Model name: model_name=EAM_Dynamo_FarkasCaro_2020_FeNiCrCoAl__MO_820335782779_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.52000077366829
cohesive_energy=4.450350029951057
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[6.53213822388336e-20, 1.42254058979592e-19, 2.41100346414222e-19, 3.3853671841093195e-19, 4.1388868768458594e-19, 4.67882040250386e-19, 5.07933251747118e-19, 5.40064904141988e-19, 5.66620981850538e-19, 5.88830354351046e-19, 6.075726166155779e-19, 6.2375940714888e-19, 6.38198222974488e-19, 6.51454632444204e-19, 6.63626368332702e-19, 6.7456442821302e-19, 6.841294227179999e-19, 6.92273286548622e-19, 6.990280632375659e-19, 7.043985593147339e-19, 7.083815704268579e-19, 7.11044387992566e-19, 7.1251678831921205e-19, 7.1296860213e-19, 7.125087774360419e-19, 7.110331727561279e-19, 7.084152161361718e-19, 7.04440215907218e-19, 6.987060257341319e-19, 6.90715970860374e-19, 6.798436002220499e-19, 6.653086537984019e-19, 6.46321258508868e-19, 6.22179660987756e-19, 5.92335916826238e-19, 5.5644395587137e-19, 5.14446099764328e-19, 4.66276659263118e-19, 4.11680888282934e-19, 3.5014929465416396e-19, 2.81425530115368e-19, 2.11176493421004e-19, 1.515617439171516e-19, 1.238447290196052e-19, 1.8258565138727398e-19, 4.659225782270039e-19, 1.3311364128262197e-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: 0.022172641801434242
Energy: 4.399034655205442
Energy: 0.6342440838832598
Energy: 1.390834677621114
Energy: 1.3950525095374364
Energy: 0.4806179452458907
Energy: 0.022654945382134316
Energy: 0.14395869865405236
Energy: 1.985124537723457
Energy: 0.4062414002739879
Energy: 0.6337529825257072
Energy: 1.7757897392188757
Energy: 0.023656491408203854
Energy: 0.1469196929193726
Energy: 0.022869357667475027
Energy: 2.186579906711766
Energy: 0.9015582037985413
Energy: 0.6346133948102523
Energy: 1.7813056302115973
Energy: 0.14598721244802693
Energy: 0.14634174370418349
Energy: 0.025292987957166634
Energy: 3.3289853078288156
Energy: 0.6330782620598184
Energy: 1.3895603038208875
Energy: 1.389503569429087
Energy: 0.14447741414882312
Energy: 0.023004299329682162
Energy: 0.47845139975089757
Energy: 2.074755374061664
Energy: 0.40626194317292286
Energy: 0.8989469156575083
Energy: 1.7515049585904547
Energy: 0.02332880809529396
Energy: 0.147375550099985
Energy: 0.022536653266815747
Energy: 2.217042366079996
Energy: 0.8997595971862525
Energy: 0.6342310611287636
Energy: 1.1440246706421942
Energy: 0.14562074476477624
Energy: 0.1460432027330239

minimum gb energy = 0.022172641801434242 eV
minimum distance =  2.46303423235546 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.7776127280723368
Energy: 2.332822212259375
Energy: 1.8701241203388363
Energy: 2.1680341960837217
Energy: 1.9577244090526082
Energy: 2.0431889107586674
Energy: 2.1691527314375887
Energy: 1.6100832402088907
Energy: 1.8937207179867084
Energy: 1.5915889845106612
Energy: 1.729236815700911
Energy: 1.6988111512213748
Energy: 1.6114494150979823
Energy: 1.7714643891369017
Energy: 2.1920269907361267
Energy: 2.035493029085473
Energy: 2.2503735787855277
Energy: 2.097606998278678
Energy: 2.2813350211515173
Energy: 2.2267179212614496
Energy: 1.8676260391856878
Energy: 1.5879467280525483
Energy: 2.074683860769354
Energy: 1.622612971024385
Energy: 1.745572607843407
Energy: 1.8016156163286365
Energy: 1.5922569457672147
Energy: 2.084645014122609
Energy: 1.8261609260878162
Energy: 2.110699544795355
Energy: 1.7428655563609232
Energy: 1.6661034837518767
Energy: 1.8473847593152897
Energy: 1.9482100647033544
Energy: 1.7462132825289594
Energy: 1.7423229240493718
Energy: 1.7165559213785775
Energy: 1.7147706796380937
Energy: 1.6986462346506876
Energy: 1.7027834103116137
Energy: 1.956997482705061
Energy: 1.7434096676655402
Energy: 2.2872375273721404
Energy: 1.833442936197551
Energy: 2.064896179586503
Energy: 2.0333148191
Energy: 2.1390836840470637
Energy: 1.991729529240827
Energy: 1.78838436816066
Energy: 1.6327507469098261
Energy: 2.024215889397412
Energy: 2.1878616842132375
Energy: 1.9650648241991144
Energy: 1.9784833874595633
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Energy: 1.9654891497376097
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Energy: 2.004232504591954
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Energy: 2.0012344318142183
Energy: 1.9597827255979565
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Energy: 1.9559098063231137
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Energy: 2.004099931532358
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Energy: 1.8599846777826787
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Energy: 1.665588247733246
Energy: 1.9152354250723074
Energy: 1.8536794671978483
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Energy: 1.9051967915664705
Energy: 2.028557783913391
Energy: 2.02953946896876
Energy: 1.8902420127883017
Energy: 2.09908259523324
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Energy: 2.0344703723194484
Energy: 1.8684746220548234
Energy: 1.9376840643187139
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Energy: 1.5933280860467083
Energy: 2.122976962314205
Energy: 1.7426273023636494
Energy: 1.9767556050916624
Energy: 1.7389093536159028
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Energy: 1.814390842899022
Energy: 1.6965067046837643
Energy: 1.8004582185279936
Energy: 1.736647865619373
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Energy: 1.6649046205141673
Energy: 1.8637842393990494
Energy: 1.7431390832814693
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Energy: 2.0211706243691245
Energy: 1.8693117885939747
Energy: 1.930065241951675
Energy: 1.9413434358072656
Energy: 1.9841086736474698
Energy: 1.6724156382782354
Energy: 1.9934475268493772
Energy: 1.7065747051571902
Energy: 1.7526541386501755
Energy: 1.8568019595721261
Energy: 2.0136555053774665
Energy: 1.9381690465424104
Energy: 2.228595170995258
Energy: 1.7910924955606946
Energy: 1.9486862457184286
Energy: 2.0520199623402195
Energy: 2.2265170082076056
Energy: 2.1488910061135753
Energy: 1.7487882761476705
Energy: 1.7469812791356294
Energy: 1.8769656171667046
Energy: 1.747569560650249
Energy: 1.800569737913032
Energy: 1.7304239986773358
Energy: 1.9167256954157794
Energy: 1.6763162885390395
Energy: 1.8390303902531355
Energy: 2.367370871134563
Energy: 1.879249844024293
Energy: 1.8565772756944177
Energy: 1.872061380927983
Energy: 1.8681498091279793
Energy: 1.6988042139029957
Energy: 1.5925181088228693
Energy: 1.651149017890625
Energy: 2.1161282320550074
Energy: 1.8116790034060652
Energy: 1.8738133605284704
Energy: 2.2242645094330378
Energy: 2.0072841150278773
Energy: 2.2096768788971604
Energy: 2.016903691630332
Energy: 2.282127227666584
Energy: 2.0906396332348955
Energy: 2.504276126289393
Energy: 2.1709074002293804
Energy: 2.0854944248339624
Energy: 1.6476778945407
Energy: 1.9677341164167688
Energy: 1.723057093764834
Energy: 1.6207770617980817
Energy: 1.6174395928043583
Energy: 1.589281918833983
Energy: 1.901630930307655
Energy: 1.7592185144415753
Energy: 1.6755486659530712
Energy: 1.7867140066915952
Energy: 1.9528211033097342
Energy: 1.9247448913139036
Energy: 1.7642840789941576
Energy: 1.7072067290543773

minimum gb energy = 1.5879467280525483 eV
minimum distance =  2.24078231036183 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.7427219121094175
Energy: 2.176920710965243
Energy: 1.7268153280901857
Energy: 1.710743204848225
Energy: 2.2214334103132565
Energy: 1.8703147791876562
Energy: 1.7411667464572937
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Energy: 1.7085705486962106
Energy: 2.007543935968323
Energy: 1.8490005335815993
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Energy: 1.6791909752366991
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Energy: 1.840657184412708
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Energy: 1.6133826859210982
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Energy: 1.98637190380853
Energy: 2.0323609730589793
Energy: 1.702250746557696
Energy: 1.630566800849895
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Energy: 1.8727655085187795
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Energy: 1.7952005236761002
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Energy: 1.9131806830105178
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Energy: 1.7799981755296153
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Energy: 1.7538518559969571
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Energy: 1.8477339107811421
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Energy: 1.6600241483771958
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Energy: 1.6189699465000846
Energy: 1.8811228649601146
Energy: 1.6766894146461682
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Energy: 1.7592604240759948
Energy: 1.7345905076445314
Energy: 1.6475855158342967
Energy: 1.7100106519127767
Energy: 1.973055176979431
Energy: 1.8126449126073114
Energy: 1.9453794835586018
Energy: 1.8948124722397277
Energy: 2.0198394037085747
Energy: 2.214970747112531
Energy: 1.949643062827111
Energy: 1.6623352982684552
Energy: 1.8324498347051486
Energy: 1.9529213480131453
Energy: 2.498147645229997
Energy: 2.0196879260516925
Energy: 2.02018617833688
Energy: 1.667633212483405
Energy: 1.7369067255789752
Energy: 1.7875056774092528
Energy: 1.6498037679152113
Energy: 1.7158414162472955
Energy: 1.866552524614528
Energy: 1.8843143735433272
Energy: 1.727687556245232
Energy: 1.6642548463619256
Energy: 1.71155364745588
Energy: 1.838960460682464
Energy: 1.7180933462561554
Energy: 1.6319426989480181
Energy: 1.6618570813045177
Energy: 1.6745286526522103
Energy: 1.6580333687401683
Energy: 1.6634305318458793
Energy: 1.7098926463419362
Energy: 1.6990635974280044
Energy: 1.9067923227459878
Energy: 1.9214807388266713
Energy: 1.6750493040940253
Energy: 1.7364613975692513
Energy: 1.6985617023166533
Energy: 1.6704124031748178
Energy: 2.0828448760004843
Energy: 1.7513044326809482
Energy: 1.6422281761992512
Energy: 1.7259255730539267
Energy: 2.0203739038140442
Energy: 1.7948851510208241
Energy: 2.041740550468566
Energy: 2.2831948996162486
Energy: 1.739454048031411
Energy: 1.7832303903514535
Energy: 1.7739216036335224
Energy: 1.7874653285969841
Energy: 1.757271889370584
Energy: 1.8411441526962604
Energy: 1.7223870004356747
Energy: 1.680513768701302
Energy: 1.7903353485448517
Energy: 1.896550546357752
Energy: 1.8880649939911054
Energy: 1.752687801651113
Energy: 1.713374858223323
Energy: 1.7243405319924112
Energy: 1.7373831673337408
Energy: 1.9896341771174397
Energy: 2.5056163222148187
Energy: 1.72988576277776
Energy: 1.7337208753780076
Energy: 1.6462421009551707
Energy: 1.6593837543878307
Energy: 1.6628939216196923
Energy: 1.6407848853790112
Energy: 1.8366867718930007
Energy: 1.993000675433123
Energy: 1.697446006778871
Energy: 1.8775520990050523
Energy: 1.9292110925310975
Energy: 1.6130398882070962
Energy: 2.0509422692674417
Energy: 1.7562113783895414
Energy: 1.6619262421347034
Energy: 1.819200296916475
Energy: 1.9409284429410836
Energy: 2.000218537237745
Energy: 1.7398074864868802
Energy: 2.0112788689673833
Energy: 1.8021670012527857
Energy: 1.8497464557346721
Energy: 1.796602593991285
Energy: 1.6486395559158784
Energy: 1.6924209819711222
Energy: 2.045074538336191
Energy: 2.2241293841980236
Energy: 1.7488206967864466
Energy: 1.6630828405831155
Energy: 1.6475427698342247
Energy: 1.7574121761916714
Energy: 1.7169727380408293
Energy: 1.6494363273228043
Energy: 1.7022947398906743
Energy: 1.667936832612988

minimum gb energy = 1.6007927384953977 eV
minimum distance =  2.25095399762394 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.8221525242063776
Energy: 1.8685924743543614
Energy: 1.812595937553337
Energy: 1.6702473746997728
Energy: 1.7464870060384108
Energy: 1.733050446834724
Energy: 1.7498845711093964
Energy: 1.9167393401797825
Energy: 1.6919920723891126
Energy: 1.9048583147275584
Energy: 1.861899017388993
Energy: 1.7343666354736198
Energy: 1.8922531162097782
Energy: 1.7413363151514976
Energy: 1.9565310793208601
Energy: 1.7088848681401376
Energy: 2.0020078500208696
Energy: 1.8526282399421319
Energy: 1.9823175271224933
Energy: 1.817815703154444
Energy: 1.8146385539578007
Energy: 1.6633446127471458
Energy: 1.9938446293608187
Energy: 1.6733544253813453
Energy: 1.930160236359809
Energy: 1.8494425876031972
Energy: 1.6730384934999176
Energy: 1.9373619369462318
Energy: 2.1705547274617465
Energy: 1.9459683731765554
Energy: 1.8286017923423128
Energy: 1.8934036948799002
Energy: 1.8024242594955842
Energy: 1.984740748131371
Energy: 1.7737611425353608
Energy: 1.6871664402209934
Energy: 1.6655049754916982
Energy: 1.72403063957112
Energy: 1.6789385880500762
Energy: 1.6822787716551275
Energy: 1.7509735491518579
Energy: 1.7340850974275124
Energy: 1.7032769257898204
Energy: 1.7488485064809667
Energy: 1.7263268979485515
Energy: 1.6601395542307196
Energy: 1.9163246221435974
Energy: 1.7793140848373068
Energy: 1.7574392004427204
Energy: 1.8793764937673176
Energy: 1.9308509301143235
Energy: 1.895562695288552
Energy: 1.9874371524184444
Energy: 1.8506147218709523
Energy: 1.8806579605462077
Energy: 1.7098083970097626
Energy: 1.900137722803064
Energy: 1.8384438161999788
Energy: 2.1843675081627603
Energy: 1.7068825904658662
Energy: 1.9932521131214431
Energy: 1.8054265348382914
Energy: 1.7915625966843558
Energy: 1.71304595412598
Energy: 1.8624208326457494
Energy: 1.6506910913275885
Energy: 1.8310623136968387
Energy: 1.832691384050708
Energy: 1.6613771861924183
Energy: 1.7691349892179176
Energy: 1.7840607878658115
Energy: 1.9455254087093194
Energy: 1.833921046309985
Energy: 1.869437848963974
Energy: 1.765422069363226
Energy: 2.0386162678312414
Energy: 1.7088429569268837
Energy: 1.7162112331687411
Energy: 1.6792877597351354
Energy: 1.675363724597207
Energy: 1.6366076531958356
Energy: 1.7003023684974372
Energy: 1.9191468601239836
Energy: 1.6780447073088094
Energy: 1.7577934987404034
Energy: 1.7277273997815845
Energy: 1.7832788481169148
Energy: 1.8769003833702038
Energy: 1.984445949930954
Energy: 1.7110378610846502
Energy: 1.72045213495356
Energy: 1.9911704788884974
Energy: 1.712307987756893
Energy: 1.869175891028114
Energy: 1.8527465103504712
Energy: 1.9054938406791655
Energy: 1.9834636526840002
Energy: 1.795502605291483
Energy: 1.8687222920142366
Energy: 1.7954241914599345
Energy: 1.8959004930388244
Energy: 1.8750865021440617
Energy: 2.2351330305503945
Energy: 2.142913282587137
Energy: 1.7059433724959512
Energy: 1.659585767087354
Energy: 1.9109532492755512
Energy: 1.7246016630872698
Energy: 2.005292327984292
Energy: 1.852354464638687
Energy: 1.7534503081912585
Energy: 1.77501540958599
Energy: 1.773818829874347
Energy: 2.1914746179208673
Energy: 1.8803376203483173
Energy: 2.033496842394913
Energy: 1.7006853510977944
Energy: 2.0227119039020276
Energy: 1.7852080203551253
Energy: 1.6574567065511847
Energy: 1.8404856913879937
Energy: 1.6390882466443004
Energy: 1.668556746561312
Energy: 1.6780149772480184
Energy: 1.6481802555158465
Energy: 1.6880852467450858
Energy: 1.81863735638216
Energy: 1.7242680299969462
Energy: 1.7726357505159658
Energy: 1.6597794633415766
Energy: 2.0383943563988685
Energy: 1.6803054249027236
Energy: 1.7572541594941626
Energy: 1.8293772263865866
Energy: 1.7373990567430273
Energy: 1.8731919885601698
Energy: 1.9103795527123821
Energy: 1.9159544867659897
Energy: 1.9159893620790833
Energy: 1.9614317983156042
Energy: 1.9733822041193962
Energy: 1.7130583570754705
Energy: 1.8599355924100345
Energy: 1.9496006595137498
Energy: 2.0592829618097905
Energy: 1.9266498274433757
Energy: 1.900668360783629
Energy: 1.6321160151301726
Energy: 1.7762306868774802
Energy: 1.6965936966000317
Energy: 1.81799943686532
Energy: 1.8109891743279574
Energy: 1.7330842548452723
Energy: 1.8910788231539917
Energy: 1.7274806447849311
Energy: 1.9605256439394316
Energy: 1.754308702200572
Energy: 2.0627727886830436
Energy: 1.6913386429166042
Energy: 1.901549796552808
Energy: 1.7499274935012714
Energy: 1.780622442513571
Energy: 1.9783453100247514
Energy: 1.7679242954602092
Energy: 1.6721895568048077
Energy: 1.6773577745109194
Energy: 1.6587037196906607
Energy: 1.7442757580851622
Energy: 1.7650374984616162
Energy: 1.7799858013248009
Energy: 1.9245005578498087
Energy: 1.7160681302951748
Energy: 1.9950284994347909
Energy: 1.744842572652434
Energy: 1.7628883881882975
Energy: 1.943990816351699
Energy: 1.9642092238982123
Energy: 1.9374986247877277
Energy: 2.007975999757805
Energy: 1.8496035171450937
Energy: 2.034390047497882
Energy: 1.7465455561002217
Energy: 1.872406494492315
Energy: 1.7264598511990867
Energy: 1.9577263223139856
Energy: 1.9980722931696009
Energy: 2.1340467932958
Energy: 1.7557854195729106
Energy: 1.772956516418051
Energy: 1.8031881628035924
Energy: 1.7062266502740495
Energy: 1.7494193917159209
Energy: 1.972641117118274
Energy: 1.8178149979284464
Energy: 1.6268996625316496
Energy: 1.779554850765173
Energy: 1.7037393901412403
Energy: 1.92454939400086
Energy: 1.7547130039762262
Energy: 1.8992225249806185
Energy: 1.7242359498005926
Energy: 1.9175644428986447
Energy: 1.9363364386262152
Energy: 1.7457522346565713
Energy: 1.8517024146860586
Energy: 1.732819078755819
Energy: 1.7585144205769285
Energy: 1.695658066514512
Energy: 1.6641069134847049
Energy: 1.736021573000445
Energy: 1.7479386913235768
Energy: 1.7258670610717735
Energy: 2.1570827137631587
Energy: 1.8012797266626661
Energy: 1.999283152855464
Energy: 1.7813168486801967
Energy: 1.7939379631975672
Energy: 2.0511442592373963
Energy: 1.7047760058459243
Energy: 1.9036850563592804
Energy: 1.9195827914605754
Energy: 1.8837477180768163
Energy: 2.0837475195762565
Energy: 1.7318820402627961
Energy: 1.7754383866762278
Energy: 1.7252618027086954
Energy: 1.7231370477365369
Energy: 1.8156679821555672
Energy: 2.098640669096702
Energy: 1.6982141651768947
Energy: 1.7996509891189671
Energy: 1.7299309623328192
Energy: 1.6704170281080772
Energy: 1.8353763030614547
Energy: 1.9191144297586535
Energy: 1.82171230129132
Energy: 1.7475206355006243
Energy: 1.7443850948232056
Energy: 1.9736948849132159
Energy: 1.9775090037098715
Energy: 1.7124919669161056
Energy: 1.9611897977856756
Energy: 1.6943076577681644
Energy: 1.9425594442525875
Energy: 1.8353465922039562
Energy: 1.7523186288589858
Energy: 1.912323666823584
Energy: 1.7633984078283231
Energy: 1.8292454557016735
Energy: 1.8670231780093363
Energy: 1.7292415147477023
Energy: 1.704717120248018

minimum gb energy = 1.6268996625316496 eV
minimum distance =  2.2655380346519 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 1.5875450378554805
Energy: 1.6941784222862688
Energy: 2.182910661398646
Energy: 1.9099283619643403
Energy: 1.7222025702672683
Energy: 1.7220866473485963
Energy: 1.5564801440687794
Energy: 1.639877486128668
Energy: 1.7172600584761826
Energy: 1.8725598028502723
Energy: 1.674058500163959
Energy: 1.826698991447
Energy: 1.791290501293574
Energy: 1.7811614102582267
Energy: 1.6399917497934384
Energy: 1.621788780398725
Energy: 1.863017470945593
Energy: 1.6554215244909265
Energy: 1.6391853448615183
Energy: 1.7916000092276791
Energy: 1.7451118415574411
Energy: 1.635675413921977
Energy: 1.6225580848676344
Energy: 1.7258982953077413
Energy: 1.646884315501845
Energy: 1.8674952228039925
Energy: 1.7289420735855174
Energy: 1.9187964957129255
Energy: 1.8205616522145418
Energy: 1.6364710237011009
Energy: 1.7490615192881116
Energy: 1.6701624098169172
Energy: 1.9106358385927522
Energy: 1.7324672771659893
Energy: 1.6527345121139578
Energy: 1.5493524816101634
Energy: 1.638874091030863
Energy: 1.817557647309202
Energy: 1.746153198321299
Energy: 1.7342440576956357
Energy: 1.6423597804691406
Energy: 1.6438024019586894
Energy: 1.6756096936086617
Energy: 2.1723702517479095
Energy: 1.811045059755114
Energy: 1.9082642361287216
Energy: 1.550664320828876
Energy: 1.5596305520987215
Energy: 1.6252278711077626
Energy: 1.5488879599181615
Energy: 1.7394941742690038
Energy: 1.9242738749394324
Energy: 1.649813709542171
Energy: 1.7730883500895516
Energy: 1.740743679122464
Energy: 1.6591552352163539
Energy: 1.5491858532042484
Energy: 1.738791523951886
Energy: 1.7647287221408818
Energy: 1.6446965649938727
Energy: 1.8464332654310593
Energy: 1.7406207761228834
Energy: 1.6588580065593865
Energy: 2.1601876089317757
Energy: 1.7206199468600367
Energy: 1.8943994953407037
Energy: 1.8607586909504579
Energy: 1.8306472607224835
Energy: 1.795291705023614
Energy: 1.6572759016371825
Energy: 1.6393020857775724
Energy: 1.6197513796084637
Energy: 1.724465290825812
Energy: 1.7036299854967676
Energy: 1.852280633360844
Energy: 1.831010586991221
Energy: 1.7437714631348282
Energy: 1.8248971816771327
Energy: 1.6369827597287367
Energy: 1.701525741319606
Energy: 1.6446211671326982
Energy: 1.8889090019171018
Energy: 1.7210855551051938
Energy: 1.8386394138630542
Energy: 1.551960109925256
Energy: 1.639162698353156
Energy: 1.877309180612464
Energy: 1.6617724862213452
Energy: 1.7542793439493929
Energy: 1.7523928219045566
Energy: 1.7901034864881689
Energy: 2.093442532084277
Energy: 1.6246923660297248
Energy: 1.6806038532263807
Energy: 1.693242595146033
Energy: 1.550142003621978
Energy: 1.5495142494280563
Energy: 1.6413605858973022
Energy: 1.549023267552114
Energy: 1.7056119192922647
Energy: 1.6520323828263286
Energy: 1.6742067857438987
Energy: 1.5507303247259425
Energy: 1.5491919352112482
Energy: 1.6605163288266003
Energy: 1.587654652271792
Energy: 1.6545269652736072
Energy: 1.8962990769290322
Energy: 1.663754450559402
Energy: 1.877397259550769
Energy: 1.7227830011659537
Energy: 1.55515085299387
Energy: 1.6394158482224575
Energy: 1.7173050366451472
Energy: 1.872326363376276
Energy: 1.6743873558769227
Energy: 1.7948887514101648
Energy: 1.6445353006353682
Energy: 1.6612101794031597
Energy: 1.6408946859283298
Energy: 1.6279005495884815
Energy: 1.8841995233838011
Energy: 1.6552442447790965
Energy: 1.6394682992316536
Energy: 1.7918126009754176
Energy: 1.7580412970267867
Energy: 1.635406123377094
Energy: 1.6224618521077587
Energy: 1.7280799234778328
Energy: 1.6447458251088334
Energy: 1.8712170817909548
Energy: 1.7279996231557258
Energy: 1.9106886040313782
Energy: 1.8293052423321263
Energy: 1.636386429048134
Energy: 1.7509997371228923
Energy: 1.6680775749182524
Energy: 1.8891842923433153
Energy: 1.737709430423992
Energy: 1.8112094176824263
Energy: 1.5489257339451212
Energy: 1.6392185607071872
Energy: 1.8176184514716238
Energy: 1.6875034157966347
Energy: 1.736060062848504
Energy: 1.5498029781414526
Energy: 1.657400680395821
Energy: 1.6751424126197312
Energy: 1.7163939721189134
Energy: 1.8112085383378396
Energy: 2.0466250982732523
Energy: 1.5508067635027065
Energy: 1.5596299857011025
Energy: 1.6248800556041372
Energy: 1.5486379396435266
Energy: 1.7398678090541884
Energy: 1.924892321915966
Energy: 1.64856371259515
Energy: 1.7730659617972493
Energy: 1.7404698944648884
Energy: 1.676769660278538
Energy: 1.5493343282139218
Energy: 1.7291772014182005
Energy: 2.0456805757471597
Energy: 1.644168118325002
Energy: 1.8300121483165104
Energy: 1.7394919928043437
Energy: 1.659905219848566
Energy: 1.6746234452670574
Energy: 1.7130521001402101
Energy: 1.8944461769548768
Energy: 1.8611487901852848
Energy: 1.834878408852243
Energy: 1.7952143754097252
Energy: 1.6394779944402775
Energy: 1.6389315205544064
Energy: 1.6187420692774555
Energy: 1.736633380106533
Energy: 1.7060915063627773
Energy: 1.8550371415009748
Energy: 1.9106110834013574
Energy: 1.7476570601986137
Energy: 1.7015186598336762
Energy: 1.6359945162108949
Energy: 1.7002142912069818
Energy: 1.6442199847153247
Energy: 1.6764674738877288
Energy: 1.723713777525086
Energy: 1.839691091167373
Energy: 1.551999867789891
Energy: 1.6391209428336047
Energy: 1.8763710679038366
Energy: 1.6639144839051867
Energy: 1.7430479225147166
Energy: 1.7247474669435758
Energy: 1.6435631745806063
Energy: 1.676941276310199
Energy: 1.6236502121474832
Energy: 1.8191453045377608
Energy: 1.6931396976118527
Energy: 1.5501849758377426
Energy: 1.5492769032765417
Energy: 1.6430550217656954
Energy: 1.548939747198595
Energy: 1.7055739746539484
Energy: 1.651564227366012
Energy: 1.6234002852952505
Energy: 1.5501599831660617
Energy: 1.5493117823299036
Energy: 1.660583791710671

minimum gb energy = 1.5486379396435266 eV
minimum distance =  2.30908968899936 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 2.1158406618194743
Energy: 2.30381825852819
Energy: 1.7482578429710391
Energy: 2.326375575048336
Energy: 1.7930746757317382
Energy: 1.7708681348353152
Energy: 2.111563634116579
Energy: 1.6600216445622045
Energy: 1.9121301733135085
Energy: 2.3270904219377426
Energy: 2.1186949411335556
Energy: 2.606858631597439
Energy: 2.2762801739351204
Energy: 1.6357339548948717
Energy: 1.7085466850560391
Energy: 1.5733574479055379
Energy: 2.199323058340043
Energy: 2.2591552870344467
Energy: 2.448889969643959
Energy: 2.4657849191040504
Energy: 1.641303511889662
Energy: 2.1185170263297195
Energy: 1.9222851134552097
Energy: 1.6972162817594134
Energy: 2.2243034663984944
Energy: 1.6368786294326485
Energy: 1.6242202114008133
Energy: 1.889631826334273
Energy: 1.5889748405632493
Energy: 1.8412726600208833
Energy: 1.668933892503951
Energy: 1.5790577621340427
Energy: 1.5830031709691945
Energy: 1.6434082268827221
Energy: 1.6274847091971631
Energy: 1.5548528009098888
Energy: 1.5659023810767083
Energy: 1.9038242291637437
Energy: 1.6058326273214563
Energy: 1.5543230117158795
Energy: 2.63876575975454
Energy: 1.6569667134705957
Energy: 2.348711620973011
Energy: 1.550822518927055
Energy: 1.6251720489251045
Energy: 1.6380554315843368
Energy: 1.5545288421815486
Energy: 1.5551603664986613
Energy: 1.6121188405293052
Energy: 1.7065994659640624
Energy: 1.5795161409993166
Energy: 2.178700566370902
Energy: 1.7224690859983287
Energy: 1.987119691233053
Energy: 2.025743295583016
Energy: 1.659447978141938
Energy: 1.6242233601079012
Energy: 1.6502369431570165
Energy: 2.448528045498006
Energy: 1.9678795212830738
Energy: 2.0467158722285177
Energy: 2.86527471618179
Energy: 1.8929739654122715
Energy: 2.2206847350666665
Energy: 2.127520731254452
Energy: 1.6518549214145724
Energy: 1.8137497197781336
Energy: 1.608007335805669
Energy: 1.8535100173761163
Energy: 2.2000235904057375
Energy: 2.0905923005764526
Energy: 1.7326870527882234
Energy: 1.652677144129936
Energy: 2.2893489815189803
Energy: 2.4878440494758998
Energy: 2.0730537648117306
Energy: 2.0067749784551503
Energy: 1.623976161883045
Energy: 2.0246042759751486
Energy: 1.9069804714347258
Energy: 2.110870397627611
Energy: 2.084955584655775
Energy: 2.1459573906147327
Energy: 2.161676932205156
Energy: 2.0716461129580526
Energy: 2.0272251407877975
Energy: 1.8528473807554449
Energy: 2.0631944191440894
Energy: 2.0182263105343083
Energy: 1.7097392289452065
Energy: 2.1115435185400737
Energy: 2.079203542498329
Energy: 1.7240074747638066
Energy: 1.8557036441771817
Energy: 2.3207102381767437
Energy: 1.7115759874143903
Energy: 1.6354432142506041
Energy: 2.152845550039766
Energy: 1.7043781109058354
Energy: 1.9507510530577352
Energy: 1.8959998444201738
Energy: 2.175477073612504
Energy: 2.282174876559879
Energy: 2.1226210489693274
Energy: 2.155889330460447
Energy: 1.974062497702586
Energy: 1.650033925618109
Energy: 1.6311070809713752
Energy: 2.2009728212485107
Energy: 1.6752224960674023
Energy: 2.060067959607183
Energy: 2.096869215259595
Energy: 1.5931853569441665
Energy: 1.8411840931060977
Energy: 1.6376759498226932
Energy: 1.680408053052488
Energy: 1.5947534841846123
Energy: 1.6239886480313663
Energy: 1.6463989534414074
Energy: 1.5552173946396832
Energy: 1.637572670065899
Energy: 1.6538632602393881
Energy: 1.7431239816132584
Energy: 2.1638813028611175
Energy: 1.9188198363289528
Energy: 1.5938523957085324
Energy: 2.0210126250693667
Energy: 1.6088372726977807
Energy: 2.486117583164707
Energy: 1.6818652707918615
Energy: 1.5544853821405535
Energy: 1.554746831737632
Energy: 1.6090697021448963
Energy: 2.2988521877923476
Energy: 1.5823047063529199
Energy: 1.9462639602093428
Energy: 1.8926339255916276
Energy: 1.8669203518447923
Energy: 2.1780722633501792
Energy: 1.6317881316500298
Energy: 1.6253007653375449
Energy: 1.6504486463978814
Energy: 2.0279288972536658
Energy: 2.0604150522263147
Energy: 2.4390656356951417
Energy: 2.453123680406043
Energy: 1.7974424628679495
Energy: 1.9037608931582184
Energy: 2.0985442194524473
Energy: 1.9858506395014346
Energy: 1.6856097297456207
Energy: 1.8318326184925655
Energy: 1.6668962201739383
Energy: 2.1551018794979475
Energy: 2.2387712230729586
Energy: 1.6939475694131627
Energy: 2.4571169223543974
Energy: 1.8113437516798552
Energy: 1.9784698582507187
Energy: 1.780960315623133
Energy: 1.595126856930334
Energy: 1.7680714198825163
Energy: 1.940239480601528
Energy: 1.8540189043108934
Energy: 2.3901204224390598
Energy: 2.0902726689957323
Energy: 2.082034803556372
Energy: 1.5844084841694381
Energy: 2.0708707948919955
Energy: 1.836592141998493
Energy: 2.7184485012714656
Energy: 1.6887563616080081
Energy: 1.9172659525442832
Energy: 1.8112448422987828
Energy: 2.241152038428309

minimum gb energy = 1.550822518927055 eV
minimum distance =  1.68905888738211 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 2.015147979825723
Energy: 2.5064329699700396
Energy: 2.1518061051773034
Energy: 2.221615012976033
Energy: 2.1497700518574727
Energy: 2.085139275517969
Energy: 2.4825515638411084
Energy: 2.4676377698990537
Energy: 2.0446576779411183
Energy: 2.2250593591798857
Energy: 2.5922174101815414
Energy: 2.3918307613369807
Energy: 2.264976658316061
Energy: 2.3230746026909896
Energy: 2.2877479692853924
Energy: 2.170151688270846
Energy: 2.030701505061216
Energy: 2.237755317187423
Energy: 2.3020910638032297
Energy: 2.0214370358636167
Energy: 2.134822884147872
Energy: 1.9976993651084392
Energy: 2.398869698851229
Energy: 2.0188228816997804
Energy: 2.1343728231442385
Energy: 2.0979055848751087
Energy: 2.0070334970846986
Energy: 2.0889096199876342
Energy: 1.9161975129925237
Energy: 2.1460922630305235
Energy: 2.111738152431717
Energy: 1.8544124336253138
Energy: 1.879254282551448
Energy: 2.222001119257128
Energy: 1.9327503127007755
Energy: 1.7978818577385147
Energy: 2.0462301607069975
Energy: 1.982766134357228
Energy: 2.0452279369189332
Energy: 1.9251243611714486
Energy: 1.9069710776393867
Energy: 2.14487403842579
Energy: 2.0124139658595186
Energy: 1.8503368970920018
Energy: 2.374434219866004
Energy: 2.038791226144308
Energy: 2.0851172015735537
Energy: 2.2526192749304985
Energy: 1.9610541726047062
Energy: 2.2731699316131277
Energy: 1.7450012795772751
Energy: 2.1426484885132546
Energy: 2.307708034432092
Energy: 2.325947920001072
Energy: 2.040292585451637
Energy: 1.9017251035275817
Energy: 2.093886981391263
Energy: 1.7639127260667375
Energy: 2.069019381958945
Energy: 2.18998429174235
Energy: 1.9011036062713393
Energy: 2.250803506792206
Energy: 2.0582141948135284
Energy: 2.0417032203981718
Energy: 2.1376460296520676
Energy: 2.276455685903419
Energy: 1.6586654221273758
Energy: 1.7276047189883965
Energy: 2.5594685471740233
Energy: 1.686400742077523
Energy: 2.1382165282650423
Energy: 1.77718445997278
Energy: 2.380002970078971
Energy: 1.8961128044082267
Energy: 1.7719941805859791
Energy: 2.0930564362013175
Energy: 1.8447215327734585
Energy: 1.57851036427078
Energy: 1.7563828102627252
Energy: 2.1363167934546023
Energy: 1.9651427099488363
Energy: 1.98152675974567
Energy: 2.0395616745454417
Energy: 1.924742822324354
Energy: 2.0412103998532847
Energy: 1.700352237067129
Energy: 1.9502510033275675
Energy: 2.08735916696907
Energy: 2.099439228656031
Energy: 2.2265556744157284
Energy: 1.723651403847094
Energy: 2.1309901050478754
Energy: 1.7467441508054031
Energy: 2.5443582890794616
Energy: 2.1634685763062795
Energy: 2.4452642440338863
Energy: 2.236614929045859
Energy: 1.8014108589288056
Energy: 1.8969944443817468
Energy: 2.0833058386082564
Energy: 2.2021243999003257
Energy: 1.9831921348758037
Energy: 1.930135241398831
Energy: 2.0987085201865514
Energy: 1.9487448638795732
Energy: 1.9183486482484404
Energy: 1.8659430070510075
Energy: 2.2744815451048725
Energy: 2.112832147018773
Energy: 2.434138245563445
Energy: 2.2144066365843984
Energy: 1.978469497261686
Energy: 2.0115060939634684
Energy: 1.9861334650449347
Energy: 1.855205433331888
Energy: 2.052837979920459
Energy: 2.21458312146058
Energy: 2.047833276252435
Energy: 1.9058954870392832
Energy: 1.8848029566509228
Energy: 1.9570567946061919
Energy: 1.9213558350672748
Energy: 2.1541619890071564
Energy: 2.0145981610269925
Energy: 2.004478052111946
Energy: 1.9730196181721338
Energy: 2.1898198856959636
Energy: 2.1214499167040173
Energy: 2.3400593637213203
Energy: 2.4185258061319286
Energy: 2.4611159994305356
Energy: 2.473714268278419
Energy: 2.082752142399631
Energy: 1.9911022063597983
Energy: 2.4282917439321077
Energy: 2.121812111114267
Energy: 2.2195703990401827
Energy: 2.086962533494347
Energy: 2.1205583734065288
Energy: 2.530557508436207
Energy: 2.5149213701654567
Energy: 2.2597582824774296
Energy: 2.282494656957473
Energy: 2.387322661669355
Energy: 2.149330911318949
Energy: 1.999361558716215
Energy: 2.2010618391173895
Energy: 2.4921837595371623
Energy: 2.216161244972871
Energy: 1.897132858647548
Energy: 2.6081003986859606
Energy: 2.4083122302795723
Energy: 2.0143156253716312
Energy: 2.0279041608914112
Energy: 1.970164654105076
Energy: 2.3864617855115307
Energy: 2.177112899098819
Energy: 2.197460446634212
Energy: 2.142280714769063
Energy: 2.122969739129254
Energy: 2.370767244613004
Energy: 2.276288326705864
Energy: 2.0118529726044487
Energy: 2.5195701202404046
Energy: 2.4543734148241234
Energy: 2.4108040357482654
Energy: 2.2831969532770287
Energy: 2.3379932784704525
Energy: 2.0109251034829607
Energy: 2.1141209650379946
Energy: 2.030320754740824
Energy: 2.2609435770385837
Energy: 2.0438745564987397
Energy: 2.0140461517201604
Energy: 2.126502477898264
Energy: 1.9989779147513953
Energy: 2.3178144002854317
Energy: 1.9915250287489645
Energy: 2.1848941098027326
Energy: 2.030405828588416
Energy: 2.0227591752745897
Energy: 2.165499649880551
Energy: 2.0200731083412875
Energy: 2.1473932154693345
Energy: 2.1487623386041608
Energy: 1.8534836781670816
Energy: 2.022709688819005
Energy: 2.1298763196128943
Energy: 1.941557513382085
Energy: 1.7985929193004788
Energy: 2.169871974293181
Energy: 1.9808271632550662
Energy: 2.045985762762289
Energy: 1.9370477605301313
Energy: 2.2624777575718857
Energy: 2.0527652658831204
Energy: 2.37372252470103
Energy: 1.8691344304429158
Energy: 2.463030913457493
Energy: 1.8063064781562128
Energy: 2.1863324298121904
Energy: 2.0200606703697157
Energy: 1.8700129768665104
Energy: 2.1832250781245195
Energy: 1.7441929619988656
Energy: 2.091605748304773
Energy: 2.319234553509743
Energy: 2.1172680957550387
Energy: 1.8414384303093403
Energy: 1.8196959515156363
Energy: 2.0305907101838745
Energy: 1.7646866030569386
Energy: 2.028960717095512
Energy: 2.1316775130126264
Energy: 2.0388968030400596
Energy: 2.103421288759043
Energy: 2.063577973803043
Energy: 2.1924788017982624
Energy: 2.127787764621304
Energy: 2.3994124437464763
Energy: 1.6347457325696415
Energy: 1.7797036296624156
Energy: 2.478522783978383
Energy: 1.6935252123513145
Energy: 2.224873795542917
Energy: 1.8998393170816885
Energy: 2.3318177818196637
Energy: 1.8029971358245296
Energy: 1.8701835178837076
Energy: 2.3579992828456056
Energy: 1.8428245965687378
Energy: 2.114969772663391
Energy: 1.8811925719703646
Energy: 2.0688984679449782
Energy: 1.9761860671312095
Energy: 2.0418442075210077
Energy: 1.9984708801982527
Energy: 1.9456253538318433
Energy: 1.793896164264273
Energy: 1.6983165049674005
Energy: 1.9196186841495708
Energy: 2.0609027549384833
Energy: 2.1680611641500813
Energy: 2.375614752546045
Energy: 1.7246103923450133
Energy: 2.0592805973961967
Energy: 1.7478480852182576
Energy: 2.4911531671682026
Energy: 2.1628412754379718
Energy: 1.978665397223521
Energy: 2.484070947428941
Energy: 1.7891599756161627
Energy: 1.8940639915313868
Energy: 2.097332358721151
Energy: 2.1993766480359738
Energy: 1.782106302531784
Energy: 1.8629422037905385
Energy: 2.3981144601736433
Energy: 1.990720102747258
Energy: 1.929233735555193
Energy: 1.9251311434629388
Energy: 2.2760892878003665
Energy: 1.839115677976335
Energy: 2.0395572126878765
Energy: 2.4488295622508787
Energy: 1.9586475916630077
Energy: 1.9818363642617778
Energy: 2.214481866469686
Energy: 2.058423302368741
Energy: 2.078601875173506
Energy: 2.065048898387384
Energy: 1.9026037928202935
Energy: 2.0535415135809054
Energy: 1.8868102125283763
Energy: 1.9526098472975322
Energy: 1.9244569880731242
Energy: 2.0881722734040524
Energy: 2.2354339978425615
Energy: 2.0469105447951095
Energy: 1.9791168336451472
Energy: 2.051541327855537
Energy: 2.033127270929862
Energy: 2.134685911916972
Energy: 2.5376341134885667
Energy: 2.3370589382511215
Energy: 2.4209495456694117
Energy: 2.0181939236595046
Energy: 2.114648555620233
Energy: 2.4058948666763706
Energy: 2.0330199927453267
Energy: 2.241661823441069
Energy: 2.261895495536318
Energy: 1.9969664681452106
Energy: 2.507770194647142
Energy: 2.5183514522324715
Energy: 2.1608403456467813
Energy: 2.089815811047876
Energy: 2.6293215621793338
Energy: 2.2007700410274817
Energy: 2.000351989227008
Energy: 2.2793153626154137
Energy: 2.154910716011921
Energy: 2.0402062686497953
Energy: 2.0315119186629516
Energy: 2.3894203131475127
Energy: 2.190310491450919
Energy: 2.004142838448008
Energy: 2.0655085376147606
Energy: 1.9657410771965715
Energy: 2.288744470809785
Energy: 2.1664903455144993
Energy: 2.2014117411864347
Energy: 2.2649648465662953
Energy: 2.1114452239729165
Energy: 2.5010582724856283

minimum gb energy = 1.57851036427078 eV
minimum distance =  1.64745798410261 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 1.7433625656208152
Energy: 2.246866319437448
Energy: 2.167841789871613
Energy: 1.6663912224927508
Energy: 1.6667400890162627
Energy: 2.1685483733496564
Energy: 1.664099182048935
Energy: 1.9615485876714476
Energy: 2.2435613006718973
Energy: 1.8786636601160998
Energy: 1.8890547263683215
Energy: 1.890241674898142
Energy: 1.8770722094081138
Energy: 2.536455851710705
Energy: 1.935999853979564
Energy: 2.570886178864596
Energy: 1.8696266815224893
Energy: 1.8952752520246583
Energy: 1.8852734625862415
Energy: 1.8747234903054815
Energy: 1.6719338638007648
Energy: 1.8723599390920491
Energy: 2.298941087343385
Energy: 1.871531095771163
Energy: 1.8940678779243574
Energy: 1.8898245937470985
Energy: 1.8893702873470903
Energy: 1.6708703122567334
Energy: 1.6612563275880645
Energy: 2.5242076080077824
Energy: 1.8814843049628105
Energy: 2.8903919848188244
Energy: 1.9315433395974801
Energy: 1.87699179923547
Energy: 2.293008829605182
Energy: 1.8797878761746467
Energy: 2.328962672563212
Energy: 1.8788284781770954
Energy: 1.8981682934502517
Energy: 1.883569516181301
Energy: 1.873796300536323
Energy: 1.6663292504658758
Energy: 1.8910871055985092
Energy: 2.5749965716095953
Energy: 1.8729951511438385
Energy: 1.8952976429912218
Energy: 1.8876373875075698
Energy: 1.8884061052191208
Energy: 2.2874252694352015
Energy: 1.8904115676460262
Energy: 2.3811216686315904
Energy: 1.8752852746648652
Energy: 1.8952453817733674
Energy: 1.8885202565140418
Energy: 1.8760237728958005
Energy: 2.5703253268605204
Energy: 1.6731040740725742
Energy: 2.2671775810400883
Energy: 1.875805981824881
Energy: 1.8976012447129127
Energy: 1.8933914866862558
Energy: 1.8825247034495682
Energy: 1.6680107601800669
Energy: 1.7373690728140703
Energy: 2.3375618793716324
Energy: 1.8861741460933938
Energy: 2.4519395395519816
Energy: 2.739758175959462
Energy: 1.9083823361079255
Energy: 1.9937139862321638
Energy: 1.868001204082836
Energy: 2.3168842178374613
Energy: 1.8755527741013625
Energy: 1.897354207666831
Energy: 1.8968519430205621
Energy: 1.882999263026095
Energy: 1.6687425482257228
Energy: 1.870233330477242
Energy: 2.3308697133475538
Energy: 1.870452921999211
Energy: 1.889856411361304
Energy: 1.887006856463922
Energy: 1.8743232713346065
Energy: 2.0380587289887084
Energy: 1.869326784091863
Energy: 2.5727153848240696
Energy: 1.8760664544219454
Energy: 1.8940341267492957
Energy: 1.8902091917181971
Energy: 1.8798923959922926
Energy: 2.5200656828263717
Energy: 1.6714465136189471
Energy: 2.352033639587174
Energy: 1.876306113760303
Energy: 1.905171488541349
Energy: 1.9271658959699416
Energy: 1.8894576553165863
Energy: 1.6655288049479648
Energy: 1.6597867721112696
Energy: 1.9939169830340393
Energy: 1.8875913746984612
Energy: 1.9615626115534948
Energy: 1.8956025745140612
Energy: 1.8810274058605754
Energy: 2.507280110566487
Energy: 1.8713160995883993
Energy: 2.572928080165188
Energy: 1.8727202734030184
Energy: 1.8945220276892007
Energy: 1.8924735438316544
Energy: 1.8798225890715203
Energy: 1.6711693857133942
Energy: 1.8750072714356056
Energy: 2.365000930072424
Energy: 1.8756185013392919
Energy: 1.8910004491170311
Energy: 1.887381504503054
Energy: 1.8760712562518562
Energy: 1.6643766919524678
Energy: 1.660855413359551
Energy: 2.531852465692781
Energy: 1.8746740685943648
Energy: 1.9025270677443813
Energy: 1.9028373670729943
Energy: 1.884690925942129
Energy: 2.559755072686663
Energy: 1.6723616140881463
Energy: 2.8762275700137243
Energy: 2.1670877307332512
Energy: 1.6658629544433445
Energy: 1.9490825926573958
Energy: 2.167788346178203
Energy: 1.6643283802777873
Energy: 1.8830300368749868
Energy: 2.352521254806775
Energy: 1.6069202526154298
Energy: 1.9004668827208013
Energy: 1.881619841180641
Energy: 1.875359735017903
Energy: 2.520420955373204

minimum gb energy = 1.6069202526154298 eV
minimum distance =  1.69260775668218 Angstroms
sigma value = 23