Model name: model_name=EAM_Dynamo_Olsson_2009_Fe__MO_024705128470_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.678452149033547
cohesive_energy=4.224994686759812
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.7596705971222e-19, 2.7694904859997197e-19, 3.33634057910892e-19, 3.78531853725474e-19, 4.1858626957547397e-19, 4.550085509961959e-19, 4.879797439472819e-19, 5.1755912896419e-19, 5.438508475281299e-19, 5.67003902066064e-19, 5.87194532007732e-19, 6.04608589842678e-19, 6.1946076723985795e-19, 6.319994015775419e-19, 6.424760345872679e-19, 6.511325949407699e-19, 6.5819018301354e-19, 6.63844264354926e-19, 6.68272680571302e-19, 6.716292406195319e-19, 6.740549360434079e-19, 6.756699300904799e-19, 6.76578364241958e-19, 6.768651538594439e-19, 6.765655468288859e-19, 6.75612251731656e-19, 6.73905933616446e-19, 6.7132002052917e-19, 6.676878860998919e-19, 6.628012473661919e-19, 6.56394143006826e-19, 6.481269115753859e-19, 6.375669653806919e-19, 6.24150338247576e-19, 6.07159255044006e-19, 5.85661248968994e-19, 5.58483526726452e-19, 5.241456771065639e-19, 4.807699490942819e-19, 4.2596749732831196e-19, 3.5666534702464194e-19, 2.68878884894514e-19, 1.5739639056518938e-19, 1.530419949093042e-20, -1.66621563406098e-19, -4.0079249587826997e-19, -7.052765521101659e-19, -1.107892324997928e-18, -1.65318993802656e-18, -2.4162425817354e-18, -3.528745971085979e-18, -5.2269410507616e-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: -1e-07 eV

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

Energy: 0.01780590651215495
Energy: 0.02171210994325153
Energy: 0.11249128178041101
Energy: 0.11257708625759924
Energy: 0.021863782767357415
Energy: 0.019205798541371277
Energy: 0.1252611195295549
Energy: 0.11272955004749127
Energy: 0.11332511307078917
Energy: 0.021086161850427155
Energy: 0.026157320287096306
Energy: 0.11992713257429688
Energy: 0.12180236964655836
Energy: 0.13337774676496578
Energy: 0.13299754829116617
Energy: 0.1154461864280115
Energy: 0.12036499175226795
Energy: 0.1240336129064331
Energy: 0.14507728030860917
Energy: 0.13207473983693366
Energy: 0.11588953550448632
Energy: 0.02267085794007667
Energy: 0.018275437269939725
Energy: 0.1295127295030471
Energy: 0.11893110659843817
Energy: 0.11570634287966337
Energy: 0.02258742238182347
Energy: 0.018171108552626568
Energy: 0.12830129497636866
Energy: 0.1146842852684636
Energy: 0.13142015784369823
Energy: 0.019050489395980023
Energy: 0.024820378420621226
Energy: 0.11958374182619946
Energy: 0.11509225307653244
Energy: 0.1326179114518023
Energy: 0.019303230369421387
Energy: 0.025507902982338255
Energy: 0.1234079936629717
Energy: 0.1164916971936562
Energy: 0.13035086297966222
Energy: 0.11344768831795084
Energy: 0.11752130792766777
Energy: 0.02427308788564295
Energy: 0.018433233831872176
Energy: 0.12897412991014998
Energy: 0.1180465617113386
Energy: 0.11702256178753032
Energy: 0.02324578937755796
Energy: 0.13590437446569115
Energy: 0.11684030040211972
Energy: 0.12538579772395778
Energy: 0.1306764079283994
Energy: 0.01875111300992173
Energy: 0.024706725584720854
Energy: 0.11752568555761443
Energy: 0.14734334942198485
Energy: 0.13152932692837924
Energy: 0.019139159014809646
Energy: 0.02583417199054223
Energy: 0.025019726330336226
Energy: 0.13475432306525043
Energy: 0.13107856473892474
Energy: 0.11744376038473846
Energy: 0.11729366975736323
Energy: 0.023865506119517082
Energy: 0.13581293168926892
Energy: 0.13073380724072164
Energy: 0.11610111182935227
Energy: 0.11580050243745107

minimum gb energy = 0.01780590651215495 eV
minimum distance =  2.51860984618258 Angstroms
sigma value = 3


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

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Energy: 0.7504885305760929
Energy: 0.685237809153159
Energy: 0.6858317504096162
Energy: 0.7145131144312046
Energy: 0.7719539337013795
Energy: 0.5640301979489512
Energy: 0.6854917103292095
Energy: 0.6871689425343686
Energy: 0.7536585312144602
Energy: 0.8054756226569972
Energy: 0.9685219317056317
Energy: 0.6864392409222063
Energy: 0.6865188412777969
Energy: 0.6798565314956805
Energy: 0.6571210306553315
Energy: 0.8379208481957838
Energy: 0.6870069840845159
Energy: 0.6911448053518814
Energy: 0.8636640549305036
Energy: 0.794334873138725
Energy: 0.8400934138030484
Energy: 0.8905302145358612
Energy: 0.6628317294784616
Energy: 0.6535408183694672
Energy: 0.661727918545043
Energy: 0.9818404195978977
Energy: 1.039357094097567
Energy: 0.7929733871546114
Energy: 0.7946928588726511
Energy: 0.7887785892411212
Energy: 0.691011087505288
Energy: 0.8846925134884772
Energy: 0.6633520384807892
Energy: 0.6587825914115001
Energy: 0.6668706888877305
Energy: 0.6883534800029278
Energy: 0.8862647058805468
Energy: 0.7900331875391889
Energy: 0.7943097694490531
Energy: 0.9832122139876279
Energy: 0.7472458975284805
Energy: 0.8391928845152361
Energy: 0.9646029821242394
Energy: 0.5979642565534589
Energy: 0.8495789172814249
Energy: 0.8588731219821507
Energy: 0.8403737961730391
Energy: 0.8278902483869578
Energy: 0.8240092125673196
Energy: 0.9037675367207656
Energy: 0.8801492105368139
Energy: 0.8318862504455783
Energy: 0.727314447488796
Energy: 0.8190287685420051
Energy: 0.9046220551901526
Energy: 0.8804888510018591
Energy: 0.8309522951139466
Energy: 0.7300458373086819
Energy: 0.8219772412780018
Energy: 0.811015038610762
Energy: 1.010891713659879
Energy: 0.8631011138344916
Energy: 0.7322950335961375
Energy: 0.8034560973929378
Energy: 0.8033761900264619
Energy: 0.8988698607511724
Energy: 0.7591122981661075
Energy: 0.731092039786113
Energy: 0.8011337263358074
Energy: 0.8100752239431
Energy: 0.8072623173983802
Energy: 0.7855262651698237
Energy: 0.7881691052849318
Energy: 0.8060584612622375
Energy: 0.8081939806041477
Energy: 0.8068925781684101
Energy: 0.844966360681693
Energy: 0.78847370144909
Energy: 0.8067669333168058
Energy: 0.8149043331947313
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Energy: 0.9676384678286108
Energy: 0.8101164238751083
Energy: 0.8020847068453347
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Energy: 0.8223671759468282
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Energy: 0.760756947023145
Energy: 0.9190712123911544
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Energy: 0.7428085521857581
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Energy: 0.9028044918308256
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Energy: 0.7750815598913757
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Energy: 0.8000759022616597
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Energy: 1.0331177986674587
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Energy: 0.8008712040754693
Energy: 0.808630632658828
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Energy: 0.7153170668319788
Energy: 0.7120697681773613
Energy: 0.8449336198964489
Energy: 0.929340662368265
Energy: 0.8429694839269314
Energy: 0.8082872369508307
Energy: 0.8128271823572185
Energy: 0.8449755950500365
Energy: 0.8695513846654302
Energy: 0.8802917171850709
Energy: 0.8503144101176388
Energy: 0.8359332731389258
Energy: 0.860020416639412
Energy: 0.8579082190159744
Energy: 0.8375776558202075
Energy: 0.8711905284772115
Energy: 0.8377816904468994
Energy: 0.8584147311518262
Energy: 0.8497212767450824
Energy: 0.8374343333113439
Energy: 0.7357526868871715
Energy: 0.9760629465619969
Energy: 0.8542611302956512
Energy: 0.8461406272203502
Energy: 0.7122014587803432
Energy: 0.7238001861576182
Energy: 0.869292365360908
Energy: 0.8543826535516317
Energy: 0.8421487356381634
Energy: 0.7122109645762368
Energy: 0.7960657537765513
Energy: 0.9827618851103249
Energy: 0.6477478379343942
Energy: 0.7057423469964493
Energy: 0.7124873600610184
Energy: 0.7050993470315088
Energy: 1.0147363922910722
Energy: 0.8875580511849258
Energy: 0.7053902401401249
Energy: 0.7139451886621195
Energy: 0.70875598145109
Energy: 0.6508729721506178
Energy: 0.8831453263436166
Energy: 0.7064524572516224
Energy: 0.6845812241789485
Energy: 0.708873019410568
Energy: 0.6573063692993361
Energy: 0.8830663360003969
Energy: 0.7063505748985753
Energy: 0.6876210789628834
Energy: 0.8930420442643004
Energy: 0.7538469826241324
Energy: 0.8755475523464966
Energy: 0.7455059951616242
Energy: 0.7800810152314844
Energy: 0.9610897838428951
Energy: -0.20134958763522562
Energy: 0.8756105365599788
Energy: 0.7459340008746962
Energy: 0.7810467534616846
Energy: 0.853290120469837
Energy: 0.8824907604422609
Energy: 0.8861097761673336
Energy: 0.7357965116126044
Energy: 0.8562916890434544
Energy: 0.8541182467353626
Energy: 0.846048618579276
Energy: 0.8358050573330728
Energy: 0.7675844479861068
Energy: 0.880407091451413
Energy: 0.8151997480987843
Energy: 0.9130019757319182
Energy: 0.8413073897316119
Energy: 0.7293164292331863
Energy: 0.9072451288737702
Energy: 0.8116151004589182
Energy: 0.8290108380670914
Energy: 0.919096049851786
Energy: 0.7304212422744361
Energy: 0.945348000466671
Energy: 0.8255747033104147
Energy: 0.8035029584153977
Energy: 0.8403031094552804
Energy: 0.887388898158888
Energy: 0.8056619934487702
Energy: 0.6919897488865644
Energy: 0.6929756992497942
Energy: 0.9276541625211295
Energy: 0.8857915558056855
Energy: 0.8065711945036967
Energy: 0.812078977684527
Energy: 0.7974634863667187
Energy: 0.6486847943698701
Energy: 0.9711432938509232
Energy: 0.8193567438324478
Energy: 0.8026728322958966
Energy: 0.7960939015395642
Energy: 0.648140389712662
Energy: 0.991788773227962
Energy: 0.8158213052037135
Energy: 0.7020188616349409
Energy: 0.749301754919207
Energy: 0.729443370611064
Energy: 0.6572555199293569
Energy: 0.8949037145176475
Energy: 0.7743505132905317
Energy: 0.756637656607973
Energy: 0.7252577676063008
Energy: 0.7933556295448243
Energy: 0.7536716109343754
Energy: 0.7939512807966554
Energy: 0.7556301407485255
Energy: 0.7562945303016549
Energy: 0.7500402874726084
Energy: 0.6461468096896906
Energy: 0.6530566232705561
Energy: 0.7485086162168862
Energy: 0.7494301154698233
Energy: 0.7444679930392489
Energy: 0.753358771893454
Energy: 1.0234581358783843
Energy: 0.6168882104420227
Energy: 0.8328198487759491
Energy: 0.6471737989547351
Energy: 0.6879789703690096
Energy: 0.9025452589195984
Energy: 0.6484435885002058
Energy: 0.8311974237443549
Energy: 0.9856696461812071
Energy: 0.6874602593356965
Energy: 0.8803019743233473
Energy: 0.7765495259321001
Energy: 0.86539283794513
Energy: 0.8469919166304678
Energy: 0.853049802673183
Energy: 0.9002516863788471
Energy: 0.9041681965225021
Energy: 0.758341081383591
Energy: 0.918944609229085
Energy: 0.8540593406285297
Energy: 0.7810699293963762
Energy: 0.795383919601528
Energy: 0.6936572588144316
Energy: 0.6867629914813544
Energy: 0.8950503708716562
Energy: 0.659041083822666
Energy: 0.6585069969826092
Energy: 0.6831282920525868
Energy: 0.8270412273062636
Energy: 1.026985232169144
Energy: 0.7673141481343957
Energy: 0.5822313603709365
Energy: 0.6860179277453283
Energy: 0.6855220145075757
Energy: 0.7147992631718816
Energy: 0.7759865021847588
Energy: 0.5572976000410257
Energy: 0.6855952450545048
Energy: 0.6864392492043816
Energy: 0.7529294915431854

minimum gb energy = -0.20134958763522562 eV
minimum distance =  2.18311196866625 Angstroms
sigma value = 75


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

Energy: 2.203172474701274
Energy: 1.0319900127921535
Energy: 0.9524406064601034
Energy: 1.0217963140958035
Energy: 0.9695293054145719
Energy: 0.9823711469753403
Energy: 0.9458789520714831
Energy: 0.9409923395585951
Energy: 0.9537169067684921
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Energy: 1.0226782813589073
Energy: 1.1138569617782184
Energy: 1.0047620618599051
Energy: 0.9575901115952827
Energy: 0.8505200397988484
Energy: 0.862946859102162
Energy: 1.052683851518525
Energy: 0.8259470313310862
Energy: 1.0007472955690313
Energy: 1.0150348002918808
Energy: 1.0665167613235964
Energy: 1.0979527923760888
Energy: 1.0949233261632176
Energy: 0.8974405268707581
Energy: 1.0003178367520489
Energy: 0.8656634529672375
Energy: 1.1030344332885333
Energy: 1.0948604430357043
Energy: 0.9991827848279033
Energy: 1.0003581441436384
Energy: 1.0158253067583254
Energy: 0.9810590566408105
Energy: 1.0871405602475268
Energy: 0.8513214431011684
Energy: 1.0015464582374884
Energy: 0.9489276416103092
Energy: 0.9843259067829263
Energy: 0.9814770138752129
Energy: 1.0596448504212033
Energy: 0.990498870399013
Energy: 1.1109090876900911
Energy: 0.9713698244602238
Energy: 1.0712588144228004
Energy: 1.1488032441293303
Energy: 1.0811738076384858
Energy: 1.0503544963442708
Energy: 1.005837211296159
Energy: 1.0530487453485868
Energy: 0.990005812524343
Energy: 1.0648036138414592
Energy: 1.046813501874989
Energy: 1.073535845367164
Energy: 1.0491921847071806
Energy: 0.9666354850488508
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Energy: 0.9873077710856175
Energy: 1.0361875924532895
Energy: 0.9848639168792992
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Energy: 1.0923838909521724
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Energy: 1.0038855265741138
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Energy: 1.0814431838708922
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Energy: 1.060831951021101
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Energy: 1.0453332719691752
Energy: 1.0135308707482928
Energy: 0.9831690606095339
Energy: 1.0946728554407013
Energy: 0.9764945170420338
Energy: 1.081212861613639
Energy: 1.0977090220735897
Energy: 1.0129654986362915
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Energy: 1.075495246644132
Energy: 1.0598694665657613
Energy: 1.0603866381123899
Energy: 1.0232881346905478
Energy: 1.1124839789933607
Energy: 1.0313065142907836
Energy: 1.0769798210165347
Energy: 1.096198750543227
Energy: 1.0471134356568148
Energy: 0.9785018887331205
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Energy: 1.0021682251370654
Energy: 1.1048605570106216
Energy: 1.057745620433281
Energy: 0.9806055046588423
Energy: 1.054527762744178
Energy: 0.9041231758986659
Energy: 1.0262071173852056
Energy: 0.9278050568411221
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Energy: 0.9425180119335778
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Energy: 1.071743414295855
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Energy: 1.0233208487154373
Energy: 0.9848246112321227
Energy: 1.1260048780681013
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minimum gb energy = 0.7263151877772007 eV
minimum distance =  2.27172444446403 Angstroms
sigma value = 105


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

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Energy: 1.0309499624256688
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Energy: 1.0203504318765066
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Energy: 0.9712829707046845
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Energy: 1.0276201194798051
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Energy: 0.990558933499109
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Energy: 1.0318849557534584
Energy: 0.8930239472413011
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Energy: 0.9753107074568806
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Energy: 1.0193648421123054
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Energy: 1.0073777880106916
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Energy: 1.0050370598653267
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Energy: 1.0191996614578183
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Energy: 0.8701720017413141
Energy: 0.8837407886914753
Energy: 0.881524265388023
Energy: 0.9650263069003614
Energy: 1.0148695663272527
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Energy: 0.8829962146209107
Energy: 0.880168736688205
Energy: 0.9637736425701713
Energy: 0.9794152669191447
Energy: 0.9001822272040421
Energy: 0.8163595395408245
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Energy: 1.0272329211946944
Energy: 0.968263170656727
Energy: 0.9687795232412783
Energy: 0.8261078061553575
Energy: 0.8836479332950434
Energy: 0.989131550486104
Energy: 0.8958688338629185
Energy: 0.9170091609582303
Energy: 0.9059741474466994
Energy: 0.8706990488942914
Energy: 1.0387923286182927
Energy: 0.8719071341267752
Energy: 0.9156195231286887
Energy: 0.9055954610165456
Energy: 1.0315042041305706
Energy: 0.9541976866461016
Energy: 0.8874706788349829
Energy: 0.8802219479652749
Energy: 0.8994143906923033
Energy: 0.8972673873953299
Energy: 0.827951515762439
Energy: 0.8700402418121385
Energy: 0.9332606940294029
Energy: 0.8934841972937204
Energy: 0.900939378645816
Energy: 1.0068779138911068
Energy: 0.9362988011237201
Energy: 0.8037571739019839
Energy: 0.9992696822606151
Energy: 0.9488416878871121
Energy: 0.9051498483347318
Energy: 0.9206153603183571
Energy: 0.8680105615938877
Energy: 1.018026873150812
Energy: 0.9796526280291068
Energy: 0.9064781919359072
Energy: 0.9826199800359557
Energy: 1.0287237823601978
Energy: 0.9330437729599076
Energy: 0.9337125942331002
Energy: 0.9779438068960438
Energy: 1.013834387923719
Energy: 1.028721694913539
Energy: 0.9824721595827651
Energy: 0.9342323795672824
Energy: 0.9852543342492334
Energy: 0.8984465519353709
Energy: 0.849420408419484
Energy: 0.813813317763526
Energy: 0.9375923618730783
Energy: 0.9547046682120434
Energy: 0.8773042526449127
Energy: 1.0067555120750964
Energy: 0.8248094986655948
Energy: 0.9375033722375051
Energy: 1.0076048924237688
Energy: 1.0126291311380364
Energy: 0.8255473833665652
Energy: 0.8348329881121561
Energy: 0.8346220381011943
Energy: 0.7849843331043014
Energy: 0.7732722120522268
Energy: 0.8252296301276576
Energy: 0.900031612104145
Energy: 0.8358764803805583
Energy: 0.9075882379631744

minimum gb energy = 0.7732722120522268 eV
minimum distance =  2.24881400996062 Angstroms
sigma value = 165


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

Energy: 1.5607846909432133
Energy: 0.9913858245304998
Energy: 0.9025447195973849
Energy: 0.999210151918393
Energy: 0.9501703681230287
Energy: 1.4626760318717296
Energy: 0.9228186334680445
Energy: 0.9749758423066128
Energy: 0.9257593859681483
Energy: 0.9915916175919101
Energy: 0.9979794309451716
Energy: 1.0670159749310946
Energy: 1.0004640026753602
Energy: 0.9434017862638345
Energy: 0.6482875146916142
Energy: 0.9806972155805764
Energy: 0.8857552455115009
Energy: 0.6505224959613791
Energy: 1.0267953080120669
Energy: 1.1069240320170075
Energy: 1.0585650133322013
Energy: 1.0887513083840519
Energy: 1.0162724860037413
Energy: 1.0238524486328289
Energy: 1.007871366986516
Energy: 1.0406484395508488
Energy: 0.8815386481514729
Energy: 1.01222027924133
Energy: 1.0418552711007336
Energy: 1.008371680732936
Energy: 1.075100695892734
Energy: 1.0146504215789052
Energy: 1.0653870684146893
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Energy: 0.05743623358514055
Energy: 0.8901586285306828
Energy: 1.053312085684465
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Energy: 1.0320362943251435
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Energy: 1.0711981213602244
Energy: 0.9614473746983913
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Energy: 0.9567847212758007
Energy: 1.041124146468142
Energy: 0.9971188013684759
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Energy: 0.9617859324904171
Energy: 1.0895032642222278
Energy: 1.0543212010116365
Energy: 1.047063943418982
Energy: 1.0390164191270859
Energy: 1.0221885426219361
Energy: 0.923258732288179
Energy: 1.0496115578200211
Energy: 1.046768090702056
Energy: 0.892553991140676
Energy: 1.006653641312193
Energy: 0.9949342472110285
Energy: 1.042186199499687
Energy: 1.0480633950092024
Energy: 1.0395148068371862
Energy: 1.0074534596702194
Energy: 1.0050124560362856
Energy: 0.896544066519517
Energy: 1.0494223472739923
Energy: 1.0845642699218736
Energy: 1.0077602484756607
Energy: 0.8927848677482783
Energy: 1.063657138057234
Energy: 1.0480469090280133
Energy: 1.0361983033874769
Energy: 0.9425244128915697
Energy: 1.0299046133210077
Energy: 0.9159083226439729
Energy: 1.0506022622853655
Energy: 1.0374346150876765
Energy: 1.0175672966254419
Energy: 1.0138007623556071
Energy: 0.9618304023977897
Energy: 1.0219835449836996
Energy: 0.8589105670583463
Energy: 0.9031269210798021
Energy: 1.0366611507251828
Energy: 0.9959164960448388
Energy: 1.0119315568032496
Energy: 1.0401987691217847
Energy: 0.44596356230354106
Energy: 1.0304060181685077
Energy: 1.0158822388592654
Energy: 0.9527043174040588
Energy: 0.9443054508221115
Energy: 1.0388048433904509
Energy: 0.97087372994251
Energy: 1.015797370202031
Energy: -0.46263876495323814
Energy: 0.9433493713128952
Energy: 1.0250353942410497
Energy: 0.9819126795880956
Energy: 1.1197821125792962
Energy: 1.0063420844719357
Energy: 0.9031504949152139
Energy: 0.8856169853659702
Energy: 0.955245388049015
Energy: 1.0020085733546293
Energy: 0.590826973913804
Energy: 1.000928006824591
Energy: 1.0681683865634126

minimum gb energy = -0.46263876495323814 eV
minimum distance =  2.27976594526555 Angstroms
sigma value = 41


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

Energy: 0.9131569871561657
Energy: 0.7740237540218484
Energy: 0.7808527064486587
Energy: 0.7618541373172762
Energy: 0.7243565900872445
Energy: 0.8123997277940259
Energy: 0.7238547142714535
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Energy: 0.8501302938729892
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Energy: 0.8593018148952769
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Energy: 0.8759628156487264
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Energy: 0.921543775490051
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Energy: 0.8211811905070103
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Energy: 0.7799418383897376
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Energy: 0.9227113152450334
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Energy: 0.8350042203832942
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Energy: 0.9209810804995581
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Energy: 0.885132611574521
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Energy: 0.9106902960881268
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Energy: 0.8754775491358072
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Energy: 0.8045271194744161
Energy: 0.9046596286427225
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Energy: 0.9125131197068446
Energy: 0.9166214801468735
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Energy: 0.8500113082157562
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Energy: 0.9094074650974441
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Energy: 0.9099410533583362
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Energy: 0.852661610793984
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Energy: 0.8335873948348432
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Energy: 0.8342700333408294
Energy: 0.8853485617082854
Energy: 0.8869227729422017
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Energy: 0.7841996993250938
Energy: 0.8302955061552798
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Energy: 0.886524380852119
Energy: 0.8534950454328899
Energy: 0.8214126086342968
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Energy: 0.8603835712121056
Energy: 0.9102626985200066
Energy: 0.8343594440238982
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Energy: 0.8635451471165844
Energy: 0.8772333501437146
Energy: 0.8949697815472897
Energy: 0.7923480876506491
Energy: 0.826621263290974
Energy: 0.8440757971134385
Energy: 0.9071976439858264
Energy: 0.7552781508360669
Energy: 0.7683356523484997
Energy: 0.7235083829615465
Energy: 0.7588536407508382
Energy: 0.887101930022972
Energy: 0.7598892646697147
Energy: 0.8427619140365301
Energy: 0.8165009037396815
Energy: 0.8140407509928843
Energy: 0.892629461143335
Energy: 0.8219298924462339
Energy: 0.7218495966099084
Energy: 0.7867254094073882
Energy: 0.7689515436690231
Energy: 0.8871124510815048
Energy: 0.816746941727781
Energy: 0.8286871521319915
Energy: 0.810374573667491
Energy: 0.9077820130111123
Energy: 0.9331186307263812
Energy: 0.7877379035209622
Energy: 0.7745538209768094
Energy: 0.7240155427733981
Energy: 0.8434522348848581
Energy: 0.8643644502702565
Energy: 0.7824118584789368
Energy: 0.7241706059909904
Energy: 0.832415707393084
Energy: 0.8842819765377053
Energy: 0.7836012097972044
Energy: 0.781917282999439
Energy: 0.8000758506990723
Energy: 0.7338121331800809
Energy: 0.8542220878353063
Energy: 0.721662946300093
Energy: 0.7959350744243893
Energy: 0.7995031715127193
Energy: 0.785282809605218

minimum gb energy = 0.721662946300093 eV
minimum distance =  2.30122991888452 Angstroms
sigma value = 185


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

Energy: 1.113438739797766
Energy: 0.838098744898801
Energy: 0.6396903148961394
Energy: 0.6482052479075759
Energy: 0.5837882886743634
Energy: 0.578485488852947
Energy: 0.6859815314626596
Energy: 0.7225398825813234
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Energy: 0.9136669595408766
Energy: 0.9125060405329568
Energy: 0.7407134226091597
Energy: 0.721412946813228
Energy: 0.5614264960305083
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Energy: 0.6959026475510549
Energy: 0.6758960067142183
Energy: 0.7187320395326625
Energy: 0.6924073227616382
Energy: 0.6992383924846511
Energy: 0.7701429703820062
Energy: 0.8279593754867002
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Energy: 0.7078357061921764
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Energy: 0.7927962155634419
Energy: 0.5865979739987092
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Energy: 0.6221955084637752
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Energy: 0.5924210863172352
Energy: 0.5361179863403002
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Energy: 0.6761937095705374
Energy: 0.6667543281447308
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Energy: 0.3982593284351094
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Energy: 0.39754166283255254
Energy: 0.6718114400244001
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Energy: 0.9728102767587865
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Energy: 0.5613519167724057
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Energy: 0.6557664762086305
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Energy: 0.5224658252739013
Energy: 0.39778262988969626
Energy: 0.7007864609576319
Energy: 0.5691020460116685
Energy: 0.4852378475939879
Energy: 0.6611820179926172
Energy: 0.4794214598554037
Energy: 0.6222507393117764
Energy: 0.47705238063611527
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Energy: 0.5999815674483328
Energy: 0.6757623458959839
Energy: 0.6708864025749082
Energy: 0.4827918922203096
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Energy: 0.6224364487883687
Energy: 0.6221540065583521
Energy: 0.47898307768171894
Energy: 0.40362621588591313
Energy: 0.6625025684974447
Energy: 0.6694541316019754
Energy: 0.6707733391415915
Energy: 0.664012285709471
Energy: 0.6153552021051604
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Energy: 0.4797425483230643
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Energy: 0.6989142876206029
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Energy: 0.6241447343386585
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Energy: 0.55396149653504
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Energy: 0.5779097441628542
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Energy: 0.39531069419385856
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Energy: 0.4842263189576047
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Energy: 0.5632601953448337
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Energy: 0.48189765311882904
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Energy: 0.6221330572731353
Energy: 0.3986647081820129
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Energy: 0.6984990476208635
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Energy: 0.734617218585
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Energy: 0.7040730157408176
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Energy: 0.5807048568293526
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Energy: 0.6243431197458426
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Energy: 0.5854421298784614
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Energy: 0.5890357869832149
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Energy: 0.6563053176007179
Energy: 0.5878194483858353
Energy: 0.6332205041473697
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Energy: 0.5363559885891089
Energy: 0.5985931810606635
Energy: 0.5812901271229106
Energy: 0.5778966947252123
Energy: 0.7481709007308527
Energy: 0.7477763244108098
Energy: 0.3991726576559662
Energy: 0.694741267451735
Energy: 0.6760562674585839
Energy: 0.5889224392399931
Energy: 0.5408901704637964
Energy: 0.5856629255208077
Energy: 0.7949063638311292
Energy: 0.5597361902957332
Energy: 0.3977600020292123
Energy: 0.6486387750931231
Energy: 0.6763159351502821
Energy: 0.8215328955662369
Energy: 0.7434147828490495
Energy: 0.6771014121821051
Energy: 0.6161960824786815
Energy: 0.7014674874717923
Energy: 0.7533461131395034
Energy: 0.6237788029800032
Energy: 0.7080071737679813
Energy: 0.622357728932448
Energy: 0.6953272560884804
Energy: 0.7496783825965547
Energy: 0.6816776806190022
Energy: 0.6777741695328395
Energy: 0.6410142622153615
Energy: 0.7532480373289768
Energy: 0.6769690014661064
Energy: 0.7106963451106885
Energy: 0.7088232199016812
Energy: 0.7362790600711573
Energy: 0.7470403227359672
Energy: 0.7027144607048345
Energy: 0.7138004909613863
Energy: 0.7162141506734644
Energy: 0.7166467303687778
Energy: 0.5738849447983576
Energy: 0.6951194107370056
Energy: 0.4238126400909143
Energy: 0.5918798248734645
Energy: 0.6344083129772823
Energy: 0.9648576011876914
Energy: 0.7541715729916777
Energy: 0.9111976524920283
Energy: 0.7487313784494796
Energy: 0.7997228052534754
Energy: 0.6229467728518341
Energy: 0.667651979812926
Energy: 0.5798107208787048
Energy: 0.6865097581080847
Energy: 0.7144997020179226
Energy: 0.6955954765058835
Energy: 0.7166499299799263

minimum gb energy = 0.39531069419385856 eV
minimum distance =  2.27994867594178 Angstroms
sigma value = 33


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

Energy: 0.7866473513476211
Energy: 0.6957186608805286
Energy: 0.738016838576081
Energy: 0.6866954049931945
Energy: 0.7254998050597764
Energy: 0.7264515922759066
Energy: 0.6731629327218678
Energy: 0.6861684890955464
Energy: 0.7406375643292
Energy: 0.7432690730694178
Energy: 0.6990014689879332
Energy: 0.7604222025366238
Energy: 0.7448235262673019
Energy: 0.7987224410352203
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Energy: 0.761665266660741
Energy: 0.7570810635378934
Energy: 0.7805093167710229
Energy: 0.6982282675513305
Energy: 0.7793871483189194
Energy: 0.6790148551249124
Energy: 0.7742799610147664
Energy: 0.7405068036813592
Energy: 0.731953641402413
Energy: 0.7280642638865712
Energy: 0.7309072120479319
Energy: 0.7887905080149682
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Energy: 0.7315024764121876
Energy: 0.8094960795530706
Energy: 0.761989997979722
Energy: 0.7218726358334316
Energy: 0.7480745112837816
Energy: 0.7372881900218982
Energy: 0.7911696477844039
Energy: 0.7773796651611834
Energy: 0.7815085289365389
Energy: 0.7740073083974779
Energy: 0.7765474381819041
Energy: 0.7381476147071429
Energy: 0.7399138187138455
Energy: 0.7684145550941466
Energy: 0.7082127807848044
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Energy: 0.7507735825476451
Energy: 0.753617277882982
Energy: 0.7785125419551208
Energy: 0.7563715549249302
Energy: 0.7847373470641067
Energy: 0.709363655609526
Energy: 0.7416768288440663
Energy: 0.8236842261946624
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Energy: 0.7993917183024603
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Energy: 0.7413554032369191
Energy: 0.8300936558572497
Energy: 0.6990335188135388
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Energy: 0.7107173117936635
Energy: 0.8099246690308332
Energy: 0.6992914827180673
Energy: 0.7278334198374129
Energy: 0.7194936860012789
Energy: 0.7093196964721314
Energy: 0.7119875853750502
Energy: 0.7454606359693673
Energy: 0.7413041465284421
Energy: 0.7517626338131527
Energy: 0.7078386306126195
Energy: 0.7020109971152588
Energy: 0.7119028117210636
Energy: 0.733258015048188
Energy: 0.7568453667190691
Energy: 0.720273924347548
Energy: 0.7166365237980107
Energy: 0.7500933715709658
Energy: 0.7314722114885128
Energy: 0.7485631371556692
Energy: 0.7373379731105951
Energy: 0.7406015161048084
Energy: 0.7493840136043483
Energy: 0.7318842273083561
Energy: 0.7400516878428965
Energy: 0.7025804015629472
Energy: 0.7417907146677667
Energy: 0.7515445172554124
Energy: 0.7339537594559741
Energy: 0.7344456977100999
Energy: 0.7327977667193566
Energy: 0.7061573392523897
Energy: 0.7493611637544576
Energy: 0.7636338825654883
Energy: 0.73443704948311
Energy: 0.7449019343561447
Energy: 0.7163452822636025
Energy: 0.736073695468038
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Energy: 0.7412867546412507
Energy: 0.6947611210284619
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Energy: 0.7409749917331411
Energy: 0.721647461571394
Energy: 0.7197763361037006
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Energy: 0.6949360492016247
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Energy: 0.810026044896954
Energy: 0.7243838192033814
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Energy: 0.6731165857525989
Energy: 0.6744150925907932
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Energy: 0.6740436115946467
Energy: 0.7226267728401176
Energy: 0.7397242873086618
Energy: 0.7427371231796286

minimum gb energy = 0.6674685171550404 eV
minimum distance =  2.32342506751684 Angstroms
sigma value = 219


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

Energy: 1.0088003887384047
Energy: 1.0037713277939184
Energy: 1.0163910961850957
Energy: 1.017251992365873
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Energy: 0.9702646238894437
Energy: 0.9635359884895099
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Energy: 1.0149626812336052
Energy: 1.0408029349339978
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Energy: 1.0498575210253245
Energy: 0.989728224228893
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Energy: 1.0168358420586998
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Energy: 1.1029426676888263
Energy: 0.9720849015901467
Energy: 0.9042958834503804
Energy: 0.9049988276723584
Energy: 0.9057746522454707
Energy: 1.0191877463689454
Energy: 0.9691071954647144
Energy: 1.0116556784374406
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Energy: 0.9074427795593344
Energy: 1.098527240511471
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Energy: 0.9696762656699277
Energy: 1.037037699031757
Energy: 1.01728986227229
Energy: 0.9642739242251531
Energy: 1.0404797376416528
Energy: 0.911780226565583
Energy: 1.0395035025392625
Energy: 1.0405468052550324
Energy: 0.9643300827721795
Energy: 1.0396641231937578
Energy: 0.9014664179968569
Energy: 0.9367329188703446
Energy: 0.9683817132613088
Energy: 0.9678638397670276
Energy: 0.9618779753607429
Energy: 0.8992353778547324
Energy: 0.90629797307405
Energy: 1.0502013225501534
Energy: 0.9678236915698688
Energy: 0.9624779419763542

minimum gb energy = 0.8992353778547324 eV
minimum distance =  2.26423610273744 Angstroms
sigma value = 15


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

Energy: 1.3155601669384416
Energy: 1.2394105088161789
Energy: 1.270706960433013
Energy: 1.1778121935996004
Energy: 1.0222032051181313
Energy: 1.2984813431688669
Energy: 1.2038150768990081
Energy: 1.26991022749049
Energy: 1.229140515542112
Energy: 1.1091860391997357
Energy: 1.2610545196483796
Energy: 1.1663471207710672
Energy: 1.2563664112121715
Energy: 1.239150410657311
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Energy: 1.2541842441980675
Energy: 1.1821509563486259
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Energy: 1.2231685284274711
Energy: 1.22093802112347
Energy: 1.1803720649951346
Energy: 1.2315186925563661
Energy: 1.1726741319214753
Energy: 1.2809645247609192
Energy: 1.2971856921465574
Energy: 1.1937832994989637
Energy: 1.2288259719957693
Energy: 1.185383257294242
Energy: 1.2991992327699595
Energy: 1.2705446575157302
Energy: 1.2885504605089035
Energy: 1.1412991459047919
Energy: 1.2372511402786748
Energy: 1.2110451313970771
Energy: 1.3038842459016158
Energy: 1.2761589370263802
Energy: 1.1646348927230579
Energy: 1.2207330593398589
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minimum gb energy = 1.0222032051181313 eV
minimum distance =  2.30832550389601 Angstroms
sigma value = 293


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

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Energy: 1.289289321908842
Energy: 1.2430737416509288
Energy: 1.2227796750029871
Energy: 1.2773100034994096
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Energy: 1.2267695657560258
Energy: 1.2521470795588112
Energy: 1.2347346000779544
Energy: 1.1547095975160309
Energy: 1.2472188973454115
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Energy: 1.2221280756316606
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Energy: 1.1543980228793507
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Energy: 1.2231909440455357
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Energy: 1.251577139711409
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Energy: 1.2377113428969535
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Energy: 1.2528831947660226
Energy: 1.2615396910405063
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Energy: 1.3011137872615695
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Energy: 1.2416610017686442
Energy: 1.2571718115074706
Energy: 1.2108327818488938
Energy: 1.2475899120503513
Energy: 1.256103152388773
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Energy: 1.227038440479624
Energy: 1.2504868196828753
Energy: 1.246166578782891
Energy: 1.229092916275188
Energy: 1.2828460834145512
Energy: 1.27714804670566
Energy: 1.2299003329612066
Energy: 1.2774229688389502
Energy: 1.2406496358318733
Energy: 1.2300391533376873
Energy: 1.3178443526642216
Energy: 1.2632656118353975
Energy: 1.2735355585463632
Energy: 1.2296614127621661
Energy: 1.2300534841020905
Energy: 1.3074651869128895
Energy: 1.223459419251495
Energy: 1.2345055132360203
Energy: 1.2935482817282626
Energy: 1.2370864102804875
Energy: 1.290363842280633
Energy: 1.2107210137409927
Energy: 1.2329534993617455
Energy: 1.2917031024056693
Energy: 1.1498941560017057
Energy: 1.175232389172244
Energy: 1.1750032236085552
Energy: 1.2473501857028224
Energy: 1.1818068889810283
Energy: 1.245435328700147
Energy: 1.2513506098713827
Energy: 1.252439484402336
Energy: 1.2322415457899483
Energy: 1.2393419499996685
Energy: 1.2309125891986012
Energy: 1.2609396822605647
Energy: 1.256044872058123
Energy: 1.2446401095803101
Energy: 1.3590566596006914
Energy: 1.1429973118937844
Energy: 1.2304955588680602
Energy: 1.1914837690977744
Energy: 1.2082296925882439
Energy: 1.3577294357055523
Energy: 1.1542053966294028
Energy: 1.2393616613461689
Energy: 1.1879994179160338
Energy: 1.2930759562100425
Energy: 1.3467026581059454
Energy: 1.2911115429239866
Energy: 1.234658097064747
Energy: 1.2844188068625593
Energy: 1.2082497425691014
Energy: 1.3297763631775361
Energy: 1.2540406027888342
Energy: 1.231000516181142
Energy: 1.2419065251788597
Energy: 1.3141325644556687
Energy: 1.2333599483537399
Energy: 1.2078277933731107
Energy: 1.2638019277699997
Energy: 1.2302391369920458
Energy: 1.23074315326039
Energy: 1.2289390659705972
Energy: 1.2301517675705151
Energy: 1.2224731756851177
Energy: 1.3002418184550368

minimum gb energy = 1.0618428689893267 eV
minimum distance =  2.28665041297718 Angstroms
sigma value = 293


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

Energy: 1.3518731408648499
Energy: 1.159464447215968
Energy: 1.2439544909518823
Energy: 1.160293184914848
Energy: 1.1598441694013872
Energy: 1.3518756412472317
Energy: 1.1587998157772408
Energy: 1.2439097007780322
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Energy: 1.164056776562941
Energy: 1.1596712264329612
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Energy: 1.1596692291139739
Energy: 1.1603534289630286
Energy: 1.1600091866858402
Energy: 1.2603634453842405
Energy: 1.1609815969593413
Energy: 1.2459229889536416
Energy: 1.1603548402274007
Energy: 1.1618869390726736
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Energy: 1.2439214976541308
Energy: 1.2460576829312142
Energy: 1.2435897653682355
Energy: 1.1643527296570733
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Energy: 1.1604199446673198
Energy: 1.2441008294706797
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Energy: 1.1593690985977494
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Energy: 1.24462545631828
Energy: 1.2628089010653856
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Energy: 1.1595779440940208
Energy: 1.1586268748546975
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Energy: 1.2438302984703142
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Energy: 1.3509218589670884
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Energy: 1.1600025589062843
Energy: 1.1606046747968712
Energy: 1.159254982960374
Energy: 1.1630636925117128
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Energy: 1.1619797794840998
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Energy: 1.1606486031280787
Energy: 1.1587640786880578
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Energy: 1.1642142113348253
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Energy: 1.1598218479114417
Energy: 1.3523295023456672
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Energy: 1.1599870566622918
Energy: 1.1605764942696202
Energy: 1.2433454622405227
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Energy: 1.2435457695930083
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Energy: 1.1622193753376053
Energy: 1.1593568211057361
Energy: 1.245416747793118
Energy: 1.2457999985093644
Energy: 1.164079391604608
Energy: 1.1617723200110164
Energy: 1.1594004918045613
Energy: 1.245904485455242
Energy: 1.159207268525436
Energy: 1.162729820491454
Energy: 1.1622476993835233
Energy: 1.2611339472240042
Energy: 1.1606919415483326
Energy: 1.1597179557543926
Energy: 1.1621726312862268
Energy: 1.164298856960294
Energy: 1.2617960827755845
Energy: 1.1601160945036817
Energy: 1.1604137064757782
Energy: 1.2447880386318926
Energy: 1.1602112719503834
Energy: 1.1603893471476008
Energy: 1.16139072350127
Energy: 1.160488400780612
Energy: 1.2447580381323051
Energy: 1.161159283315082
Energy: 1.2602466143191817
Energy: 1.1603462191331304
Energy: 1.1595898512496916
Energy: 1.2607373071939973
Energy: 1.1592429963269948
Energy: 1.1600279911623204
Energy: 1.1592425745977581
Energy: 1.1602053571382074
Energy: 1.2622110548245242
Energy: 1.1591686189798887
Energy: 1.1597641827016947
Energy: 1.2443094092057
Energy: 1.1590737389602705
Energy: 1.2439005669248988
Energy: 1.24393911346059
Energy: 1.3516243558870256
Energy: 1.1620373866336928
Energy: 1.1594514106250386
Energy: 1.2432327291175997
Energy: 1.1618001829446531
Energy: 1.3509799019165
Energy: 1.161658010913134
Energy: 1.1601002922550645
Energy: 1.163020761866503
Energy: 1.1594840233730062
Energy: 1.1628516835233584
Energy: 1.2435636031105248
Energy: 1.1602836912728098
Energy: 1.1606220519856665
Energy: 1.159153477099724
Energy: 1.1630195694310073
Energy: 1.1595097562920291
Energy: 1.260271120321058
Energy: 1.161749547911719
Energy: 1.2433004210296297
Energy: 1.1611508725606547
Energy: 1.159176152747781
Energy: 1.2600839825931391
Energy: 1.1600528419336662
Energy: 1.3492776369774457
Energy: 1.1605068559675846
Energy: 1.1595194964069242
Energy: 1.1641985376444768
Energy: 1.1588875424675384
Energy: 1.1601609346168436
Energy: 1.245329549877452
Energy: 1.2436790488832403
Energy: 1.1631420972984654
Energy: 1.1589225997771846
Energy: 1.2636293414132986
Energy: 1.2448289702053728
Energy: 1.242907496890513

minimum gb energy = 1.1572084747451503 eV
minimum distance =  2.33300288856297 Angstroms
sigma value = 15


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

Energy: 1.1820645764482083
Energy: 1.2457221380563868
Energy: 1.2452912393641462
Energy: 1.228424783910904
Energy: 1.231543377389844
Energy: 1.1520650841581817
Energy: 1.2377061475581774
Energy: 1.2335337826670987
Energy: 1.2315280054755409
Energy: 1.2494098139613312
Energy: 1.1881413883687637
Energy: 1.1983525268592021
Energy: 1.1901510203390204
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Energy: 1.2368057937961119
Energy: 1.2288917155132448
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Energy: 1.1933109411064573
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Energy: 1.2493623055470513
Energy: 1.2246302323461282
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Energy: 1.2157817438576495
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Energy: 1.225123870423655
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Energy: 1.268222349256263
Energy: 1.3545562918703955
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Energy: 1.258183262891219
Energy: 1.26074297628512
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Energy: 1.1464238951363106
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Energy: 1.3115550014285533
Energy: 1.237682519698353
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Energy: 1.3169516787654219
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Energy: 1.2198359825857072
Energy: 1.270680373235867
Energy: 1.3155540860234194
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Energy: 1.312117874763552
Energy: 1.1842966883128705
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Energy: 1.1745801479290143
Energy: 1.2702619176011791
Energy: 1.392105337554441
Energy: 1.2718871458655363
Energy: 1.358860368268907
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Energy: 1.3087704959462405
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Energy: 1.2304165032618546
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Energy: 1.155729445888665
Energy: 1.1532075524005032
Energy: 1.369407406793909
Energy: 1.150941896077242
Energy: 1.1753815623378532
Energy: 1.1554269971801185
Energy: 1.2544498078741984
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Energy: 1.2530300520192297
Energy: 1.1682787544125817
Energy: 1.1741375572058041
Energy: 1.1814811008158903
Energy: 1.3393491556285846
Energy: 1.2534422395875762
Energy: 1.1727710038977812
Energy: 1.1565275721608848
Energy: 1.2227920460584287
Energy: 1.2030961241260438
Energy: 1.2101904584263454
Energy: 1.1642292852803309
Energy: 1.2369991081604979
Energy: 1.2222474801915755
Energy: 1.2292331766151268
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Energy: 1.2353387402152614
Energy: 1.247574182275267
Energy: 1.1902852804330804
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Energy: 1.4687765864484126
Energy: 1.1390154125036975
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Energy: 1.1722445638701215
Energy: 1.2409702673528247
Energy: 1.4490444692264715
Energy: 1.1659042842221086
Energy: 1.1712419054179601
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Energy: 1.245854392755653
Energy: 1.1745388735980797
Energy: 1.1715828081830237
Energy: 1.1913104194567192
Energy: 1.1808116240894184
Energy: 1.246135068841263
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Energy: 1.2964394424716228
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Energy: 1.345685713356576
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Energy: 1.1536899329245538
Energy: 1.1997905010501093
Energy: 1.3453715814809128
Energy: 1.2629032130971698
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Energy: 1.2353397952001441
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Energy: 1.2489787527260814
Energy: 1.2661723412579333
Energy: 1.4853702650332357
Energy: 1.2154382905191246
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Energy: 1.2762421896565221
Energy: 1.199470150527971
Energy: 1.1907410749227003
Energy: 1.2301546008024369
Energy: 1.2722253200949063
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Energy: 1.1991260505046388
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Energy: 1.2224302979978423
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Energy: 1.2342574545942218
Energy: 1.225643066543803
Energy: 1.2554987868733924
Energy: 1.267557560162986
Energy: 1.3281727090694302
Energy: 1.3119025296367886
Energy: 1.2104149647933429
Energy: 1.211511759915304
Energy: 1.245917460680785
Energy: 1.335818558609296
Energy: 1.3116716319178532
Energy: 1.1931251391061888
Energy: 1.2085201059251838
Energy: 1.2364576885921368
Energy: 1.2382229257820139
Energy: 1.2634811055135804
Energy: 1.2488837613888535
Energy: 1.3164445814553292
Energy: 1.2568772555854482
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Energy: 1.262264410550661
Energy: 1.3423132666394046
Energy: 1.3159576092454175
Energy: 1.2614273135317406
Energy: 1.3334860885074709
Energy: 1.2836165020314476
Energy: 1.1778436016216942
Energy: 1.159543640821895
Energy: 1.2609451967696108
Energy: 1.4725189257808295
Energy: 1.2490343931068852
Energy: 1.209998844235802
Energy: 1.185593558346202
Energy: 1.2658442921960578
Energy: 1.4742289246121572
Energy: 1.1640417078358236
Energy: 1.1656650903008006
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Energy: 1.269231644109366
Energy: 1.357993045622475
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Energy: 1.1654864433615357
Energy: 1.1489993561677512
Energy: 1.2726915800904706
Energy: 1.3124029066095195
Energy: 1.1963804875285473
Energy: 1.1750205636063542
Energy: 1.155711184977933
Energy: 1.2489439241161893
Energy: 1.2222828118858124
Energy: 1.1495696253743837
Energy: 1.173327746054163
Energy: 1.1796708577579507
Energy: 1.2200222916930006
Energy: 1.2225607855298237
Energy: 1.2070638679970405
Energy: 1.3454946288018026
Energy: 1.2461050345250853
Energy: 1.3146000317412907
Energy: 1.257086775532251
Energy: 1.179702660690905
Energy: 1.248636733165417
Energy: 1.2460429577255014
Energy: 1.3104933344825718
Energy: 1.25128255431119
Energy: 1.2440048243563318
Energy: 1.231402540080341
Energy: 1.2477493881635813
Energy: 1.184017654612337
Energy: 1.1784277509506673
Energy: 1.2467131745651776
Energy: 1.4456030032673282
Energy: 1.1907299383028216
Energy: 1.184439112320242
Energy: 1.2530917603082163
Energy: 1.2576661321813916
Energy: 1.2621402043711398
Energy: 1.1739823702916552
Energy: 1.1774713128435665
Energy: 1.1654354623737013
Energy: 1.2910191157814992
Energy: 1.2689699275795292
Energy: 1.1705306204897943
Energy: 1.1941116939405672
Energy: 1.1654635329397542
Energy: 1.381046028513309
Energy: 1.2632036785204332
Energy: 1.1687011685085107
Energy: 1.1786529515920343
Energy: 1.2078243672381617
Energy: 1.3468512619973694
Energy: 1.262291353023357
Energy: 1.1743092204029475
Energy: 1.1895600481478956
Energy: 1.215928820370566
Energy: 1.2383980069865064
Energy: 1.271636326607903
Energy: 1.1714286104638043
Energy: 1.253387606644918
Energy: 1.2648097200009387
Energy: 1.2687102826089927
Energy: 1.221536563197914
Energy: 1.1722073077976414
Energy: 1.2581541555640698
Energy: 1.2644180276984773
Energy: 1.2505537950769785
Energy: 1.2174867706246006
Energy: 1.247410174265762
Energy: 1.143520699990537
Energy: 1.2133466915755673
Energy: 1.194102215775562
Energy: 1.2192607048669435
Energy: 1.191239465103634
Energy: 1.1424271232862184
Energy: 1.208084566886874
Energy: 1.3060894904600466
Energy: 1.3213903504100075
Energy: 1.312553752255575
Energy: 1.2468489538627074
Energy: 1.2278851163206346
Energy: 1.2337897973365564
Energy: 1.3217399534340522
Energy: 1.31226401768808
Energy: 1.2461658603998076
Energy: 1.218114373724882
Energy: 1.351307875125826
Energy: 1.3135319541762287
Energy: 1.3523279337199041
Energy: 1.2164527351848164
Energy: 1.1953070101112118
Energy: 1.264724136144722
Energy: 1.3156780663570415
Energy: 1.3396761515590219
Energy: 1.2160956856870684
Energy: 1.1947965683786037
Energy: 1.189890587277665
Energy: 1.1906532067717692
Energy: 1.4285419774611667
Energy: 1.2591670594431712
Energy: 1.3589848578054717
Energy: 1.1884924176519545
Energy: 1.1909851567897456
Energy: 1.429105885094577
Energy: 1.2724922403839267
Energy: 1.3534332633613646
Energy: 1.215236720446051
Energy: 1.437061909806761
Energy: 1.4266037846383322
Energy: 1.3561305461380422
Energy: 1.169803181367828
Energy: 1.2192544350062842
Energy: 1.437204466239203
Energy: 1.434512774496346
Energy: 1.3286951892556342
Energy: 1.1727842844508098
Energy: 1.1574326958311638
Energy: 1.245010032464165
Energy: 1.1700515171946961
Energy: 1.173620493616623
Energy: 1.1531272330031541
Energy: 1.152447072444463
Energy: 1.341264165823936
Energy: 1.1513120244359532
Energy: 1.1758466516433255
Energy: 1.1539554644128287
Energy: 1.2029798323085525
Energy: 1.284066904960847
Energy: 1.2514302198357445
Energy: 1.1601837627421672
Energy: 1.170534538700625
Energy: 1.2215520870895478
Energy: 1.3201823124892518
Energy: 1.2464304047751351
Energy: 1.1734886605027508
Energy: 1.1541366767818935
Energy: 1.2419472852232232
Energy: 1.2034037304964202
Energy: 1.2469875901720022
Energy: 1.2030544923599527
Energy: 1.2405306832075838
Energy: 1.2250119667917059
Energy: 1.2300484457343317
Energy: 1.2380017959477263
Energy: 1.206819812402161
Energy: 1.24111481681406
Energy: 1.1552119698099004
Energy: 1.1760159907050818
Energy: 1.2374574978954191
Energy: 1.4508642033870343
Energy: 1.1417719556051413
Energy: 1.1741992877223366
Energy: 1.17651579871135
Energy: 1.2365695256834985
Energy: 1.4609001850145686
Energy: 1.1411640927987283
Energy: 1.1567790763773809
Energy: 1.1823449689482373
Energy: 1.1545376576108526
Energy: 1.2112287343481907
Energy: 1.1709462611450385
Energy: 1.1684015884599879
Energy: 1.1883917947191438
Energy: 1.1636873099675873
Energy: 1.2233090043328834
Energy: 1.1571989171082537
Energy: 1.157444229260482
Energy: 1.292575783637698
Energy: 1.3427563804188178
Energy: 1.3434385194180172
Energy: 1.2538248111021906
Energy: 1.166830012476031
Energy: 1.218413734530541
Energy: 1.3437325675171756
Energy: 1.2452070453508668
Energy: 1.2386585903282055
Energy: 1.2493211353432183
Energy: 1.2601650115332468
Energy: 1.3054715827849481
Energy: 1.2443019374230966
Energy: 1.2038449149667998
Energy: 1.2527806285411311
Energy: 1.2387129789216642
Energy: 1.4739251352549119
Energy: 1.2274078798182995
Energy: 1.1651372503562758

minimum gb energy = 1.1390154125036975 eV
minimum distance =  2.33828228900274 Angstroms
sigma value = 437


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

Energy: 1.7119610218743284
Energy: 1.0856964815316599
Energy: 1.16230265502167
Energy: 1.2013701204061102
Energy: 1.0857456441215838
Energy: 1.7087576027784148
Energy: 1.162582049953861
Energy: 1.160822591646641
Energy: 1.2016360292594623
Energy: 1.0917203695739246
Energy: 1.1504258389613025
Energy: 1.231262884977609
Energy: 1.2003890198555653
Energy: 1.1998360649454314
Energy: 1.2490327985594283
Energy: 1.0856020629924412
Energy: 1.133507844863176
Energy: 1.2010544168866226
Energy: 1.2368118260291243
Energy: 1.3254558982269242
Energy: 1.0875848858121748
Energy: 1.0676734432192356
Energy: 1.2220057820941297
Energy: 1.0750128047256127
Energy: 1.2006463067932365
Energy: 1.088014715671823
Energy: 1.2070848211608147
Energy: 1.266450594353705
Energy: 1.0740795673145527
Energy: 1.19829328603582
Energy: 1.0730654651018345
Energy: 1.1244772984243043
Energy: 1.1556019851617814
Energy: 1.0912392339588728
Energy: 1.196390057186203
Energy: 1.0748707601488012
Energy: 1.1049842509519652
Energy: 1.1603639203454221
Energy: 1.0866393801664649
Energy: 1.1964829167741946
Energy: 1.0854999910169347
Energy: 1.1431195757473234
Energy: 1.111365132580696
Energy: 1.0797618336019512
Energy: 1.103972644018074
Energy: 1.0853081007992775
Energy: 1.1421535863726693
Energy: 1.119488914791228
Energy: 1.0760030894354937
Energy: 1.104166416600151
Energy: 1.100109563134654
Energy: 1.0724515904895937
Energy: 1.0659053022025138
Energy: 1.0877614893823826
Energy: 1.2185450741491104
Energy: 1.1189946373170605
Energy: 1.080453372874575
Energy: 1.114317362221225
Energy: 1.0901452367384767
Energy: 1.713585533124942
Energy: 1.0917357610980285
Energy: 1.1082656479479474
Energy: 1.136879621495393
Energy: 1.116812694902807
Energy: 1.1218424328847083
Energy: 1.0890397507167577
Energy: 1.1081167084450594
Energy: 1.1104613305827318
Energy: 1.1882342584397851
Energy: 1.1217475185266297
Energy: 1.0626509129141526
Energy: 1.0850567709689927
Energy: 1.081496424152407
Energy: 1.328697863989597
Energy: 1.2168635318425298
Energy: 1.0627630595585642
Energy: 1.0855913020813222
Energy: 1.0810544653238214
Energy: 1.3279913649150012
Energy: 1.2158281225683663
Energy: 1.0743612370581122
Energy: 1.3203906740320903
Energy: 1.1730242671292865
Energy: 1.3448373938868832
Energy: 1.07214488156454
Energy: 1.0738157271010043
Energy: 1.2197405434087965
Energy: 1.1736711227530598
Energy: 1.3451533732145704
Energy: 1.0716228833547337
Energy: 1.1687503422878949
Energy: 1.3016320623739175
Energy: 1.0678646242528875
Energy: 1.1708878857734397
Energy: 1.2291966351749837
Energy: 1.0963293941669006
Energy: 1.1598320837808713
Energy: 1.0655068176285647
Energy: 1.371586212392629
Energy: 1.0947643691105524
Energy: 1.0434069208483985
Energy: 1.0449272425008904
Energy: 1.1676575565285063
Energy: 1.2123278009616494
Energy: 1.015308762038761
Energy: 1.0456113754377148
Energy: 1.0174754265716934
Energy: 1.1686878542147179
Energy: 1.4190861255768705
Energy: 1.0749884906628442
Energy: 1.0411925377469708
Energy: 1.0426375316749628
Energy: 1.024295907668051
Energy: 1.1428128940658662
Energy: 1.0228447248723123
Energy: 1.042035999874216
Energy: 1.0201585775270825
Energy: 1.1734984314378198
Energy: 1.0945356449168642
Energy: 1.0237409042040528
Energy: 1.0287430472762662
Energy: 1.1496021516049437
Energy: 1.3254297394413284
Energy: 1.3229577554212746
Energy: 1.166779088711203
Energy: 1.0269164029768365
Energy: 1.1491095138911094
Energy: 1.3245973490884364
Energy: 1.3223510093427473
Energy: 1.1787788392624978
Energy: 1.2848993382132265
Energy: 1.1726608253045245
Energy: 1.238498422516189
Energy: 1.024466216621486
Energy: 1.0195974507384828
Energy: 1.219474090982396
Energy: 1.1719994714689108
Energy: 1.256162182057704
Energy: 1.0256626238645008
Energy: 1.167112766918464

minimum gb energy = 1.015308762038761 eV
minimum distance =  2.31525230680574 Angstroms
sigma value = 33