum gb energy = 0.6195459574385968 eV
minimum distance =  2.58366732978623 Angstroms
sigma value = 9


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

Energy: 0.9152465255940683
Energy: 0.9809295523093738
Energy: 0.9701609035331886
Energy: 0.9809295523093738
Energy: 0.8207088812883466
Energy: 0.8626271605711165
Energy: 1.0177725816834045
Energy: 0.8626271605716821
Energy: 0.7277968114580459
Energy: 0.844841282017779
Energy: 0.8517053583794324
Energy: 0.8448412820183444
Energy: 0.7181985386224773
Energy: 0.7206870062712202
Energy: 0.9791885017668324
Energy: 0.7206870062712202
Energy: 0.7206128120741063
Energy: 0.7094733255291457
Energy: 0.957599415738289
Energy: 0.7094733255297112
Energy: 0.7747691027471157
Energy: 0.8817646448834323
Energy: 0.9581922102823868
Energy: 0.8817646448823014
Energy: 1.025359778263585
Energy: 1.014576553543146
Energy: 0.9690055232757556
Energy: 1.0145765535437112
Energy: 1.0443517985558046
Energy: 0.9693607842755139
Energy: 0.9575592872364622
Energy: 0.9693607842749484
Energy: 0.7723531908121309
Energy: 0.9189631870373616
Energy: 0.732609690988385
Energy: 0.9189631870373616
Energy: 0.6774220162751605
Energy: 0.8018827585525795
Energy: 0.9137127253618372
Energy: 0.8018827585050813
Energy: 0.8241262031636186
Energy: 0.8397930611823761
Energy: 1.0397537571440922
Energy: 0.8397930611835069
Energy: 0.838816393296571
Energy: 0.9212139857534705
Energy: 0.9184624104329827
Energy: 0.9212139857432923
Energy: 1.0574151966166292
Energy: 0.8388687600313548
Energy: 0.885159440467927
Energy: 0.8388687600307894
Energy: 1.0271293913768613
Energy: 0.8382956288884841
Energy: 0.8315706366853202
Energy: 0.8382956288879186
Energy: 0.915739000052985
Energy: 0.952834666988245
Energy: 0.7330271554850277
Energy: 0.9528346669888105
Energy: 0.7873822983691922
Energy: 0.9148996665210024
Energy: 0.7329163131797307
Energy: 0.9148996665210024
Energy: 0.8994474179739432
Energy: 0.9087047166795895
Energy: 0.9635123374578857
Energy: 0.9087047166795895
Energy: 0.9701384322966424
Energy: 0.9808568257187718
Energy: 0.9157128013704212
Energy: 0.980856825720468
Energy: 0.9825763490995777
Energy: 0.9292669940191769
Energy: 0.8463350606056158
Energy: 0.9292669940186113
Energy: 0.8509321866401888
Energy: 0.8447394020519858
Energy: 0.728001794038625
Energy: 0.8447394020514204
Energy: 0.9782915694805028
Energy: 0.7205679493738378
Energy: 0.7186950081403332
Energy: 0.7205679493721415
Energy: 0.9581863151631675
Energy: 0.7094996089333405
Energy: 0.7280189734757438
Energy: 0.7094996089333405
Energy: 0.9579034378076764
Energy: 0.8452403898214405
Energy: 0.7747265823810955
Energy: 0.845240389808435
Energy: 0.9722815711750019
Energy: 1.0145767926666376
Energy: 1.0268273242596233
Energy: 1.0145767926666376
Energy: 0.9573972903234973
Energy: 1.014920769112805
Energy: 1.0442500670135777
Energy: 1.0149207691122393
Energy: 0.7341780562015779
Energy: 0.9219169607827814
Energy: 0.7701163265783838
Energy: 0.9219169607827814
Energy: 0.9033537499361314
Energy: 0.8018593269503463
Energy: 0.6769813453382133
Energy: 0.8018593269497809
Energy: 1.0280939744712738
Energy: 0.8378011176128751
Energy: 0.8245860510293458
Energy: 0.8378011176123097
Energy: 0.9169357325074057
Energy: 0.8378421625697522
Energy: 0.8388709974338522
Energy: 0.8378421625708832
Energy: 0.8771466844362141
Energy: 0.8327752523445406
Energy: 1.0055347901403344
Energy: 0.8327752523445406
Energy: 0.8323981509477804
Energy: 0.8048954586884277
Energy: 0.853207112819061
Energy: 0.8048954586884277
Energy: 0.7713847828437641
Energy: 0.9533560935871486
Energy: 0.9159884386625077
Energy: 0.9533560935865831
Energy: 0.7350262404437088
Energy: 0.9075473230098373
Energy: 0.7885307981766907
Energy: 0.9075473230098373
Energy: 0.8516637559532693
Energy: 0.954477281129446
Energy: 0.8501687323852223
Energy: 0.9544772811300114
Energy: 0.9172818876844714
Energy: 0.9795539724793085
Energy: 0.9701868334714846
Energy: 0.9795539724787431

minimum gb energy = 0.6769813453382133 eV
minimum distance =  2.61285960354235 Angstroms
sigma value = 73


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

Energy: 0.9495879333025949
Energy: 0.9404621154165674
Energy: 0.9442008778927373
Energy: 0.9404621154165674
Energy: 0.8201575843466464
Energy: 0.9088005610252586
Energy: 1.030621203832681
Energy: 0.9088005610252586
Energy: 0.767911392512568
Energy: 0.8804503564318769
Energy: 0.8210888551272459
Energy: 0.8804503564309797
Energy: 0.7610396128625908
Energy: 0.749785683833483
Energy: 0.9992317529069267
Energy: 0.749785683833483
Energy: 0.7554613876884049
Energy: 0.7518041158430833
Energy: 0.9631377573663564
Energy: 0.7518041158430833
Energy: 0.7596434380198575
Energy: 0.9579106432593849
Energy: 0.9873833378188307
Energy: 0.9579106432593849
Energy: 1.1252415461009229
Energy: 1.0039056156953639
Energy: 0.9570374271386466
Energy: 1.0039056156962607
Energy: 1.1173876532532843
Energy: 0.8991533155030609
Energy: 0.9343976005096571
Energy: 0.8991533155030609
Energy: 0.8245956907778482
Energy: 0.9330285519153513
Energy: 0.8444318146223744
Energy: 0.9330285519153513
Energy: 0.7262257507928014
Energy: 0.8475862865311958
Energy: 0.9020136531337277
Energy: 0.8475862865302987
Energy: 0.8784978174794484
Energy: 0.7768481490659892
Energy: 1.0439362833614436
Energy: 0.776848149065092
Energy: 0.8446067096886907
Energy: 0.794648586418595
Energy: 0.8686617919556647
Energy: 0.794648586418595
Energy: 0.854712202689699
Energy: 0.8788046328305901
Energy: 0.8560802040799146
Energy: 0.8788046328305901
Energy: 0.8208417791266068
Energy: 0.858489900618575
Energy: 0.8415888352207402
Energy: 0.858489900618575
Energy: 0.9955049951265016
Energy: 0.9196636438221132
Energy: 0.7556525576884773
Energy: 0.919663643821216
Energy: 0.9560790590635682
Energy: 1.0007523120427264
Energy: 0.7758219352366648
Energy: 1.0007523120427264
Energy: 0.9921830803614039
Energy: 0.8446234346943605
Energy: 0.8071021924836859
Energy: 0.8446234346943605
Energy: 0.9350211949317537
Energy: 0.9351631350813682
Energy: 1.1219315454758938
Energy: 0.9351631350912366
Energy: 0.8550229105802788
Energy: 0.8649801022880985
Energy: 0.9245072597619716
Energy: 0.8649801022880985
Energy: 0.7851500441289828
Energy: 0.8369279742617174
Energy: 0.806389161232624
Energy: 0.8369279742617174
Energy: 0.817237075978929
Energy: 0.8241950989904828
Energy: 0.7268045792529252
Energy: 0.8241950989895858
Energy: 0.950778802277534
Energy: 0.9142071949302184
Energy: 0.9449254611544858
Energy: 0.9142071949293212

minimum gb energy = 0.7262257507928014 eV
minimum distance =  2.54996647924899 Angstroms
sigma value = 7


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

Energy: 1.0656435074993877
Energy: 0.9655257956614047
Energy: 0.9623329642753985
Energy: 0.9655257956607703
Energy: 0.8892298201142488
Energy: 0.8285909601339733
Energy: 0.9509420312665632
Energy: 0.8285909601358765
Energy: 0.7456033958292341
Energy: 0.8674654453541537
Energy: 0.7597764912855106
Energy: 0.8674654453541537
Energy: 0.7249112011750993
Energy: 0.756144382476177
Energy: 0.9574372207540921
Energy: 0.756144382476177
Energy: 0.8322578200788788
Energy: 0.775807530398969
Energy: 0.8304030756231237
Energy: 0.7758075303983346
Energy: 0.840247159019221
Energy: 0.8602888150169253
Energy: 0.8261248140519127
Energy: 0.8602888150169253
Energy: 0.949215689398204
Energy: 0.9487169792513147
Energy: 0.84099901895148
Energy: 0.9487169792513147
Energy: 0.9799747299853241
Energy: 0.7763110125512437
Energy: 0.767141471117726
Energy: 0.776311012551878
Energy: 0.9437473567435272
Energy: 0.721529572177479
Energy: 0.7205639434366696
Energy: 0.7215295721762103
Energy: 0.8265281862941257
Energy: 0.9605208255562024
Energy: 0.7359823658447195
Energy: 0.9605208255568367
Energy: 1.0523933094579399
Energy: 0.872713346449042
Energy: 1.002097501440352
Energy: 0.8727133464477733
Energy: 0.961645331305185
Energy: 0.9200343019740784
Energy: 0.9468312944508513
Energy: 0.9200343019753472
Energy: 0.8273794716740465
Energy: 0.7783939393700426
Energy: 0.7881838903562377
Energy: 0.7783939393700426
Energy: 0.7625888869224138
Energy: 0.8255004387071917
Energy: 0.694951776932301
Energy: 0.8255004387065573
Energy: 0.8284902073832058
Energy: 0.8615811340201126
Energy: 0.7367303136493498
Energy: 0.8615811340340688
Energy: 1.0680896800415707
Energy: 0.9213733513319184
Energy: 0.9616867707141774
Energy: 0.9213733513281123
Energy: 1.0732518085097893
Energy: 0.8749921069106247
Energy: 1.027573672283893
Energy: 0.8749921068072507
Energy: 0.7457572865653681
Energy: 0.9604169594284325
Energy: 0.7586234077004373
Energy: 0.9604169594277983
Energy: 0.724563681087373
Energy: 0.721858540664915
Energy: 0.9453354862911655
Energy: 0.721858540664915
Energy: 0.8222360052034714
Energy: 0.7756618740919324
Energy: 1.0133311860926713
Energy: 0.7756618740938355
Energy: 0.8404816057037674
Energy: 0.9085449958105845
Energy: 0.8289632329535523
Energy: 0.9085449958086813
Energy: 0.9700296932650511
Energy: 0.8439186512345644
Energy: 0.8405813160109342
Energy: 0.8439186512364674
Energy: 0.9480003483430489
Energy: 0.7767598112892369
Energy: 0.8307329627642551
Energy: 0.7767598112898714
Energy: 0.9459629685597796
Energy: 0.7550248023539973
Energy: 0.7249942232319948
Energy: 0.7550248023552659
Energy: 0.8273457436226614
Energy: 0.9507674968427952
Energy: 0.7357718941838358
Energy: 0.9507674968427952
Energy: 0.8897748908938893
Energy: 0.8994639879910236
Energy: 0.7918782290216524
Energy: 0.8994639879948297
Energy: 0.9623036228465681
Energy: 0.966255839798828
Energy: 0.9443833124019287
Energy: 0.9662558397994624
Energy: 0.8412186974128587
Energy: 0.8726543662459301
Energy: 0.8721086487715902
Energy: 0.8726543662421239
Energy: 0.7604504425836737
Energy: 0.8156879255743731
Energy: 0.7884759419069902
Energy: 0.815687925575642
Energy: 0.8288717060863088
Energy: 0.8162334940256689
Energy: 0.6942464362286812
Energy: 0.816233493980023
Energy: 1.0645818654689578
Energy: 0.8327866131473715
Energy: 0.9342406796833163
Energy: 0.8327866131530807

minimum gb energy = 0.6942464362286812 eV
minimum distance =  2.54576855849355 Angstroms
sigma value = 29


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

Energy: 0.6206636859833656
Energy: 0.8561507015405644
Energy: 0.8118735475495062
Energy: 0.8561507015405644
Energy: 0.6373507068086633
Energy: 0.7020492665421749
Energy: 0.8255397645615943
Energy: 0.7020492665423959
Energy: 0.8105477058458845
Energy: 0.8591083981882389
Energy: 0.624411737866429
Energy: 0.8591083981882389
Energy: 0.6468439384755923
Energy: 0.6366409758819856
Energy: 0.8249563759157841
Energy: 0.6366409758822065
Energy: 0.6319530490637798
Energy: 0.6377434182168007
Energy: 0.622858859345493
Energy: 0.6377434182168007
Energy: 0.8252038041143018
Energy: 0.7057786627299697
Energy: 0.623094329131848
Energy: 0.7057786627295277
Energy: 0.6254722763918197
Energy: 0.8595066318523263
Energy: 0.970887570189835
Energy: 0.8595066318518844
Energy: 0.8253522143409994
Energy: 0.637122330913658
Energy: 0.6452241833549648
Energy: 0.6371223309134615
Energy: 0.6230255734844538
Energy: 0.6360159959422172
Energy: 0.7998761814228902
Energy: 0.6360159959419962

minimum gb energy = 0.6206636859833656 eV
minimum distance =  2.62486818758746 Angstroms
sigma value = 5


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

Energy: 0.8333640380267928
Energy: 0.8403557314660293
Energy: 0.8862055226592865
Energy: 0.8403557526997201
Energy: 0.9173806373723152
Energy: 0.6497808747234829
Energy: 0.7684369775681514
Energy: 0.6497808747222845
Energy: 0.7694428680341662
Energy: 0.7888202619934397
Energy: 0.7488484350656035
Energy: 0.7888202619934397
Energy: 0.6586510475292756
Energy: 0.6486603299712189
Energy: 0.8771806730007018
Energy: 0.6486603299706198
Energy: 0.8674968515015455
Energy: 0.6502810447146536
Energy: 0.9773151665637848
Energy: 0.650281044758371
Energy: 0.7918599892849799
Energy: 0.652196801727458
Energy: 0.9775317002037577
Energy: 0.6521968017250609
Energy: 0.6485204591431543
Energy: 0.6484668412789776
Energy: 0.8685059521608586
Energy: 0.6484668412789776
Energy: 0.6502892428695912
Energy: 0.6504736035314947
Energy: 0.8370272881859023
Energy: 0.650473603532094
Energy: 0.8810310560709759
Energy: 0.8384360718876255
Energy: 0.8902196043859473
Energy: 0.8384360718870262
Energy: 0.7447934707614432
Energy: 0.6403997043625016
Energy: 0.6806846967045553
Energy: 0.6403997043637
Energy: 0.897353287240231
Energy: 0.6399417620991737
Energy: 0.6395756369071012
Energy: 0.6399417620985746
Energy: 0.8722203492610278
Energy: 0.641074597081479
Energy: 0.6832839260523049
Energy: 0.641074597081479
Energy: 0.8392229647357697
Energy: 0.8490520080091927
Energy: 0.6799779191726012
Energy: 0.8490520080091927
Energy: 0.7392153962575897
Energy: 0.823089132467668
Energy: 0.7663578239823837
Energy: 0.8230891324664695
Energy: 0.6528367716644367
Energy: 0.6495967827408079
Energy: 0.7672299144676779
Energy: 0.6495967827354148
Energy: 0.6524766344896753
Energy: 0.6496187097399372
Energy: 0.931736270305044
Energy: 0.6496187097399372
Energy: 0.8852393411153991
Energy: 0.8403013261090844
Energy: 1.0717861258762935
Energy: 0.8403013261300579
Energy: 0.7908117873769889
Energy: 0.6503203414835911
Energy: 0.9262258254670718
Energy: 0.6503203414829919
Energy: 0.747171407224397
Energy: 0.7884188218809559
Energy: 0.7706775118216074
Energy: 0.7884188218797573
Energy: 0.8560826721955723
Energy: 0.8221686872297662
Energy: 0.6568916392271794
Energy: 0.8221686872291669
Energy: 0.9780990806560077
Energy: 0.6502232383269851
Energy: 0.8656664441777618
Energy: 0.6502232383269851
Energy: 0.9776655729187752
Energy: 0.6520464573723228
Energy: 0.7919861154654151
Energy: 0.652046457372922
Energy: 0.8945032513094858
Energy: 0.649124891625643
Energy: 0.649313666893449
Energy: 0.6491248916250437
Energy: 0.8385993358944732
Energy: 0.6499590515914492
Energy: 0.6535048989301472
Energy: 0.6499590515914492
Energy: 0.8683673897330725
Energy: 0.7999864471355373
Energy: 0.8998591831793675
Energy: 0.7999864471361366
Energy: 0.8181080673612401
Energy: 0.6412576199656819
Energy: 0.7448414160124813
Energy: 0.6412576200351667
Energy: 0.641204218061214
Energy: 0.6397834916447607
Energy: 0.899555412372329
Energy: 0.6397834916447607
Energy: 0.6809368184957951
Energy: 0.6404064181869789
Energy: 1.0030945187656568
Energy: 0.6404064181869789
Energy: 0.6637199210728428
Energy: 0.7714828563016768
Energy: 0.8359625737666033
Energy: 0.7714828563010776
Energy: 0.7682097380167923
Energy: 0.6391074017589725
Energy: 0.8787377698209409
Energy: 0.6391074017679612
Energy: 0.7673378947972905
Energy: 0.7752779902430548
Energy: 0.6500177924043746
Energy: 0.7752779902430548
Energy: 0.9295008689139849
Energy: 0.6488111414272648
Energy: 0.6501890513053507
Energy: 0.648811141427864
Energy: 1.073372956714856
Energy: 0.6798744310941973
Energy: 0.7808404918642967
Energy: 0.6798744310965943

minimum gb energy = 0.6391074017589725 eV
minimum distance =  2.59556928420474 Angstroms
sigma value = 1


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

Energy: 0.9608331495128029
Energy: 0.8411570758446996
Energy: 0.8424461027290693
Energy: 0.8411570758438709
Energy: 0.9288374328040645
Energy: 0.6315832541245704
Energy: 0.7878574921512903
Energy: 0.631583254125399
Energy: 0.7805535420391732
Energy: 0.8661580685533973
Energy: 0.7687900111218299
Energy: 0.8661580685533973
Energy: 0.6955626022957354
Energy: 0.6361172223177932
Energy: 0.8152947088413616
Energy: 0.6361172223153075
Energy: 0.8606879197638209
Energy: 0.7283111636337832
Energy: 1.137353363562627
Energy: 0.7283111636329547
Energy: 0.7381890912124278
Energy: 0.6371614700412771
Energy: 1.0699865251100837
Energy: 0.6371614700412771
Energy: 0.6348167858476657
Energy: 0.6352002741560259
Energy: 0.952271781868212
Energy: 0.6352002741568544
Energy: 0.6443920496363339
Energy: 0.6373587909436362
Energy: 0.9651972527353135
Energy: 0.6373587908260195
Energy: 0.8803540125332067
Energy: 0.6807015686434083
Energy: 0.9627411338830729
Energy: 0.6807015686434083
Energy: 0.8182125504706205
Energy: 0.6099065513875945
Energy: 0.6868441009584118
Energy: 0.6099065513784805
Energy: 0.9964391547646358
Energy: 0.6175978292098834
Energy: 0.6805953537657302
Energy: 0.6175978292090548
Energy: 0.9120663027413984
Energy: 0.6093239046923128
Energy: 0.701013434980123
Energy: 0.6093239046923128
Energy: 0.8830520988645547
Energy: 0.8111769736873985
Energy: 0.8885411648165299
Energy: 0.8111769736873985
Energy: 0.7209825623357254
Energy: 0.8285877506987862
Energy: 0.8441895989116036
Energy: 0.8285877506979578
Energy: 0.695463935587228
Energy: 0.9006995605768282
Energy: 0.8662116990608828
Energy: 0.9006995605759996
Energy: 0.7104958573812677
Energy: 0.636097252064743
Energy: 0.9626003709508659
Energy: 0.6360972520639144
Energy: 0.8544152808581502
Energy: 0.8401016428623564
Energy: 1.1286671050583956
Energy: 0.8401016428093481
Energy: 0.6365297323929456
Energy: 0.6370067538436656
Energy: 1.0370612605523506
Energy: 0.6370067538444941
Energy: 0.6361518123968721
Energy: 0.7743431975786933
Energy: 0.9602039205285525
Energy: 0.7743431975786933
Energy: 0.6486260636922857
Energy: 0.6377923160600044
Energy: 0.9649098258753853
Energy: 0.6377923160591759
Energy: 0.8501345767406726
Energy: 0.681587380125367
Energy: 0.9352356699444877
Energy: 0.6815873801245385
Energy: 0.8192106713549802
Energy: 0.6318538003260445
Energy: 0.6321710156201836
Energy: 0.6318538003260445
Energy: 0.9112590884587991
Energy: 0.6312222367446132
Energy: 0.6314303322382969
Energy: 0.6312222367446132
Energy: 0.9635916432073963
Energy: 0.6794441063590929
Energy: 0.6962679537071059
Energy: 0.6794442567366196

minimum gb energy = 0.6093239046923128 eV
minimum distance =  2.59026050933891 Angstroms
sigma value = 17


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

Energy: 0.9322837661034815
Energy: 0.8329271662749995
Energy: 0.8886822123232616
Energy: 0.8329271580167655
Energy: 0.9861892112179492
Energy: 0.6183673472956274
Energy: 0.7207872515192852
Energy: 0.6183673472956274
Energy: 0.8114701132690093
Energy: 0.8601923098647541
Energy: 0.7013156156270578
Energy: 0.860192309864242
Energy: 0.7749124565789055
Energy: 0.8263881475941475
Energy: 0.7215663733638339
Energy: 0.8263881475941475
Energy: 0.9548790230662296
Energy: 0.6239685378639843
Energy: 0.8826467936614986
Energy: 0.6239685378634723
Energy: 0.6093918755202411
Energy: 0.6112107298274357
Energy: 1.0082663531633673
Energy: 0.6112107298258994
Energy: 0.6099352284258333
Energy: 0.6091671211887176
Energy: 0.9030811625232056
Energy: 0.6091671211887176
Energy: 0.638186839167838
Energy: 0.6127210149273967
Energy: 0.9345825634821255
Energy: 0.6127210149325177
Energy: 0.8797874056462726
Energy: 0.6105197501461569
Energy: 0.9770578249005102
Energy: 0.6105197501466689
Energy: 0.6977851146119661
Energy: 0.7669534148485766
Energy: 0.725924348289875
Energy: 0.7669534148741589
Energy: 0.8829666929169382
Energy: 0.7695597639845584
Energy: 0.6225933312144206
Energy: 0.7695597639855826
Energy: 1.0053427936363892
Energy: 0.6197005981757676
Energy: 0.7826248556620224
Energy: 0.6197005982039105
Energy: 1.0543231681928575
Energy: 0.6873075795841831
Energy: 0.6976147248679194
Energy: 0.6873075795862315
Energy: 0.9510799322302371
Energy: 0.6173642248494329
Energy: 0.6186709735430368
Energy: 0.6173642248494329
Energy: 0.8044158367242921
Energy: 0.6181001160704169
Energy: 0.6247797177552875
Energy: 0.6181001160699048
Energy: 0.9476044297972216
Energy: 0.6454586146529703
Energy: 0.9904723686329998
Energy: 0.6454586146550187
Energy: 0.6179420421857125
Energy: 0.6200753616492721
Energy: 0.853873638572568
Energy: 0.6200767621514333
Energy: 0.6187536937328358
Energy: 0.6171714433514007
Energy: 0.9977622681503661
Energy: 0.6171714433503767
Energy: 0.6506022001233284
Energy: 0.6186502597665586
Energy: 1.055667697001631
Energy: 0.6186502597655344
Energy: 0.6973804798703624
Energy: 0.6787831019118921
Energy: 0.9329231308453816
Energy: 0.6787831019287685
Energy: 0.7212503762960609
Energy: 0.6177186850956458
Energy: 0.9209612606651336
Energy: 0.6177186850951335
Energy: 0.7184937776901746
Energy: 0.8597524169777649
Energy: 0.8093285730047337
Energy: 0.8597524169777649
Energy: 0.7484326479598463
Energy: 0.6091812200594857
Energy: 0.8076025563724099
Energy: 0.6091812200594857
Energy: 0.8552828503256548
Energy: 0.764314921160521
Energy: 0.8222359858540154
Energy: 0.7643149211574483
Energy: 1.008128320814618
Energy: 0.6111796580398683
Energy: 0.6160071202201008
Energy: 0.6111796580403804
Energy: 0.9759628699522453
Energy: 0.6100908392114635
Energy: 0.6113574489119052
Energy: 0.6100908392114635
Energy: 0.9334947054211108
Energy: 0.6109942135670632
Energy: 0.6223247934203073
Energy: 0.6109942135665511
Energy: 1.0454218380930578
Energy: 0.6107846916431793
Energy: 0.8788691372847734
Energy: 0.6107846916365218
Energy: 0.723007907025455
Energy: 0.7734597774565476
Energy: 0.6992543639870047
Energy: 0.7734597774560356
Energy: 0.6236676219452476
Energy: 0.616302160097863
Energy: 0.884960876677076
Energy: 0.6163021601014478
Energy: 0.7859137447996725
Energy: 0.6205338376488918
Energy: 1.0338512721987982
Energy: 0.6205338376478676
Energy: 0.7035557675867086
Energy: 0.633940421458095
Energy: 1.0515181165135676
Energy: 0.6339404214586072
Energy: 0.6170664609024753
Energy: 0.6168533316227636
Energy: 0.9279858522545232
Energy: 0.6168533316217393
Energy: 0.6171627518121486
Energy: 0.6190101833331154
Energy: 0.7750782451735259
Energy: 0.6190101833305549
Energy: 0.991459515849411
Energy: 0.7882088836883109
Energy: 0.946492845305309
Energy: 0.7882088836883109
Energy: 0.8534684133980955
Energy: 0.620081954607483
Energy: 0.6178889517096994
Energy: 0.6200819546059467
Energy: 0.9955646220462642
Energy: 0.6164701125264659
Energy: 0.6172783889067266
Energy: 0.6164701125280023
Energy: 1.0675736625002272
Energy: 0.6189128160209912
Energy: 0.6531492335972129
Energy: 0.6189128160209912

minimum gb energy = 0.6091671211887176 eV
minimum distance =  2.59281037486708 Angstroms
sigma value = 89


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

Energy: 0.972726744888105
Energy: 0.5677897867312132
Energy: 0.5668394139176727
Energy: 0.5677897858227445
Energy: 0.7612653652283395
Energy: 0.8029857238484835
Energy: 0.7588081116408182
Energy: 0.8029857238484835
Energy: 0.559155462541618
Energy: 0.7420629980208148
Energy: 0.7759899430965914
Energy: 0.7420629980208148
Energy: 0.5605032601586266
Energy: 0.6250810005074874
Energy: 0.760412175438167
Energy: 0.6250810005014575
Energy: 0.6071531523204746
Energy: 0.5649666607580012
Energy: 0.7637047454761876
Energy: 0.5649666607580012
Energy: 0.5656305179177845
Energy: 0.5661265928391057
Energy: 0.764997265079067
Energy: 0.5661265928391057
Energy: 0.5630821754517104
Energy: 0.5633572549739649
Energy: 0.7609119659125069
Energy: 0.5633572549736909
Energy: 0.5658589382196813
Energy: 0.5658510174846797
Energy: 0.9748278331248301
Energy: 0.5658510174846797
Energy: 0.7530367350943968
Energy: 0.803912171605912
Energy: 0.9403135123968154
Energy: 0.8039121716063079
Energy: 0.770180847330018
Energy: 0.6253256460004567
Energy: 0.761199281273558
Energy: 0.6253256460005937
Energy: 0.7603772140515911
Energy: 0.6248591199715158
Energy: 0.5578940826108615
Energy: 0.6248591199712417
Energy: 0.7655016572300036
Energy: 0.7426277668866832
Energy: 0.6092583107510182
Energy: 0.7426277668862873
Energy: 0.7662949529113197
Energy: 0.5653703257496181
Energy: 0.5657604988094362
Energy: 0.5653703257493593
Energy: 0.7783048277124839
Energy: 0.563263381675969
Energy: 0.5622463760955211
Energy: 0.563263381675969
Energy: 0.9686753551449432
Energy: 0.5649805801436691
Energy: 0.5652614489890052
Energy: 0.5649805801471408

minimum gb energy = 0.5578940826108615 eV
minimum distance =  2.61991158577012 Angstroms
sigma value = 13


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

Energy: 0.8630802665709919
Energy: 0.5502350837838165
Energy: 0.6028317744107473
Energy: 0.5502350813087272
Energy: 0.9283338806755058
Energy: 0.5447431606500147
Energy: 0.6409593317649466
Energy: 0.5447431606494532
Energy: 0.8809957191243537
Energy: 0.5434028819973891
Energy: 0.6396027822399002
Energy: 0.5434028819906752
Energy: 0.6909239164033207
Energy: 0.9837420450883798
Energy: 0.8067775416110426
Energy: 0.9837420450872565
Energy: 0.8185533286705365
Energy: 0.5847233773539036
Energy: 0.8091480792321394
Energy: 0.5847233773522188
Energy: 0.6401020333235117
Energy: 0.7245311395846149
Energy: 0.8085406372437381
Energy: 0.72453113958293
Energy: 0.6382467434395647
Energy: 0.5438854405056226
Energy: 0.9982031083409961
Energy: 0.5438854405095539
Energy: 0.6816564523764451
Energy: 0.6950000192947039
Energy: 0.9703698387098838
Energy: 0.6949434438679457
Energy: 0.5503182893340819
Energy: 0.5452753845333084
Energy: 1.0376568015583647
Energy: 0.5452753845327467
Energy: 0.5456513956376208
Energy: 0.5441971723788854
Energy: 0.9707178341087767
Energy: 0.544197172379447
Energy: 0.5437328383709051
Energy: 0.548449376576802
Energy: 0.8634401273653494
Energy: 0.5484493764909251
Energy: 0.8155193505603732
Energy: 0.7627001016591942
Energy: 0.9738310679874197
Energy: 0.7627001016603175
Energy: 0.8116609565432749
Energy: 0.8707390497916122
Energy: 0.809038070009257
Energy: 0.8707390497932971
Energy: 0.8452974625109416
Energy: 0.7530841339467881
Energy: 0.6918310007289526
Energy: 0.7530841339456649
Energy: 0.9431576947989567
Energy: 0.546235741081655
Energy: 0.8132700795354947
Energy: 0.5462357410805316
Energy: 0.9401589455631301
Energy: 0.5461774839044213
Energy: 0.5504974471016797
Energy: 0.5461774839044213
Energy: 0.845185247082235
Energy: 0.544921930595693
Energy: 0.5462683520290277
Energy: 0.5449219305968163
Energy: 0.8642071653012667
Energy: 0.5447667907966476
Energy: 0.6034654320939412
Energy: 0.5447667916886805
Energy: 0.9936179212184171
Energy: 0.5455238060356462
Energy: 0.6532940348274093
Energy: 0.5455238060362079
Energy: 0.9348624667906249
Energy: 0.5433619193161862
Energy: 0.618463964257143
Energy: 0.5433619193173095
Energy: 0.6893242393542935
Energy: 0.5457406640309594
Energy: 0.6392853240366827
Energy: 0.5457406640365756
Energy: 0.9012167506614857
Energy: 0.769869062253632
Energy: 0.8085080218520031
Energy: 0.7698690622530705
Energy: 0.6438306752715743
Energy: 0.5451107319985311
Energy: 0.8090989085001813
Energy: 0.5451107319985311
Energy: 0.5453230202528287
Energy: 0.5434156496659414
Energy: 0.9738548506138226
Energy: 0.5434156496653797
Energy: 0.6485004113903325
Energy: 0.6039571379327063
Energy: 0.9754905145151092
Energy: 0.6039571379327063
Energy: 0.5437865322185627
Energy: 0.5468320608665908
Energy: 0.9416240379835934
Energy: 0.5468320608665908
Energy: 0.5437379462495058
Energy: 0.5437863435106897
Energy: 0.9708757435218789
Energy: 0.543786343511813
Energy: 0.543642422668623
Energy: 0.5463646624620966
Energy: 0.8652307403712018
Energy: 0.5463646624615351
Energy: 0.816628258886333
Energy: 0.7629912181340459
Energy: 0.9907404623866887
Energy: 0.7629912181329226
Energy: 0.617705957318604
Energy: 0.7236759792388257
Energy: 0.8095951545316004
Energy: 0.7236759792388257
Energy: 0.8525283557686504
Energy: 0.582895351178283
Energy: 0.6904853009967045
Energy: 0.5828953511799678
Energy: 0.9399682406736253
Energy: 0.5458384505666605
Energy: 0.8767822537316108
Energy: 0.5458384505627292
Energy: 0.945331747685056
Energy: 0.5464740354443564
Energy: 0.5436990073411689
Energy: 0.5464740354460413
Energy: 0.9737441987427068
Energy: 0.5436837388062584
Energy: 0.5440259795494073
Energy: 0.5436837388073816
Energy: 0.9973848111060142
Energy: 0.606339565361171
Energy: 0.6029357312798499
Energy: 0.6063395653600477

minimum gb energy = 0.5433619193161862 eV
minimum distance =  2.60736780600712 Angstroms
sigma value = 37


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

Energy: 0.8413998018595042
Energy: 0.5589727376492843
Energy: 0.5587999016205957
Energy: 0.5589727376270607
Energy: 1.0344368356466493
Energy: 0.5126587755013547
Energy: 0.6631068728556664
Energy: 0.5126587755264773
Energy: 0.8572797998729801
Energy: 0.7091694009019754
Energy: 0.6623905877776415
Energy: 0.7091694009019754
Energy: 0.8454024778267213
Energy: 0.895398906273855
Energy: 0.8213029195608816
Energy: 0.895398906273855
Energy: 0.875681553871971
Energy: 0.6402474326196681
Energy: 0.687600572207858
Energy: 0.6402474326196681
Energy: 0.6544722673076715
Energy: 0.6913038319086277
Energy: 0.9031352944764701
Energy: 0.6913038319086277
Energy: 0.560349785832798
Energy: 0.6590636271898849
Energy: 0.937437854443315
Energy: 0.6590636271898849
Energy: 0.6827651909133803
Energy: 0.4971888646656777
Energy: 1.0264265160657813
Energy: 0.49718886473425944
Energy: 0.5961468629126027
Energy: 0.5086788296324496
Energy: 0.951148687898943
Energy: 0.5086788296324496
Energy: 0.5716546121884479
Energy: 0.49630792372193916
Energy: 0.980964979972016
Energy: 0.4963079237209729
Energy: 0.6350171657294077
Energy: 0.6355429067220685
Energy: 0.7505839564631718
Energy: 0.6355429067220685
Energy: 0.719311479910105
Energy: 0.49635567617509174
Energy: 0.9810325481412743
Energy: 0.49635567617509174
Energy: 0.7431477957291797
Energy: 0.7047127052411598
Energy: 0.8573387053516207
Energy: 0.7047127052411598
Energy: 0.8343326228660396
Energy: 0.7192926241276366
Energy: 0.845054763897722
Energy: 0.7192926241392317
Energy: 0.687600572207858
Energy: 0.8526749757283414
Energy: 0.8543858922918629
Energy: 0.8526749757283414
Energy: 0.8944620008728679
Energy: 0.690515001566178
Energy: 0.6637930333982313
Energy: 0.6905150015652117
Energy: 0.9423822244210043
Energy: 0.5124357587859695
Energy: 0.560293483298862
Energy: 0.5124357587859695
Energy: 1.0264265160657813
Energy: 0.6723559541272257
Energy: 0.6631448194674447
Energy: 0.6723559534810905
Energy: 0.951148687898943
Energy: 0.5144002426709984
Energy: 0.5132033134696289
Energy: 0.5144002426709984
Energy: 1.0342242168764881
Energy: 0.5133727703412355
Energy: 0.5130954951356643
Energy: 0.5133727703412355

minimum gb energy = 0.4963079237209729 eV
minimum distance =  2.6045385804214 Angstroms
sigma value = 25


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

Energy: 0.9653716820035125
Energy: 0.4914186008668472
Energy: 0.49156636860385017
Energy: 0.49141876198813866
Energy: 1.0344341596381963
Energy: 0.4559040139757002
Energy: 0.5757124496446453
Energy: 0.4559040139757002
Energy: 0.893633508673632
Energy: 0.6261293227847237
Energy: 0.574570711171473
Energy: 0.6261293227847237
Energy: 0.7007081172004911
Energy: 0.7900636112925785
Energy: 0.7811773686226071
Energy: 0.7900636112925785
Energy: 0.8958897324009285
Energy: 0.7210578998206728
Energy: 0.7789782260574408
Energy: 0.7210578998206728
Energy: 0.7313770178134413
Energy: 0.7849283902760729
Energy: 0.7780387199567573
Energy: 0.7849283902753184
Energy: 0.732825928695203
Energy: 0.591208099180564
Energy: 0.8929678682123425
Energy: 0.591208099180564
Energy: 0.7665565736552696
Energy: 0.7763865737093538
Energy: 0.8296842152811443
Energy: 0.7763865737093538
Energy: 0.5685770070181422
Energy: 0.5805367004697735
Energy: 0.9389142347069424
Energy: 0.5805367004705281
Energy: 0.5691608947350753
Energy: 0.5714818745191084
Energy: 0.9739777920672557
Energy: 0.5714818745191084
Energy: 0.5505534468307446
Energy: 0.45752197281796697
Energy: 0.8273567463625137
Energy: 0.45752197276290457
Energy: 0.5006265626344361
Energy: 0.4538703809488871
Energy: 0.9742453534341934
Energy: 0.45387038094964155
Energy: 0.5105053526333851
Energy: 0.44821361010295313
Energy: 1.0087330127559642
Energy: 0.4482136097847026
Energy: 0.6510277874546047
Energy: 0.6499444197511156
Energy: 0.8938036270749722
Energy: 0.6499444197518702
Energy: 0.6245954142756971
Energy: 0.4474572669175173
Energy: 0.9187535597136903
Energy: 0.4474572669175173
Energy: 0.6685869807081515
Energy: 0.6580731213219315
Energy: 0.8952701494435629
Energy: 0.6580731213226859
Energy: 0.7986069935559358
Energy: 0.7987435512522969
Energy: 0.8932559514003982
Energy: 0.7987435512522969
Energy: 0.5895091626726269
Energy: 0.7788187759541004
Energy: 0.8161276422492859
Energy: 0.7788187759541004
Energy: 0.7698171121929874
Energy: 0.743268677701925
Energy: 0.7323410948617677
Energy: 0.7432686777011704
Energy: 0.9429690015173418
Energy: 0.6055563388462114
Energy: 0.7313546636247522
Energy: 0.605556338846966
Energy: 0.8283367357958658
Energy: 0.540510758976145
Energy: 0.5744599007209875
Energy: 0.5405107593351393
Energy: 0.9375680526100735
Energy: 0.6208569869244237
Energy: 0.4964709119380773
Energy: 0.6208569869244237
Energy: 0.9708324751048312
Energy: 0.4567410085040693
Energy: 0.5839875963209157
Energy: 0.45674100845883275
Energy: 0.8290491261765376
Energy: 0.45549372589142273
Energy: 0.45544894245666057
Energy: 0.45549372589217724
Energy: 0.9938177602822471
Energy: 0.45546068431114095
Energy: 0.45665618126846574
Energy: 0.45546068431114095
Energy: 0.9207057660147636
Energy: 0.45591276395246594
Energy: 0.4552775807173402
Energy: 0.45591276395246594

minimum gb energy = 0.4474572669175173 eV
minimum distance =  2.60373402041254 Angstroms
sigma value = 41


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

Energy: 0.9806029448653575
Energy: 0.41143287568113185
Energy: 0.41536425514345326
Energy: 0.41602219487566694
Energy: 0.9584910145240272
Energy: 0.4096375963573951
Energy: 0.5111505702124652
Energy: 0.40963759635553937
Energy: 0.8865917768243754
Energy: 0.547648168723633
Energy: 0.5098472101813062
Energy: 0.5476481687230145
Energy: 0.7618320790334822
Energy: 0.6598418101002694
Energy: 0.6886117418548328
Energy: 0.6598418100699873
Energy: 0.8916280365019796
Energy: 0.5891067320409699
Energy: 0.6836421675978624
Energy: 0.5891067320409699
Energy: 0.7593397723426659
Energy: 0.7143379048402545
Energy: 0.6827385278846972
Energy: 0.7143379048408731
Energy: 0.7627333007296105
Energy: 0.7279973731498446
Energy: 0.8242197338433196
Energy: 0.7279973731492261
Energy: 0.7663765292984674
Energy: 0.7179749900212073
Energy: 0.6602558646972178
Energy: 0.7179749900212073
Energy: 0.6032200041698439
Energy: 0.7122746286614298
Energy: 0.8216737377364582
Energy: 0.7122746286620484
Energy: 0.6039247304548835
Energy: 0.5816468423023821
Energy: 0.958576826177812
Energy: 0.5816468423017637
Energy: 0.509784526859205
Energy: 0.5495298202467074
Energy: 0.8710959181455988
Energy: 0.5495297839257349
Energy: 0.4847882273591152
Energy: 0.5479673247048868
Energy: 0.9541214967385017
Energy: 0.5479673247055054
Energy: 0.5123205364942583
Energy: 0.4107600374707533
Energy: 0.9550608322234804
Energy: 0.41076003747137185
Energy: 0.4114551652494153
Energy: 0.4116403350900471
Energy: 0.87143979931279
Energy: 0.41164033508942854
Energy: 0.41073938238303603
Energy: 0.40984462170950037
Energy: 0.9775698246990265
Energy: 0.40984462170950037
Energy: 0.40920125301197574
Energy: 0.4124983795454817
Energy: 0.9015666188715362
Energy: 0.4124983795448631
Energy: 0.5083133791680918
Energy: 0.41239444515023627
Energy: 0.916774522882667
Energy: 0.4123944451539478
Energy: 0.48412354939867974
Energy: 0.40893537078935505
Energy: 0.9057703605183466
Energy: 0.40893537073865976
Energy: 0.514545737219498
Energy: 0.5499062567619399
Energy: 0.760680179267133
Energy: 0.5499062567613213
Energy: 0.7014618687311898
Energy: 0.5949464147637928
Energy: 0.7593239498228502
Energy: 0.5949464147644115
Energy: 0.6601835909901864
Energy: 0.7192316136946211
Energy: 0.8274341158835632
Energy: 0.7192316136952396
Energy: 0.6866318537912469
Energy: 0.7146277540342992
Energy: 0.7636319569148589
Energy: 0.7146277540342992
Energy: 0.8214357679700699
Energy: 0.7604549372423136
Energy: 0.7577317342417199
Energy: 0.7604549372423136
Energy: 0.6607292638599975
Energy: 0.715262267506734
Energy: 0.6850682857847723
Energy: 0.715262267506734
Energy: 0.8258571682840133
Energy: 0.7134161756484932
Energy: 0.5582457694138362
Energy: 0.7134161756472561
Energy: 0.8371943765496854
Energy: 0.589920640582395
Energy: 0.6827343221468326
Energy: 0.5899206405817766
Energy: 0.838945304666273
Energy: 0.5505942102367855
Energy: 0.5141457030922689
Energy: 0.5505942102367855
Energy: 0.9591757357724571
Energy: 0.4092075128121039
Energy: 0.48332782531399054
Energy: 0.4092075128213825
Energy: 0.8389775300926192
Energy: 0.41329699297043004
Energy: 0.5323102952295673
Energy: 0.41329699297043004
Energy: 0.8368444973019297
Energy: 0.41255504196805154
Energy: 0.41310826273591783
Energy: 0.41255504196805154
Energy: 0.9541171443855117
Energy: 0.4092439965154393
Energy: 0.41030986175942336
Energy: 0.40924399651482074
Energy: 0.9519640853280343
Energy: 0.4132189882817748
Energy: 0.40975785621683797
Energy: 0.4132189882749986

minimum gb energy = 0.40893537073865976 eV
minimum distance =  2.61308995585421 Angstroms
sigma value = 15


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

Energy: 0.84894569189492
Energy: 0.38591851205573574
Energy: 0.3816707384239034
Energy: 0.385595828637478
Energy: 0.9718179744386151
Energy: 0.3800667600748864
Energy: 0.4647893653965084
Energy: 0.3800667600769825
Energy: 0.9113104375562986
Energy: 0.49923508140236733
Energy: 0.4638732558520651
Energy: 0.49923508140236733
Energy: 0.8507035320874196
Energy: 0.5003089530706888
Energy: 0.6217607642601679
Energy: 0.5003089530712128
Energy: 0.9142026058877808
Energy: 0.4970490638843291
Energy: 0.6118400885724201
Energy: 0.49704906381415775
Energy: 0.7937939332622238
Energy: 0.6478260417693421
Energy: 0.612086412261776
Energy: 0.6478260417693421
Energy: 0.67602026186017
Energy: 0.6572514868014555
Energy: 0.7412575192708638
Energy: 0.6572514868014555
Energy: 0.807640993714285
Energy: 0.685801194828443
Energy: 0.5860782101126346
Energy: 0.6858011948289433
Energy: 0.6777216094829226
Energy: 0.6825128695238099
Energy: 0.7365466098349815
Energy: 0.6825128695232859
Energy: 0.6774676419683815
Energy: 0.6910488257718685
Energy: 0.8524509232848487
Energy: 0.6910488257718685
Energy: 0.6213346432398792
Energy: 0.6506335029956882
Energy: 0.7594534933651547
Energy: 0.6506335029951642
Energy: 0.5035599168485794
Energy: 0.6531833405340073
Energy: 0.8523584544411346
Energy: 0.6531833405340073
Energy: 0.6140461514768729
Energy: 0.5308122759671888
Energy: 0.8518446989006013
Energy: 0.5308122759666648
Energy: 0.4733004964218744
Energy: 0.5006640532741311
Energy: 0.7602054614687677
Energy: 0.5006640532746551
Energy: 0.44081313515408044
Energy: 0.5006168155162476
Energy: 0.9692422526750376
Energy: 0.5006168155157236
Energy: 0.5171775467606056
Energy: 0.38038372924340347
Energy: 0.8739703501000579
Energy: 0.38038372924340347
Energy: 0.43869577771950236
Energy: 0.3817563265127636
Energy: 0.8762616648822603
Energy: 0.3817563265132876
Energy: 0.3782303675231053
Energy: 0.3784016679746341
Energy: 0.9880006283274322
Energy: 0.3784016679746341
Energy: 0.4371408987416035
Energy: 0.38217266950566003
Energy: 0.8106208837778693
Energy: 0.382172669505136
Energy: 0.5182719875583223
Energy: 0.3814459277255031
Energy: 0.9149197791316878
Energy: 0.3814459277338875
Energy: 0.43929592306701176
Energy: 0.49787962842266437
Energy: 0.9296274192455525
Energy: 0.49787962842266437
Energy: 0.4706720142801589
Energy: 0.5003699111925051
Energy: 0.8320737521789037
Energy: 0.5003699112014135
Energy: 0.6134809068668621
Energy: 0.5413420670298863
Energy: 0.8072523966965323
Energy: 0.5413420670298863
Energy: 0.5871608603622939
Energy: 0.6489312224696575
Energy: 0.8619330188344504
Energy: 0.6489312224691336
Energy: 0.6196237093077566
Energy: 0.6506039293786963
Energy: 0.6694748198357622
Energy: 0.6506039293786963
Energy: 0.7367440429519853
Energy: 0.6807748736490732
Energy: 0.8528789024189277
Energy: 0.6807748736490732
Energy: 0.5927295699326235
Energy: 0.683359023758375
Energy: 0.7375117524235688
Energy: 0.683359023758899
Energy: 0.8668027641162759
Energy: 0.6655544110851006
Energy: 0.6700076930229089
Energy: 0.6655544110856245
Energy: 0.7443459627011578
Energy: 0.6572703672295037
Energy: 0.7383959930892608
Energy: 0.6572703672300276
Energy: 0.7427950538871443
Energy: 0.6560497007128046
Energy: 0.6134924097648805
Energy: 0.6560497007122806
Energy: 0.929035904954538
Energy: 0.5300858005460941
Energy: 0.5039694435933809
Energy: 0.5300858005471422
Energy: 0.760693796807636
Energy: 0.5003396974423051
Energy: 0.6216572103679029
Energy: 0.5003396974412571
Energy: 0.8517693709900864
Energy: 0.4997392641571635
Energy: 0.46308825972533796
Energy: 0.4997392641854608
Energy: 0.9759299228781556
Energy: 0.3786536256759661
Energy: 0.4636115684706827
Energy: 0.3786536256759661
Energy: 0.9444105604529537
Energy: 0.47913896070939455
Energy: 0.47167036381626015
Energy: 0.479138960219648
Energy: 0.9725144191194491
Energy: 0.3785773164979911
Energy: 0.381091927793976
Energy: 0.3785773164979911
Energy: 0.9100243870296258
Energy: 0.3791587352948029
Energy: 0.3820047390944559
Energy: 0.37915873529427885

minimum gb energy = 0.3782303675231053 eV
minimum distance =  2.61581570621328 Angstroms
sigma value = 85


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

Energy: 0.9053773365789216
Energy: 0.34321922205675615
Energy: 0.34282204469157823
Energy: 0.3432192187477716
Energy: 0.9725639165132792
Energy: 0.3435996309029263
Energy: 0.41855939685639415
Energy: 0.3435996309033808
Energy: 0.8234198362699758
Energy: 0.4492928193687194
Energy: 0.4191388562015293
Energy: 0.4492928193678104
Energy: 0.7460144190829852
Energy: 0.4486012735964169
Energy: 0.5482404779335834
Energy: 0.44860127360687
Energy: 0.9217408483070193
Energy: 0.45042467733103403
Energy: 0.5481145781875483
Energy: 0.4504246773314885
Energy: 0.7193187355603661
Energy: 0.5902278893664357
Energy: 0.55008030609097
Energy: 0.5902278893664357
Energy: 0.7218887148560272
Energy: 0.5913754071344445
Energy: 0.6596626736687897
Energy: 0.5913754071344445
Energy: 0.8686796883318525
Energy: 0.6179070714887216
Energy: 0.5212979763127302
Energy: 0.6179070714891761
Energy: 0.7218987924713478
Energy: 0.6277756331906753
Energy: 0.6657697114295115
Energy: 0.6277756331906753
Energy: 0.7160308501127975
Energy: 0.6317721913957959
Energy: 0.7630860605210426
Energy: 0.6317721913957959
Energy: 0.6644236634213622
Energy: 0.6227996531479962
Energy: 0.6700339278522258
Energy: 0.6227996531475418
Energy: 0.6021709535834272
Energy: 0.6236097381171014
Energy: 0.764099000499401
Energy: 0.6236097381166469
Energy: 0.6585489935874248
Energy: 0.6260756198268255
Energy: 0.7617917440050627
Energy: 0.6260756198268255
Energy: 0.5481848036389728
Energy: 0.5844143412001808
Energy: 0.6702739489836081
Energy: 0.5844143412001808
Energy: 0.4493081387164964
Energy: 0.583557304271401
Energy: 0.868535342232776
Energy: 0.5835573042718555
Energy: 0.5539092904815958
Energy: 0.44966025496646045
Energy: 0.7766493619610167
Energy: 0.44966025496646045
Energy: 0.4170253286442196
Energy: 0.4492447158558298
Energy: 0.7786235332369325
Energy: 0.44924471579449493
Energy: 0.39648862895851283
Energy: 0.3965555075817983
Energy: 0.9730930237117988
Energy: 0.39655550758134384
Energy: 0.41634065652308555
Energy: 0.3426643382080835
Energy: 0.888248116625563
Energy: 0.3426643382126284
Energy: 0.34275355092085813
Energy: 0.34379150277781034
Energy: 0.8753265474212726
Energy: 0.34379150278099174
Energy: 0.34333957217861366
Energy: 0.34307722048750344
Energy: 0.9722000213193981
Energy: 0.3430772204879579
Energy: 0.34306893743534866
Energy: 0.3431278347971261
Energy: 0.8731735073521113
Energy: 0.34312783482394077
Energy: 0.4168680005776587
Energy: 0.34497038457977125
Energy: 0.9206394630513084
Energy: 0.3449703845802257
Energy: 0.3981591264983562
Energy: 0.4486224091978967
Energy: 0.976269987609131
Energy: 0.44862240920789537
Energy: 0.4169562976848856
Energy: 0.44935354836951086
Energy: 0.744986140086823
Energy: 0.4493535483699653
Energy: 0.548819430275871
Energy: 0.47940940665823345
Energy: 0.918546832731994
Energy: 0.47940940665823345
Energy: 0.5480906015432722
Energy: 0.5838978247841248
Energy: 0.814372433497355
Energy: 0.5838978247841248
Energy: 0.6600604760964949
Energy: 0.5913578290783008
Energy: 0.7465887748837394
Energy: 0.5913578290783008
Energy: 0.6646694422388916
Energy: 0.6164301689884838
Energy: 0.8673059485694417
Energy: 0.6164301689884838
Energy: 0.6639426357891006
Energy: 0.6264613258644309
Energy: 0.7206514635168086
Energy: 0.6264613258644309
Energy: 0.7664656230045032
Energy: 0.6273319680006323
Energy: 0.594686838263277
Energy: 0.6273319680006323
Energy: 0.6717051184377066
Energy: 0.627508157499662
Energy: 0.7626103908742962
Energy: 0.627508157499662
Energy: 0.7623012732517577
Energy: 0.6264928907012901
Energy: 0.6057664012558135
Energy: 0.6264928907012901
Energy: 0.8673064897216851
Energy: 0.623853891966034
Energy: 0.6057837074023027
Energy: 0.623853891966034
Energy: 0.6685026401608389
Energy: 0.5914081929763191
Energy: 0.6587587789274494
Energy: 0.5914081929763191
Energy: 0.8663601606332038
Energy: 0.5896748708201214
Energy: 0.5304952102949545
Energy: 0.5896748708205759
Energy: 0.8664047367310761
Energy: 0.4815993785255056
Energy: 0.5504217481358142
Energy: 0.4815993785255056
Energy: 0.8267644979212639
Energy: 0.44847676995675967
Energy: 0.4167977501047239
Energy: 0.44847676969373657
Energy: 0.9697463140243473
Energy: 0.45012269319221454
Energy: 0.39767199428399636
Energy: 0.45012269319221454
Energy: 0.8678713755305232
Energy: 0.34529793252593877
Energy: 0.41681800295811505
Energy: 0.3452979325254843
Energy: 0.7925407415690665
Energy: 0.3440507791906691
Energy: 0.3428093351884477
Energy: 0.3440507791856698
Energy: 0.974351603904356
Energy: 0.34289097010445635
Energy: 0.34317215640760984
Energy: 0.34289097010445635
Energy: 0.8344079199303702
Energy: 0.3429091101949
Energy: 0.34268788892099716
Energy: 0.3429091101940117

minimum gb energy = 0.3426643382080835 eV
minimum distance =  2.61248843057903 Angstroms
sigma value = 113


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

Energy: 0.009797881719183024
Energy: 0.3753441230385247
Energy: 0.7577673480123132
Energy: 0.37534412304161097
Energy: 0.4552339886123434
Energy: 0.07718050688106953
Energy: 0.45609639609009683
Energy: 0.07718050688106953
Energy: 0.010268921868666764
Energy: 0.07671244562799188
Energy: 0.45549411368766685
Energy: 0.07671244562799188
Energy: 0.010964531040892974
Energy: 0.0776299755761429
Energy: 0.4553445632975293
Energy: 0.0776299755761429
Energy: 0.4569623967038787
Energy: 0.07814698755631068
Energy: 0.4572130227082118
Energy: 0.07814698755631068
Energy: 0.010139025831168644
Energy: 0.0765683207162926
Energy: 0.45509768009275686
Energy: 0.07656832071561323

minimum gb energy = 0.009797881719183024 eV
minimum distance =  2.84423331095715 Angstroms
sigma value = 1