Model name: model_name=EAM_Dynamo_BonnyPasianotCastin_2009_FeCuNi__MO_469343973171_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.61492508649826
cohesive_energy=3.540501757109522
mass=63.546
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=[1.4503335478659178e-19, 2.22223501312434e-19, 2.80046056033494e-19, 3.2504959550592e-19, 3.61149839423208e-19, 3.90902259516588e-19, 4.1582411705845797e-19, 4.3683025490683195e-19, 4.548499355094299e-19, 4.70785184311194e-19, 4.8519996748729195e-19, 4.983185897664839e-19, 5.1020513821413e-19, 5.20874032419936e-19, 5.30350907210046e-19, 5.38661397410604e-19, 5.45832740024388e-19, 5.51890569877542e-19, 5.5686052179621e-19, 5.60782650196242e-19, 5.6370982690656e-19, 5.657045368158899e-19, 5.66843684402664e-19, 5.67205776321948e-19, 5.66827662636324e-19, 5.656132127477519e-19, 5.63423037289074e-19, 5.60084101183818e-19, 5.55375304056492e-19, 5.490194693494139e-19, 5.40660913849836e-19, 5.29836608510532e-19, 5.159601566834579e-19, 4.98304170176778e-19, 4.7599866707823e-19, 4.480166521654199e-19, 4.13100416780658e-19, 3.6956126675170797e-19, 3.1500074365747197e-19, 2.46059083096452e-19, 1.5817985493921538e-19, 4.5357139855549796e-20, -1.003036273009164e-19, -2.8979369867475e-19, -5.39513755379892e-19, -8.72691192950094e-19, -1.3218485948789219e-18, -1.9412773185861e-18, -2.8278097154773197e-18, -4.1517363334505395e-18, -6.214362510295799e-18, -9.631500857057339e-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: 4.9999999997e-06 eV

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

Energy: 0.015448590502061708
Energy: 0.10396468109238143
Energy: 0.10507612511339222
Energy: 0.10520939951782647
Energy: 0.019234951185344257
Energy: 0.016807195323170664
Energy: 0.10364226904931531
Energy: 0.1057962517836414
Energy: 0.10416416897726567
Energy: 0.018387593768245943
Energy: 0.10326592306125464
Energy: 0.10293930321498797
Energy: 0.1038667234923474
Energy: 0.10556508897679891
Energy: 0.10556663347277812
Energy: 0.10349445848465273
Energy: 0.10824502005218083
Energy: 0.10366240955962985
Energy: 0.105708723538252
Energy: 0.1049482214212552
Energy: 0.10595137941729521
Energy: 0.01913967535585234
Energy: 0.015954090867849758
Energy: 0.10369602570880616
Energy: 0.10448034011696808
Energy: 0.10535062860653104
Energy: 0.018477908070467466
Energy: 0.015958001200673772
Energy: 0.10340345879196303
Energy: 0.10517923608677614
Energy: 0.10454034440593132
Energy: 0.016904541214062416
Energy: 0.016833414887476833
Energy: 0.10656188644528668
Energy: 0.1039695693227163
Energy: 0.10496895567305771
Energy: 0.017242104361719048
Energy: 0.016177999814097763
Energy: 0.10410876619128166
Energy: 0.10361638846534028
Energy: 0.10401017237317826
Energy: 0.10475196959467208
Energy: 0.10639165414557143
Energy: 0.01734092818361114
Energy: 0.01611770069752393
Energy: 0.10397366501104056
Energy: 0.10461260507244004
Energy: 0.10582800458436983
Energy: 0.018382666800790898
Energy: 0.10418355254714859
Energy: 0.10624399557152214
Energy: 0.1036165793202183
Energy: 0.10438665689381975
Energy: 0.016586200411140305
Energy: 0.016012146332168572
Energy: 0.10647055179932989
Energy: 0.10313359091950415
Energy: 0.10501607367063812
Energy: 0.017214762999490422
Energy: 0.016154052835306854
Energy: 0.016047749538769602
Energy: 0.10628678390055334
Energy: 0.10444415537708439
Energy: 0.10487956107522615
Energy: 0.10695903491759443
Energy: 0.01993767541747844
Energy: 0.10699054207464279
Energy: 0.10429538162861866
Energy: 0.10573753563428054
Energy: 0.1066840323185625

minimum gb energy = 0.015448590502061708 eV
minimum distance =  2.51952406409002 Angstroms
sigma value = 3


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

Energy: 1.2973217140236495
Energy: 0.8643544018623935
Energy: 0.8873744319075153
Energy: 0.8738740109801865
Energy: 0.845589605704721
Energy: 0.8811364961077435
Energy: 0.8490883821580023
Energy: 0.8891204537831311
Energy: 0.8894327803420299
Energy: 0.8699903486479765
Energy: 0.8547132980254805
Energy: 0.9587937679305171
Energy: 0.8948119535191905
Energy: 0.7793827252749485
Energy: 0.685857086588147
Energy: 0.684931217357244
Energy: 0.9100038435614192
Energy: 0.8888809226608592
Energy: 0.7781593161419811
Energy: 0.7878132667339269
Energy: 0.8939942911041246
Energy: 0.9261976733159974
Energy: 0.757545168907694
Energy: 0.6844842281515147
Energy: 0.6846840250788515
Energy: 0.6841282747898233
Energy: 0.8163994852439888
Energy: 0.7574474444224418
Energy: 0.7469920846461511
Energy: 0.8376410146001894
Energy: 0.7468807364761078
Energy: 0.9593859595008104
Energy: 0.8667118977379186
Energy: 0.6841376294620576
Energy: 0.6839735408866101
Energy: 0.6840768762891595
Energy: 0.8921682251249773
Energy: 0.8671660150334112
Energy: 0.7908197319234063
Energy: 0.8379347489161323
Energy: 0.9303397590656766
Energy: 0.8716927512189027
Energy: 0.87442075733832
Energy: 0.7215577046215954
Energy: 0.7293251428906534
Energy: 0.8803018678089929
Energy: 0.8320306728948125
Energy: 0.8749807402625875
Energy: 0.966325726170066
Energy: 0.7574791897228939
Energy: 0.8341609677998498
Energy: 0.8711684815276376
Energy: 0.8718402713325348
Energy: 0.7887601784769068
Energy: 0.721254091049666
Energy: 0.8732058760372156
Energy: 0.8706070246140447
Energy: 0.9459388298018142
Energy: 0.7879554031424353
Energy: 0.913369317680709
Energy: 0.9125027558376313
Energy: 0.8940377066515668
Energy: 0.9147375344053581
Energy: 0.7210501808523386
Energy: 0.9019222026830308
Energy: 0.9083301106042743
Energy: 0.9044523203263537
Energy: 0.7954724791908716
Energy: 0.7217076675197007
Energy: 0.9103251739832916
Energy: 0.9146898556735688
Energy: 0.8955106130396734
Energy: 0.9184435043075866
Energy: 0.778053213302532
Energy: 0.9062883468958133
Energy: 0.9092215704607988
Energy: 0.9058858268946479
Energy: 0.9018044334095081
Energy: 0.8698969458505728
Energy: 0.906236877295922
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Energy: 0.8106338079947402
Energy: 0.7237128983917005
Energy: 0.9001715130962007
Energy: 0.895053931833017
Energy: 0.9805505061729852
Energy: 0.8044614072964897
Energy: 0.7555196439144747
Energy: 0.9562819630293529
Energy: 0.907326179573271
Energy: 0.9657368701269472
Energy: 0.7223853687916023
Energy: 0.7916078347934722
Energy: 0.8157355932065067
Energy: 0.7553834935179546
Energy: 0.7404008101249301
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Energy: 0.7996120944606215
Energy: 0.7612545018846073
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Energy: 0.7849191579053572
Energy: 0.7891901551471991
Energy: 0.825392537243423
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Energy: 0.7544105607337225
Energy: 1.0007833396212322
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Energy: 0.9845328967531799
Energy: 0.9057625995870774
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Energy: 0.7266549810376914
Energy: 0.8470955731711225
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Energy: 0.9826268063258371
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Energy: 0.7208116087117423
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Energy: 0.9184359113760537
Energy: 0.8759418815560956
Energy: 0.8595562924005571
Energy: 0.9091059070618493
Energy: 0.9075671892767209
Energy: 0.9058290596640787
Energy: 0.8187321729620766
Energy: 0.7242870519825083
Energy: 0.9092039557770654
Energy: 0.9146604438028167
Energy: 0.8355605212990438
Energy: 0.8987568640145381
Energy: 0.8961882624985275
Energy: 0.9099117110947883
Energy: 0.9014945394032033
Energy: 0.897932783580319
Energy: 0.8970975413668912
Energy: 0.8967852782718583
Energy: 0.9094127507524928
Energy: 0.9032666114870009
Energy: 0.9030857163490723
Energy: 0.7764756786269201
Energy: 0.9967878677619159
Energy: 0.911805178413575
Energy: 0.9029424040969893
Energy: 0.7235596244609581
Energy: 0.7462817016461117
Energy: 0.9132558130901756
Energy: 0.9159028378588159
Energy: 0.9118366820219768
Energy: 0.7228295184392973
Energy: 0.8652569662831949
Energy: 0.817717711901721
Energy: 0.7589483900601278
Energy: 0.7814966104996751
Energy: 0.7186309420882966
Energy: 0.7575502087915116
Energy: 0.7553480595808921
Energy: 0.7670956251935854
Energy: 0.7597460276022909
Energy: 0.8495122687199138
Energy: 0.8235442682775274
Energy: 0.7650045499019014
Energy: 0.7582564755511872
Energy: 0.7532865459417577
Energy: 0.7803285823917561
Energy: 0.7185026883755447
Energy: 0.764794604915772
Energy: 0.759190408235721
Energy: 0.8169073407456904
Energy: 0.8035262569677409
Energy: 0.9297408493637287
Energy: 0.9120040837546718
Energy: 0.8875864667186231
Energy: 0.9010944353005714
Energy: 0.7213843138973324
Energy: 0.9268367999593596
Energy: 0.9160665544600796
Energy: 0.8733082259024846
Energy: 0.7876760705841769
Energy: 0.8217162924621909
Energy: 0.9175990342474208
Energy: 0.922850290430327
Energy: 0.9389819263142568
Energy: 0.7895088793422901
Energy: 0.9398776700825879
Energy: 0.8310787754586227
Energy: 0.9235848733313079
Energy: 0.9445720456533544
Energy: 0.8933119147624817
Energy: 0.8724899859275906
Energy: 0.9143169406526273
Energy: 0.9260413523988219
Energy: 0.8853146090639165
Energy: 0.7219754108592957
Energy: 0.9041546758630077
Energy: 0.911359984992405
Energy: 0.9834460992832769
Energy: 0.8998460287676909
Energy: 0.7194756833926936
Energy: 0.9086048871099364
Energy: 0.916166929633265
Energy: 0.9114317534921996
Energy: 0.8404820687192713
Energy: 0.791309326066259
Energy: 0.902574231788316
Energy: 0.9093057947653819
Energy: 0.8981132959693311
Energy: 0.8181947503732357
Energy: 0.7814605015683896
Energy: 0.9057798777986961
Energy: 0.9847553281080129
Energy: 0.8072507680519029
Energy: 0.7581489201734412
Energy: 0.7976827428144883
Energy: 0.8948826117190143
Energy: 0.9788011787694961
Energy: 0.8020144726443709
Energy: 0.7565687860148728
Energy: 0.7951171930422202
Energy: 0.909052484291528
Energy: 0.8184384134351091
Energy: 0.8584528945239042
Energy: 0.7207007755089826
Energy: 0.819964004258157
Energy: 0.7541513935358543
Energy: 0.826765057261277
Energy: 0.7258000756522044
Energy: 0.7196811265107182
Energy: 0.8029840568326364
Energy: 0.7539403579928404
Energy: 0.8173366794527297
Energy: 0.7902001922985801
Energy: 0.7214799235376617
Energy: 0.8262030987349765
Energy: 0.7621171850092096
Energy: 0.7788181020243525
Energy: 0.7848799176665227
Energy: 0.7238585940854954
Energy: 0.7811838662025147
Energy: 0.753848515209764
Energy: 0.7464841609047966
Energy: 0.7969784272794156
Energy: 0.7254015781872606
Energy: 0.9203313794130019
Energy: 0.8837563653905292
Energy: 0.7685935285258577
Energy: 0.6893995283287667
Energy: 0.7969615796789417
Energy: 0.9846057015181745
Energy: 0.8917321996405301
Energy: 0.992326605029472
Energy: 0.8942576016608373
Energy: 0.8740194303893607
Energy: 0.9235863803578426
Energy: 0.9167573787703469
Energy: 0.6887780860440822
Energy: 0.6848871904103299
Energy: 0.8100042003648611
Energy: 0.9244298576151662
Energy: 0.9177671105139561
Energy: 0.8490901501778325
Energy: 0.8443722214369931
Energy: 0.8871090921089341
Energy: 0.8871715987117593
Energy: 0.8472262281670752
Energy: 0.6892643534264751
Energy: 0.6867545506224315
Energy: 0.9635937653780354
Energy: 0.8788446514499779
Energy: 0.9044059554967548
Energy: 0.8732423744128925
Energy: 0.849804700032395
Energy: 0.889969772358032
Energy: 0.8631640039412088
Energy: 0.8457069843785495
Energy: 0.8443448681936744
Energy: 0.8489212374743504
Energy: 0.8878527379939247
Energy: 0.872566757444274
Energy: 0.8337218156306733

minimum gb energy = 0.6839735408866101 eV
minimum distance =  2.23134929426502 Angstroms
sigma value = 75


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

Energy: 1.7379682874252438
Energy: 0.8316893658667813
Energy: 0.8320705315019246
Energy: 0.8365970538281576
Energy: 0.960890859715128
Energy: 0.8232272920223195
Energy: 0.8264116328059171
Energy: 0.8692125152470955
Energy: 0.8435974112936075
Energy: 0.9600493665634802
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Energy: 0.8519958300996586
Energy: 0.8692865778602303
Energy: 0.8441197060787893
Energy: 0.8289266562162403
Energy: 0.8252967979606026
Energy: 0.8902362026958069
Energy: 0.8132800074056609
Energy: 0.8884167099713319
Energy: 0.869622792269887
Energy: 0.9325943064355434
Energy: 1.047649047129212
Energy: 0.8862776589996237
Energy: 0.8779121886626424
Energy: 0.9063736770037523
Energy: 0.8474706751434646
Energy: 0.9132235015965626
Energy: 0.8844273825947832
Energy: 0.8733016846290022
Energy: 0.8200936801668344
Energy: 0.8966271687233258
Energy: 0.8792449871870355
Energy: 0.8749523438692727
Energy: 0.8360413407707106
Energy: 0.8276135194330604
Energy: 0.9082370260654802
Energy: 0.8510530320174908
Energy: 0.8534482768542334
Energy: 0.9004783397769399
Energy: 0.9079573478236843
Energy: 0.846530419592602
Energy: 0.8476148011602234
Energy: 1.0110398251986488
Energy: 0.8672312651810047
Energy: 0.8100878378167226
Energy: 0.8581107716915073
Energy: 0.8211449995649147
Energy: 0.9926391847911076
Energy: 0.8661118965517538
Energy: 0.8651438018486397
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Energy: 0.8719690040877314
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Energy: 0.8543138368096785
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Energy: 0.8293021330759938
Energy: 0.8833587794291851
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Energy: 0.8470098026895799
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Energy: 0.9077326282451117
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Energy: 0.8461232900694311
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Energy: 0.8616079088552235
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Energy: 0.8577029756628636
Energy: 0.852837905739883
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Energy: 0.877456595118492
Energy: 0.8824226175709114
Energy: 0.8795935793530207
Energy: 0.8480440154667565
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Energy: 0.8896822310464985
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Energy: 0.8948326631860861
Energy: 0.8562193365222729
Energy: 0.8921523951761052
Energy: 0.9042453111766875
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Energy: 0.8619005092923713
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Energy: 0.8872206134064319
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Energy: 0.8730824720707563
Energy: 0.9112247352445876
Energy: 0.8671161488869068
Energy: 0.854616839854287
Energy: 0.8635018250834133
Energy: 1.014226623896171
Energy: 0.8902858787154528
Energy: 0.87243205083136
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Energy: 0.8632117226258198
Energy: 1.0162380947997787
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Energy: 0.8781752429187872
Energy: 0.8637135516443475
Energy: 0.8547770842000598
Energy: 0.8666735631488727
Energy: 1.0395627384241288
Energy: 0.8921941657604651
Energy: 0.8620858199068978
Energy: 0.8462444771968104
Energy: 0.8706045625539484
Energy: 0.9155096546714313
Energy: 0.8779037060796533
Energy: 0.8768656279472915
Energy: 0.915018595705667
Energy: 0.8241575892465447
Energy: 0.912711372776184
Energy: 0.8724900106833476
Energy: 0.8369401400894325
Energy: 0.8443651040102504
Energy: 0.8310011774867775
Energy: 0.9030783039539371
Energy: 0.9151962763059937
Energy: 0.8961821420050973
Energy: 0.9375751336154916
Energy: 0.8469861055721511
Energy: 0.9392767093595392
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Energy: 0.8384658690477587
Energy: 0.8685026814829883
Energy: 0.9128710452744768
Energy: 0.8522887865598325
Energy: 0.8741574413300557
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minimum gb energy = 0.8080768871311669 eV
minimum distance =  2.28065304028983 Angstroms
sigma value = 105


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

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Energy: 0.8736353732329974
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Energy: 0.8770549760951407
Energy: 0.8754505467213002
Energy: 0.8933453351045799
Energy: 0.8651876056013117
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Energy: 0.8569023749522399
Energy: 0.9432289334403625
Energy: 0.9360417362311504
Energy: 0.943953364760515
Energy: 0.8857839534784842
Energy: 0.8633136283636783
Energy: 0.9631204935595297
Energy: 0.9348473141406708
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Energy: 0.9224386226362914
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Energy: 0.9325989971701836
Energy: 0.9165618777511015
Energy: 0.9267220796565917
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Energy: 0.9001571092119557
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Energy: 0.8789895672150535
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Energy: 0.8746523987340383
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Energy: 0.9057428899825596
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Energy: 0.8765897919099331
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Energy: 0.9286828822261425
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Energy: 0.8592704672377959
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Energy: 0.9268490509895566
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Energy: 0.9320104309915772
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Energy: 0.924500012847242
Energy: 0.8513973550110099
Energy: 0.9359504138824956
Energy: 0.9267629182147944
Energy: 0.9295025230358896
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Energy: 0.8562669013866048
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Energy: 0.9241339725781341
Energy: 0.9225712793176838
Energy: 0.8602871870410839
Energy: 0.9722819995172579
Energy: 0.9443547802556379
Energy: 0.9089089606534564
Energy: 0.9230316531193342
Energy: 0.8633545309344424
Energy: 0.9460854952790073
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Energy: 0.9430777727728911
Energy: 0.9431781368969847
Energy: 0.9011321597411548
Energy: 0.971520468432252
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Energy: 0.8668951574763688
Energy: 0.8770682889962308
Energy: 0.925983365259619
Energy: 0.9502110348089131
Energy: 0.8750802720397134
Energy: 0.862078593820034
Energy: 0.869346709427767
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Energy: 0.8884553103261819
Energy: 0.8567079347756097
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Energy: 0.8571970918031722
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Energy: 0.8822538556024859
Energy: 0.857012427880944
Energy: 0.8564276373657886
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Energy: 0.8647829665589242
Energy: 0.8895874687099252
Energy: 0.849905595502439
Energy: 0.9800113947192133
Energy: 0.8373098786310454
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Energy: 0.8899278600646956
Energy: 0.8714313387743492
Energy: 0.9195677604436223
Energy: 0.9296486494869384
Energy: 0.8606883254079104
Energy: 0.8616639886470189
Energy: 0.9082764659615472
Energy: 0.9128837391170825
Energy: 0.8921570849448853
Energy: 0.9644586429586792
Energy: 0.8621937416884172
Energy: 0.9735322031832323
Energy: 0.9318168021248825
Energy: 0.9272342933319053
Energy: 0.8759306797431398
Energy: 0.8533383426031629
Energy: 0.9131312512150654
Energy: 0.9148595605415812
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Energy: 0.8732180250223388
Energy: 0.9202133999568185
Energy: 0.896232942417076
Energy: 0.8771773014556249
Energy: 0.8727571434078866
Energy: 0.8681144907835502
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Energy: 0.945827292164367
Energy: 0.8816108638312646
Energy: 0.8746902464140226
Energy: 0.8815836704724852
Energy: 0.8792396289777539
Energy: 0.9366786318396383
Energy: 0.9193988051142352
Energy: 0.8607513612755742
Energy: 0.8744908669417883
Energy: 0.879387854937093
Energy: 0.8510600633321062
Energy: 0.9131385482604325
Energy: 0.8792940458013117
Energy: 0.8762839503926517
Energy: 0.8767591560577092
Energy: 0.9015524575008181
Energy: 0.9543052629044936
Energy: 0.8409017297071038
Energy: 0.8709838142124755
Energy: 0.9185302548932652
Energy: 0.9231529199499712
Energy: 0.9696743097252615
Energy: 0.8846374575783755
Energy: 0.8893799865144626
Energy: 0.9239587435734663
Energy: 0.9108316469190811
Energy: 0.8720311291717575
Energy: 0.9132947804837258
Energy: 0.9181580750902564
Energy: 0.8537801677511313
Energy: 0.9625975038155404
Energy: 0.8611305235148834
Energy: 0.9285391746325322
Energy: 0.9175134172219245
Energy: 0.8674768026297534
Energy: 0.9434073673346979
Energy: 0.911528207508295
Energy: 0.9133789943113403
Energy: 0.9257864997762267
Energy: 0.8581862688419369
Energy: 0.935563124093865
Energy: 0.843096827519483
Energy: 0.9129081812067882
Energy: 0.9260940074663895
Energy: 0.8579924654926486
Energy: 0.9078940492431488
Energy: 0.9342151875068214
Energy: 0.9139971980855137
Energy: 0.9194465355235236
Energy: 0.8867376130532378
Energy: 0.9416949191260124
Energy: 0.9433303105452334
Energy: 0.9170054210950114
Energy: 0.919541052810967
Energy: 0.8969025193864392
Energy: 0.941638065209759
Energy: 0.945740204993166
Energy: 0.9239451641889829
Energy: 0.9016339491800155
Energy: 0.9168230670689466
Energy: 0.9128697178946786
Energy: 0.9307984210663143
Energy: 0.9239077274861166
Energy: 0.8703378465262477
Energy: 0.9170292927366284
Energy: 0.9135640728956093
Energy: 0.9178012784647951
Energy: 0.9317330024519833
Energy: 0.9334801160251421
Energy: 0.9187795491593844
Energy: 0.9224327355036491
Energy: 0.9202388267448394
Energy: 0.924091754187653
Energy: 0.9190825440008895
Energy: 0.9364117436539849
Energy: 0.8960251288590767
Energy: 0.9520079678952441
Energy: 0.8721284630073953
Energy: 0.9276167543113729
Energy: 0.9290510843104393
Energy: 0.851185026290644
Energy: 0.9182947340789338
Energy: 0.8349074103504746
Energy: 0.9239081640200321
Energy: 0.924536943862722
Energy: 0.8819714927462001
Energy: 0.8707525159361247
Energy: 0.8762109606308086
Energy: 0.9178792800543978
Energy: 0.9185798089117528
Energy: 0.854707147921256
Energy: 0.9135248856592089
Energy: 0.8779243940210708
Energy: 0.921509576379193
Energy: 0.9217999919047714
Energy: 0.9089929884198688
Energy: 0.9527838491129108
Energy: 0.9422688656157634
Energy: 0.9353300344796701
Energy: 0.934459473123948
Energy: 0.9655228673752553
Energy: 0.8915117517456395
Energy: 0.9422169011156152
Energy: 0.9612220156948458
Energy: 0.9337178708545312
Energy: 0.9542940677631115
Energy: 0.925640880759727
Energy: 0.8548025180178903
Energy: 0.8603044898410906
Energy: 0.8539906829881095
Energy: 0.9373022750872444
Energy: 0.8389619564249629
Energy: 0.8490090192568875
Energy: 0.8497128658922352
Energy: 0.8418456831773254
Energy: 0.8954588274172198
Energy: 0.8778205455675021
Energy: 0.8481148599597215
Energy: 0.8488918118109959
Energy: 0.8481773924062888
Energy: 0.8481540561282744
Energy: 0.8456774496709889
Energy: 0.8486966372089526
Energy: 0.8599655128447964
Energy: 0.8483919970379327
Energy: 0.920339825932561

minimum gb energy = 0.8347092643512966 eV
minimum distance =  2.28176217886436 Angstroms
sigma value = 165


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

Energy: 1.1252586604130117
Energy: 0.8182843804205747
Energy: 0.8173684335200511
Energy: 0.8651981254430089
Energy: 0.8091388816466466
Energy: 1.124328214220035
Energy: 0.8186939922855391
Energy: 0.817623738703818
Energy: 0.8655589655756613
Energy: 0.8089970471695043
Energy: 0.8583518630421678
Energy: 0.858892355693054
Energy: 0.8700734014388155
Energy: 0.8601269213504403
Energy: 0.8601222536928864
Energy: 0.8590027976720419
Energy: 0.8579263654534389
Energy: 0.8667485641139626
Energy: 0.8607522269461412
Energy: 0.9066786716312235
Energy: 0.8646993529265949
Energy: 0.9072499719793365
Energy: 0.8172083984815859
Energy: 0.817975318268471
Energy: 0.8940380586241592
Energy: 0.8636694395627614
Energy: 0.8191954933311453
Energy: 0.8650294798883098
Energy: 0.8661121643732691
Energy: 0.8936365126153132
Energy: 0.8083413870072773
Energy: 0.8635900596818108
Energy: 0.8641068428804538
Energy: 0.8181749227470322
Energy: 0.8083024751001364
Energy: 0.8183019843235658
Energy: 0.8676172011161368
Energy: 0.8640112867932658
Energy: 0.8173974109786173
Energy: 0.8924141834140183
Energy: 0.8582891723368439
Energy: 0.8777945358742524
Energy: 0.8589411228756848
Energy: 0.8567050816470162
Energy: 0.8580154661900058
Energy: 0.8662952819765672
Energy: 0.8138209775150691
Energy: 0.8584216047628198
Energy: 0.85809417664574
Energy: 0.8587557028929637
Energy: 0.8620716031815213
Energy: 0.8620819403606477
Energy: 0.8181319133770664
Energy: 0.8130000862133531
Energy: 0.8214514091925338
Energy: 0.8621086616642024
Energy: 0.8621759407798091
Energy: 0.8186277422343089
Energy: 0.8113424964019648
Energy: 0.8215353881094435
Energy: 0.8562357232355253
Energy: 0.856892907204749
Energy: 0.8598582970307597
Energy: 0.8169129370742902
Energy: 0.8650258779747276
Energy: 0.9105953898096413
Energy: 0.8749208235185717
Energy: 0.8586674528446064
Energy: 0.8171981779253837
Energy: 0.8652984624037221
Energy: 0.8726759534284234
Energy: 0.856869120293133
Energy: 0.8570162251738364
Energy: 0.8569789393903575
Energy: 0.8580446320578051
Energy: 0.8133848238449135
Energy: 0.8566939231204063
Energy: 0.8567871309174784
Energy: 0.8571471563525461
Energy: 0.8113667394087615
Energy: 0.8153099264202941
Energy: 0.8577767284832323
Energy: 0.8178339330005153
Energy: 0.8570658110592422
Energy: 0.857758814607547
Energy: 0.8155868580060489
Energy: 0.8215882635565368
Energy: 0.8178036533684043
Energy: 0.857021884000808
Energy: 0.89264113267723
Energy: 0.9068110977370487
Energy: 0.8664907632407272
Energy: 0.871040841756277
Energy: 0.8641799111474081
Energy: 0.8571371265856903
Energy: 0.9059897071371911
Energy: 0.8647523804089841
Energy: 0.8656523942108475
Energy: 0.8654205103345627
Energy: 0.8590509730834964
Energy: 0.8945771782652601
Energy: 0.8635162302451478
Energy: 0.8640996545423963
Energy: 0.8635444813922744
Energy: 0.8974027563776251
Energy: 0.8653471756398203
Energy: 0.8641777385987272
Energy: 0.864688020247766
Energy: 0.8639718572393649
Energy: 0.9108483400033274
Energy: 0.8663260847709741
Energy: 0.8644557554782616
Energy: 0.8658351288026405
Energy: 0.8634672048243558
Energy: 0.8706816763965239
Energy: 0.8657235253707567
Energy: 0.8598326349964782
Energy: 0.8654382630956952
Energy: 0.863383176309266
Energy: 0.8707444306085874
Energy: 0.8643661337193715
Energy: 0.81407865535331
Energy: 0.8211367134460027
Energy: 0.8585194535300974
Energy: 0.816756500561282
Energy: 0.8145042181523919
Energy: 0.8622754754799637
Energy: 0.8586354111339158
Energy: 0.8595603465915598
Energy: 0.8167317492424829
Energy: 0.8603222702829298
Energy: 0.8616516987197922
Energy: 0.8554566165229295
Energy: 0.8123980687620516
Energy: 0.8579520597527459
Energy: 0.9072679041185645
Energy: 0.8624863109748014
Energy: 0.8197691107116609
Energy: 0.8096903234122752
Energy: 0.8568427780928617
Energy: 0.81024570945434
Energy: 0.8596337480852017
Energy: 0.865040770750575
Energy: 0.8183010524871276
Energy: 0.857773640149717
Energy: 0.8661817673097564
Energy: 0.8604359563108854
Energy: 0.8656429676656255
Energy: 0.8181450426830705
Energy: 0.8581599881021448

minimum gb energy = 0.8083024751001364 eV
minimum distance =  2.30954108612994 Angstroms
sigma value = 41


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

Energy: 0.8642691579397298
Energy: 0.7489353940803946
Energy: 0.7484895418005681
Energy: 0.7430066825394133
Energy: 0.7332859792078993
Energy: 0.799699038189386
Energy: 0.7493186357776674
Energy: 0.7497685238018352
Energy: 0.7453866218902684
Energy: 0.7508244311479123
Energy: 0.808787013792633
Energy: 0.7587959009462785
Energy: 0.7511642776074051
Energy: 0.7569787844150274
Energy: 0.7927868659272979
Energy: 0.8067833611100509
Energy: 0.7420219806982775
Energy: 0.7584924995308604
Energy: 0.7594534095809008
Energy: 0.8144769496130541
Energy: 0.7673033245087054
Energy: 0.7890138316899935
Energy: 0.7963726471965733
Energy: 0.7711181966997813
Energy: 0.7696296270916816
Energy: 0.7762614986177954
Energy: 0.7672455146509846
Energy: 0.7992103983407746
Energy: 0.7796541037888561
Energy: 0.7756840692243202
Energy: 0.8080663903224784
Energy: 0.7522676204880409
Energy: 0.7912375623926007
Energy: 0.7817159393249639
Energy: 0.8785019623660555
Energy: 0.8046127613355194
Energy: 0.7569351753701263
Energy: 0.7690437144364773
Energy: 0.7833393191237291
Energy: 0.9206600335919084
Energy: 0.8051050960375044
Energy: 0.786364006215335
Energy: 0.7897198106474111
Energy: 0.799699852227702
Energy: 0.7898324367915835
Energy: 0.7483011490940965
Energy: 0.7667540132121791
Energy: 0.7701398349779345
Energy: 0.8004173870435352
Energy: 0.816578947799497
Energy: 0.7864783664876104
Energy: 0.7823019398926047
Energy: 0.7898487672648065
Energy: 0.7503278398231238
Energy: 0.8073179287558065
Energy: 0.7853239715661586
Energy: 0.7847580124642264
Energy: 0.7891281743099264
Energy: 0.7858126811963857
Energy: 0.841140252316163
Energy: 0.8128071121694399
Energy: 0.806230613498634
Energy: 0.7887980118773777
Energy: 0.765550592219088
Energy: 0.7999809004189974
Energy: 0.8153615189170302
Energy: 0.7927639854479211
Energy: 0.78945855987766
Energy: 0.7976006614572698
Energy: 0.8007939733915068
Energy: 0.7481453664426768
Energy: 0.7847459365160264
Energy: 0.7846527104522648
Energy: 0.7577860983914133
Energy: 0.7798287498214311
Energy: 0.7894741994960783
Energy: 0.7838832999227755
Energy: 0.7867861992653014
Energy: 0.762405900452594
Energy: 0.7966630777534132
Energy: 0.7513188286589404
Energy: 0.7695748000754361
Energy: 0.7782178292347446
Energy: 0.7789433098163111
Energy: 0.7846397396481619
Energy: 0.7490814719447779
Energy: 0.7839075558572233
Energy: 0.752254019139793
Energy: 0.7872628149664802
Energy: 0.7841718439995563
Energy: 0.8110712729453682
Energy: 0.7580467289339985
Energy: 0.7591005661440242
Energy: 0.774899698708122
Energy: 0.8097532726723543
Energy: 0.7704911864834714
Energy: 0.7653788511521755
Energy: 0.7605554779507836
Energy: 0.7729224345425273
Energy: 0.808916286327688
Energy: 0.7474316956204122
Energy: 0.7585249514988243
Energy: 0.7670276346195102
Energy: 0.7667042440696976
Energy: 0.7927140794824606
Energy: 0.7500337638389882
Energy: 0.7585530681049182
Energy: 0.7628569069711583
Energy: 0.7691413091891995
Energy: 0.8913248629962763
Energy: 0.7779879619771816
Energy: 0.7779911931102143
Energy: 0.7812478494487112
Energy: 0.7573914414238894
Energy: 0.8065522195142724
Energy: 0.7773099111361755
Energy: 0.7776554628053577
Energy: 0.7466548294514416
Energy: 0.7580303588376996
Energy: 0.8052289176825667
Energy: 0.7631420236682179
Energy: 0.7600345323784357
Energy: 0.7454050302969571
Energy: 0.7790563215042153
Energy: 0.7820034508411521
Energy: 0.7631618987760912
Energy: 0.7631288968010722
Energy: 0.7472541386934984
Energy: 0.7984499788686028
Energy: 0.7818192900452714
Energy: 0.7666551523285441
Energy: 0.7678376039570177
Energy: 0.7620258384521571
Energy: 0.7496559477664787
Energy: 0.7806601689541993
Energy: 0.7654233392715463
Energy: 0.7687086894050733
Energy: 0.7770164090569127
Energy: 0.799014877220736
Energy: 0.7826828117817279
Energy: 0.780133167782623
Energy: 0.7700332295241737
Energy: 0.7601769158930375
Energy: 0.8183409093073787
Energy: 0.7852155057189028
Energy: 0.7628712827113738
Energy: 0.771920543414117
Energy: 0.7593794157913448
Energy: 0.8021035567484355
Energy: 0.7735075433298676
Energy: 0.7877891740686989
Energy: 0.7998758379564955
Energy: 0.7834367793701933
Energy: 0.7861523119153477
Energy: 0.8012915376609567
Energy: 0.7891677115505548
Energy: 0.8018338110647588
Energy: 0.7672982546091106
Energy: 0.7856729193887728
Energy: 0.7999164877537802
Energy: 0.790613195397202
Energy: 0.7851094944082463
Energy: 0.7813339521022061
Energy: 0.779925778932522
Energy: 0.787707786736685
Energy: 0.7910943014929793
Energy: 0.7850359404011358
Energy: 0.7740327351339269
Energy: 0.7838618560367425
Energy: 0.7576731009019415
Energy: 0.7858791011791368
Energy: 0.8012841547976883
Energy: 0.815515097270885
Energy: 0.8073797536886008
Energy: 0.7639896424659629
Energy: 0.7862762631126035
Energy: 0.7888712868700923
Energy: 0.8038135741884557
Energy: 0.8123571166196093
Energy: 0.7722630934876495
Energy: 0.821578427620453
Energy: 0.7981717334126698
Energy: 0.8191699978852625
Energy: 0.8071298848282579
Energy: 0.8675519088963431
Energy: 0.8275416146784726
Energy: 0.8094656257831618
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Energy: 0.7794233340808668
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Energy: 0.7426697620693669
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Energy: 0.7680384224172452
Energy: 0.7665769482876663
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Energy: 0.7645959433808873
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Energy: 0.8039811606042239
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Energy: 0.8021179201122697
Energy: 0.803683905490525
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Energy: 0.7637098211407498
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Energy: 0.8009895287366328
Energy: 0.8012784365430888
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Energy: 0.7644471570347393
Energy: 0.7955041067579045
Energy: 0.7542188833553854
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Energy: 0.8012366315375808
Energy: 0.7910612471566232
Energy: 0.7540035431441954
Energy: 0.8071619710668128
Energy: 0.7938186883465854
Energy: 0.7861944785822064
Energy: 0.7848013620650004
Energy: 0.7530329702998333
Energy: 0.8024537369582331
Energy: 0.8087666059926197
Energy: 0.7857973262820838
Energy: 0.7857329907452695
Energy: 0.7637784300045336
Energy: 0.7958207832737614
Energy: 0.8026631639876805
Energy: 0.7629303977417906
Energy: 0.7596904829590357
Energy: 0.7425855767068554
Energy: 0.8003433670685666
Energy: 0.8006718090858851
Energy: 0.7805155578051622
Energy: 0.7709056206431356
Energy: 0.7971811997198447
Energy: 0.7858219433394055
Energy: 0.7876880642429015
Energy: 0.7765921593798389
Energy: 0.7465236308094283
Energy: 0.7849131556764092
Energy: 0.7873331713804996
Energy: 0.7983958151928577
Energy: 0.7770332932198135
Energy: 0.7664823668023334
Energy: 0.7856895504149084
Energy: 0.8155388428029903
Energy: 0.7367042475238038
Energy: 0.7381469470450378
Energy: 0.7575416829745689
Energy: 0.772334825600747
Energy: 0.8242760347871583
Energy: 0.760966348785446
Energy: 0.7589827461302966
Energy: 0.7381875218211884
Energy: 0.7413989506921728
Energy: 0.7580442251484378
Energy: 0.7422473137066817
Energy: 0.7457756816626298
Energy: 0.7471905856883556
Energy: 0.7419451414565066
Energy: 0.7849461248402504
Energy: 0.7470978507654412
Energy: 0.764863781986565
Energy: 0.759099878151829
Energy: 0.7541777707629002
Energy: 0.8216715355962438
Energy: 0.7529496193515216
Energy: 0.7471374709009496
Energy: 0.752902177841883
Energy: 0.7621946630540635
Energy: 0.7958465496251217
Energy: 0.7599402665940403
Energy: 0.7586286818871049
Energy: 0.7613676816792991
Energy: 0.7748660793019864
Energy: 0.7421010457564449
Energy: 0.7622028349420729
Energy: 0.7594117603763963
Energy: 0.7534315820943659
Energy: 0.7534114878828286
Energy: 0.7426209619784809
Energy: 0.7520034012941875
Energy: 0.7481076256247314
Energy: 0.7773440570317922

minimum gb energy = 0.7332859792078993 eV
minimum distance =  2.33662901860352 Angstroms
sigma value = 185


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

Energy: 0.3263343687557992
Energy: 0.4035295597241208
Energy: 0.3485294745927906
Energy: 0.35425602705839004
Energy: 0.3288623609753361
Energy: 0.3271378052396757
Energy: 0.36562331486922683
Energy: 0.3696578427151788
Energy: 0.35259203437591674
Energy: 0.32819749727351644
Energy: 0.3478609920649995
Energy: 0.3524676887759859
Energy: 0.36807841446368605
Energy: 0.3628367575635421
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Energy: 0.3544625814892557
Energy: 0.3483415440976418
Energy: 0.36810468221875087
Energy: 0.3618933151048496
Energy: 0.3451070165440686
Energy: 0.3475498877972588
Energy: 0.3655748936362428
Energy: 0.3661257614348611
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Energy: 0.3300235914703805
Energy: 0.32727811749005353
Energy: 0.4031330734289996
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Energy: 0.33009520017653415
Energy: 0.3273616298380561
Energy: 0.4034001047018923
Energy: 0.3484911600577056
Energy: 0.3531732565170939
Energy: 0.33025366105703957
Energy: 0.3477322267249918
Energy: 0.36894920326886904
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Energy: 0.34968093111832804
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Energy: 0.3455331144645367
Energy: 0.3975717962414027
Energy: 0.3331300640173065
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Energy: 0.4024922907390761
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Energy: 0.3470793172377168
Energy: 0.32898331358888283
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Energy: 0.36693480084093216
Energy: 0.3477308348495576
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Energy: 0.36498319282014985
Energy: 0.35006213714101836
Energy: 0.3515090928598441
Energy: 0.34670055230076535
Energy: 0.3647504212003867
Energy: 0.40116419705853085
Energy: 0.37132851866944827
Energy: 0.3511690335939016
Energy: 0.346972051961602
Energy: 0.36341425930891375
Energy: 0.362893515286062
Energy: 0.368080630644458
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Energy: 0.3271243771586459
Energy: 0.32813604680706804
Energy: 0.3495202889549746
Energy: 0.3675246868206321
Energy: 0.34301963811308994
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Energy: 0.3626810643473547
Energy: 0.3379231613230436
Energy: 0.3500634540254452
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Energy: 0.36649010297987694
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Energy: 0.3415968230653349
Energy: 0.34853142527004155
Energy: 0.36967752303279716
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Energy: 0.3538145108839549
Energy: 0.33739342009035084
Energy: 0.3654684272459067
Energy: 0.3696311770925019
Energy: 0.3467624463336709
Energy: 0.3293518090518632
Energy: 0.3462276426276554
Energy: 0.3639044560845824
Energy: 0.3456973434474111
Energy: 0.3532886379478583
Energy: 0.3287978335287596
Energy: 0.3270888416614296
Energy: 0.3667869662915089
Energy: 0.35066682805617994
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Energy: 0.36733414881159754
Energy: 0.35151553568661176
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Energy: 0.4012830349825496
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Energy: 0.3989373318066174
Energy: 0.36691457082714035
Energy: 0.368042795002904
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Energy: 0.3285581743682712
Energy: 0.3980979305280979
Energy: 0.36732967823058194
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Energy: 0.34565603398390754
Energy: 0.3995859635771552
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Energy: 0.34831618355789595
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Energy: 0.3290489839649598
Energy: 0.3682511340297631
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Energy: 0.36511441683885615
Energy: 0.4023907357439884
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Energy: 0.3310036621210739
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Energy: 0.35238529806529495
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Energy: 0.32791322633071274
Energy: 0.35042680055929054
Energy: 0.3489357085528591
Energy: 0.3470709470556984
Energy: 0.3268695207573898
Energy: 0.32839159436619075
Energy: 0.34803972634582614
Energy: 0.35387225374708586
Energy: 0.3306060519407104
Energy: 0.32646309334407897
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Energy: 0.36501619263967455
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Energy: 0.4030197394290746
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Energy: 0.4034383885791675
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Energy: 0.32974037394134803
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Energy: 0.40305224457904
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Energy: 0.36725146433625333
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Energy: 0.3471202930015325
Energy: 0.3528002965778861
Energy: 0.34810172565572367
Energy: 0.3673681923536765
Energy: 0.3991803264045379
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Energy: 0.3462206434065636
Energy: 0.32737112354674397
Energy: 0.3316664404261443
Energy: 0.35483962903653693
Energy: 0.3678443339299388
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Energy: 0.3271896519026855
Energy: 0.327644518627182
Energy: 0.35012559383159586
Energy: 0.36764199853905466
Energy: 0.36144877052270136
Energy: 0.3460012528304589
Energy: 0.329344283495739
Energy: 0.3499667986057024
Energy: 0.36705252429677054
Energy: 0.3618068416928568
Energy: 0.35648763219417673
Energy: 0.3500081698863178
Energy: 0.35076002630309466
Energy: 0.36692356081851063
Energy: 0.3529467702540807
Energy: 0.34553474132467876
Energy: 0.3446059456290219
Energy: 0.3659583045216018
Energy: 0.36577965929872014
Energy: 0.3520928414898847
Energy: 0.34539175727419974
Energy: 0.3474477804413011
Energy: 0.4030127127789815
Energy: 0.3491726925963773
Energy: 0.34650595281671964
Energy: 0.330900893941621
Energy: 0.36514902979231084
Energy: 0.368012427186434
Energy: 0.3512815137464912
Energy: 0.32942009628371577
Energy: 0.33124479240632954
Energy: 0.3662373344783475
Energy: 0.3693308593374317
Energy: 0.35237382127056877
Energy: 0.3664824671198205
Energy: 0.3675497811676731
Energy: 0.34866513570243113
Energy: 0.34961032561064614
Energy: 0.36318615823552064
Energy: 0.366737242367032
Energy: 0.3472317855141759
Energy: 0.34855694677013266
Energy: 0.3496473070823229
Energy: 0.3630573112747744
Energy: 0.3336544339435025
Energy: 0.3475947926242801
Energy: 0.3473897279474951
Energy: 0.3630145735012999
Energy: 0.36376219592116976
Energy: 0.33357844199101055
Energy: 0.34735488976504675
Energy: 0.3466313337460562
Energy: 0.4024610366784189
Energy: 0.32874513648033166

minimum gb energy = 0.3263343687557992 eV
minimum distance =  2.41212042652245 Angstroms
sigma value = 33


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

Energy: 0.6908996108117612
Energy: 0.6906335508400006
Energy: 0.7053035015553822
Energy: 0.7049042707239741
Energy: 0.6786871276899898
Energy: 0.6762769728528142
Energy: 0.6914337496602848
Energy: 0.7046569190495713
Energy: 0.6969334749068622
Energy: 0.6751692265825757
Energy: 0.6797989102649836
Energy: 0.7178410568189111
Energy: 0.6940550914824078
Energy: 0.691660965594031
Energy: 0.7026899716992906
Energy: 0.6804627764846476
Energy: 0.7165628026764871
Energy: 0.6929063311008679
Energy: 0.6917451526540225
Energy: 0.702780310777808
Energy: 0.6852951394465981
Energy: 0.6934131564839513
Energy: 0.692014847519883
Energy: 0.7145170223897555
Energy: 0.6759416069996882
Energy: 0.68781879976322
Energy: 0.6931522506390377
Energy: 0.6921800454614654
Energy: 0.7148442036898609
Energy: 0.6755291037367511
Energy: 0.72356434526318
Energy: 0.6882484654651415
Energy: 0.6933129449217221
Energy: 0.693119804292833
Energy: 0.6797133875183194
Energy: 0.7222473387622468
Energy: 0.6893602664912094
Energy: 0.6936809039776374
Energy: 0.6927234506831429
Energy: 0.6886185226561646
Energy: 0.6905889216639669
Energy: 0.6951154851783443
Energy: 0.6915074038922148
Energy: 0.680022148677042
Energy: 0.6801939434429913
Energy: 0.6910670846031811
Energy: 0.7216487495516103
Energy: 0.688408732978233
Energy: 0.679694584908994
Energy: 0.6823742097530526
Energy: 0.6919983586197045
Energy: 0.6908242116582386
Energy: 0.7272024410345538
Energy: 0.6884777495854845
Energy: 0.6774183083985916
Energy: 0.6912074790450837
Energy: 0.6916817949593856
Energy: 0.7831775310229049
Energy: 0.6879223917652698
Energy: 0.6783019390333034
Energy: 0.6910009380618425
Energy: 0.6973352793059104
Energy: 0.6892761042016468
Energy: 0.6976186412261567
Energy: 0.7154402951959037
Energy: 0.7807321735025204
Energy: 0.6978985416291539
Energy: 0.6871227410542318
Energy: 0.6858336610422047
Energy: 0.6945982757961537
Energy: 0.6812305052283325
Energy: 0.692629953868286
Energy: 0.6769155540264633
Energy: 0.705554293209081
Energy: 0.6800923136746289
Energy: 0.6821605672504562
Energy: 0.6930825908538877
Energy: 0.6765612464234708
Energy: 0.6938588216166444
Energy: 0.680006911615032
Energy: 0.6794668513784118
Energy: 0.6861981503666666
Energy: 0.6794366888300649
Energy: 0.6797726042390839
Energy: 0.6938080144864208
Energy: 0.679321860605384
Energy: 0.6876733814984604
Energy: 0.6799214424530498
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Energy: 0.6901847393005672
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Energy: 0.6793192783374071
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Energy: 0.6786613208784821
Energy: 0.6885698906734271
Energy: 0.6955192442581059
Energy: 0.6794755553829736
Energy: 0.6799862798719716
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Energy: 0.7021160907875283
Energy: 0.6813262627503799
Energy: 0.6800201315613453
Energy: 0.7051134638708637
Energy: 0.6766490293540321
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Energy: 0.680767661167861
Energy: 0.6991173664788733
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Energy: 0.6811373474896166
Energy: 0.6922053280282133
Energy: 0.7245477627928367
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Energy: 0.7017735672931424
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Energy: 0.6922719165021258
Energy: 0.7264519644070571
Energy: 0.6789452084299642
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Energy: 0.6912883404043128
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Energy: 0.6786098537778522
Energy: 0.6770497307571866
Energy: 0.6916108882709144
Energy: 0.6908813733793565
Energy: 0.691723870889493
Energy: 0.6799663782455457
Energy: 0.6803712538468722
Energy: 0.7261003343266811
Energy: 0.693919987135004
Energy: 0.6917379392812899
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Energy: 0.6803085347905484
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Energy: 0.6965667611967552
Energy: 0.6912016396123641
Energy: 0.6775910677357574
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Energy: 0.693966862924105
Energy: 0.7134551709043482
Energy: 0.6823564638199499
Energy: 0.6741197586879123
Energy: 0.6922605401583214
Energy: 0.693523013973465
Energy: 0.7185453229703419
Energy: 0.6849074265062963

minimum gb energy = 0.6738037836906274 eV
minimum distance =  2.36583127003009 Angstroms
sigma value = 219


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

Energy: 0.8987941384877479
Energy: 0.9017672605776517
Energy: 0.9032933588278479
Energy: 0.90289631284728
Energy: 0.894869462677452
Energy: 0.8969686534999375
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Energy: 0.8883641014305418
Energy: 0.889799137245607
Energy: 0.9115166497314472
Energy: 0.9112739519499213
Energy: 0.8914196450115612
Energy: 0.8877640077245248
Energy: 0.9098643992319155
Energy: 0.8997776709187757
Energy: 0.9055439624485149
Energy: 0.8912851108630655
Energy: 0.8879959792081981
Energy: 0.9082737572389984
Energy: 0.8997650944728252
Energy: 0.9279890869041877
Energy: 0.9245272014149832
Energy: 0.8919326279324252
Energy: 0.903767859838098
Energy: 0.899300484655112
Energy: 0.9068444644240036
Energy: 0.9244839184284643
Energy: 0.8922895222775346
Energy: 0.9025436489999608
Energy: 0.8937331602578025
Energy: 0.8998621775972445
Energy: 0.9031465769589078
Energy: 0.8701625913238421
Energy: 0.9001972792530667
Energy: 0.8977168052543989
Energy: 0.9001626679764815
Energy: 0.8755150217915029
Energy: 0.8699624874101112
Energy: 0.9002779003973315
Energy: 0.9133323740666809
Energy: 0.9018752188261868
Energy: 0.9029844069515679
Energy: 0.9016041778213043
Energy: 0.9190334291806591
Energy: 0.900995552135405
Energy: 0.9013752719536525
Energy: 0.9052830973868639
Energy: 0.9011002428385162
Energy: 0.9186426919957648
Energy: 0.912438161271934
Energy: 0.872300888758859
Energy: 0.8995125126964645
Energy: 0.9118071930782501
Energy: 0.9015095102295924
Energy: 0.9039354097941433
Energy: 0.8979122898787797
Energy: 0.8991867987858265
Energy: 0.9115054348217019
Energy: 0.9189002113332959
Energy: 0.9041091344164663
Energy: 0.9111476577746085
Energy: 0.8992003034374426
Energy: 0.8921358043253592
Energy: 0.9068090545471423
Energy: 0.900946480365328
Energy: 0.9121937991155261
Energy: 0.900032694339638
Energy: 0.9234994492272551
Energy: 0.9062122289249124
Energy: 0.9025057543105293
Energy: 0.8946641772322701
Energy: 0.9114163621158462
Energy: 0.8896478295894222
Energy: 0.8909927091294405
Energy: 0.9038118531663245
Energy: 0.8959886094551561
Energy: 0.9118514938474644
Energy: 0.8900905887659798
Energy: 0.8920862056117325
Energy: 0.9018636301505946

minimum gb energy = 0.8699624874101112 eV
minimum distance =  2.33909065652812 Angstroms
sigma value = 15


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

Energy: 1.551053816812358
Energy: 1.0226003165187332
Energy: 1.026143144573826
Energy: 1.0154236467364806
Energy: 1.0714011239484433
Energy: 0.9995017170068407
Energy: 1.022539275721462
Energy: 1.0290259311567838
Energy: 1.013154289883378
Energy: 1.0370535980146554
Energy: 1.012436451312015
Energy: 1.0134194956845328
Energy: 1.0143339361720154
Energy: 1.013806205375015
Energy: 1.0178129081118914
Energy: 1.0228647336550807
Energy: 1.0147162996631867
Energy: 1.0110817670990293
Energy: 1.0161440349053534
Energy: 1.0265607384042195
Energy: 1.0387909210762107
Energy: 1.0167045011387512
Energy: 1.0145589134580315
Energy: 1.0068372944628081
Energy: 1.02540873935028
Energy: 1.0472653017673983
Energy: 1.0155066010848497
Energy: 1.0127004984825352
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minimum gb energy = 0.986495690096879 eV
minimum distance =  2.32394357730987 Angstroms
sigma value = 293


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

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Energy: 1.0775038348728632
Energy: 1.002534605215886
Energy: 1.0408964965218097
Energy: 1.0033255817680524
Energy: 1.028609890072338
Energy: 1.0768703584851536
Energy: 1.0032717359472667
Energy: 1.0168540136609965
Energy: 1.0155925161233919
Energy: 1.045756657530252
Energy: 1.002598678786789
Energy: 1.009415782141437
Energy: 1.0424877474809011
Energy: 1.0153966637845877
Energy: 1.0475365181206409
Energy: 1.01147885396995
Energy: 1.0157229282530544
Energy: 1.0419421241354347
Energy: 0.9768294924353184
Energy: 1.0211030488723394
Energy: 1.0038328103068408
Energy: 1.001455322546739
Energy: 1.023784065700249
Energy: 0.9766894972582936
Energy: 1.0194947134995649
Energy: 1.002848737740271
Energy: 1.002863267917358
Energy: 1.0192117532928582
Energy: 1.0009168476815202
Energy: 0.9997321823160263
Energy: 0.9995143155048651
Energy: 1.0071184213601876
Energy: 1.0021581013648078
Energy: 1.0007867031886737
Energy: 0.9999658799603148
Energy: 1.0020384839302687
Energy: 1.0077452485517902
Energy: 1.0058918709875835
Energy: 1.020572345704661
Energy: 0.9999384109368503
Energy: 1.0014757162278745
Energy: 1.0561336186987875
Energy: 1.038293546652794
Energy: 1.0229994731263212
Energy: 0.9999210232872792
Energy: 1.0011914355624711
Energy: 1.0557125059066528
Energy: 1.0043994934192035
Energy: 1.0580529001557335
Energy: 0.9790123351327784
Energy: 0.9800548795423522
Energy: 1.0326175278523626
Energy: 1.0361533251559782
Energy: 1.0623870043994135
Energy: 0.9786108256334615
Energy: 0.980303543810964
Energy: 1.0043831686289368
Energy: 1.040007027144118
Energy: 1.0291749177745038
Energy: 0.9812912650735763
Energy: 1.0278502817700805
Energy: 1.0030776990008088
Energy: 1.003159391196432
Energy: 1.030006092894264
Energy: 0.9809055734033699
Energy: 1.054117231826547
Energy: 1.0019234308989795
Energy: 1.0055795000629073
Energy: 0.9997366287283695
Energy: 1.005341214156393
Energy: 1.0151844596590638
Energy: 1.0046986855235656
Energy: 1.0004202969806386
Energy: 1.000003005502641
Energy: 1.0009076431017918
Energy: 1.0147202234898178
Energy: 1.0029085202087717
Energy: 1.000388501038187
Energy: 0.9977461138581815
Energy: 0.997153456516349
Energy: 1.0216665992736653
Energy: 1.0005414326927202
Energy: 1.0276349715462665
Energy: 0.9981132434048201
Energy: 0.9980613147912587
Energy: 1.0223577092370666
Energy: 1.0002481645915742
Energy: 1.0283231620220004
Energy: 1.0435259554875502
Energy: 1.0197305855480019
Energy: 1.0437496333315261
Energy: 1.0274322790092216
Energy: 1.0356331918872086
Energy: 1.002907013691696
Energy: 1.0414013481721547
Energy: 1.0443938947131843
Energy: 1.0278912583539586
Energy: 1.0148658026864645
Energy: 1.0258820531981465
Energy: 1.0098144051697768
Energy: 1.041021833363278
Energy: 1.03028557831895
Energy: 1.0479539968389917
Energy: 1.0285328684773394
Energy: 1.0426840673177828
Energy: 1.0417139041948873
Energy: 1.0282268801706405
Energy: 1.0072756176441733
Energy: 1.008489027975457
Energy: 1.0117571019924076
Energy: 1.0626214097871245
Energy: 1.0173847775309162
Energy: 1.0024502523504295
Energy: 1.0066003944533861
Energy: 1.0124233775422264
Energy: 1.012124711425896
Energy: 1.023076169046453
Energy: 1.0028271934316073
Energy: 1.0008035190229692
Energy: 1.0169951134007884
Energy: 0.9769112753915113
Energy: 0.9779157410564836
Energy: 1.006571618834073
Energy: 0.9997213070513032
Energy: 1.0194878750592713
Energy: 0.9767464601690911
Energy: 0.976650679450595
Energy: 1.006352558383117
Energy: 1.0054467453755376
Energy: 1.0099810452126081
Energy: 1.0137011942492478
Energy: 1.0020288665643569
Energy: 1.0032810479393628
Energy: 1.0056194423686986
Energy: 1.011340407361623
Energy: 1.0401939988358866
Energy: 1.0021667835410097
Energy: 1.0027270358844402
Energy: 1.0324496897738573
Energy: 1.0021435814249526
Energy: 1.0078476391766351
Energy: 1.0302106500311812
Energy: 1.0030656251047567
Energy: 1.0321353942978329
Energy: 1.0013727892823914
Energy: 0.9986276644924174
Energy: 1.0301536802477982
Energy: 1.0063604728426694
Energy: 0.9800157771849779
Energy: 1.007518886744125
Energy: 1.0248801247771255
Energy: 1.006927827279823
Energy: 0.9805335237638346
Energy: 1.0216816010279126
Energy: 1.0021108139528416
Energy: 1.0466883168186647
Energy: 1.0558960035818352
Energy: 0.9844640081797662
Energy: 1.0536425796676039
Energy: 0.9996057880729469
Energy: 0.999166136602302
Energy: 1.0460947407329038
Energy: 1.054335132139549
Energy: 1.0566916723602542
Energy: 0.9995123866279041
Energy: 0.9996524769838188
Energy: 1.0019085788241193
Energy: 0.9806284862299915
Energy: 1.0110434847497998
Energy: 1.003261839394779
Energy: 1.0016533171520212
Energy: 1.041862980544015
Energy: 1.003588130981285
Energy: 1.0097122767198248
Energy: 1.0049105646580785
Energy: 1.000881604142365
Energy: 1.0175074259629209
Energy: 1.0283209671539189
Energy: 1.0035298428654074
Energy: 1.028251122045424
Energy: 1.0223336647780175
Energy: 0.9973642363953212
Energy: 0.9980099215456003
Energy: 1.0026772190150768
Energy: 1.0302862729780649
Energy: 1.0204552916728475
Energy: 0.996982633648615
Energy: 0.9976200100246625
Energy: 1.0025308612964392
Energy: 1.0280486557716806
Energy: 1.0720391033299739
Energy: 1.0032684714977158
Energy: 1.0408811215425455
Energy: 1.0369971406902783
Energy: 1.0308186879786925
Energy: 1.0612119306815093
Energy: 1.0132425500373334
Energy: 1.0412908399481187
Energy: 1.0031101132677047
Energy: 1.0283079214288853
Energy: 1.0865820914547226
Energy: 1.0025738966542892
Energy: 1.0411738206669845
Energy: 1.0039061943868421
Energy: 1.0293747646889742
Energy: 1.0798842175298826
Energy: 1.0028718646728672
Energy: 1.0407175792143242
Energy: 0.977054951839115
Energy: 1.044429014854785
Energy: 1.0021248858220768
Energy: 1.0061398070921583
Energy: 1.0437522001337558
Energy: 1.0271061148024148
Energy: 1.0201934426249377
Energy: 1.0024339087118963
Energy: 1.006816357918608
Energy: 1.0293846413752532

minimum gb energy = 0.9766020786119505 eV
minimum distance =  2.29502298146232 Angstroms
sigma value = 293


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

Energy: 0.9677037477896521
Energy: 1.013600798355284
Energy: 1.0544804208816347
Energy: 0.987097160036683
Energy: 0.9719298940458331
Energy: 0.9675692883303144
Energy: 0.9894517853905432
Energy: 1.0542416111198278
Energy: 0.9881219045909745
Energy: 0.9711078401051704
Energy: 1.042361442810761
Energy: 0.9806297982076668
Energy: 0.9793139844344204
Energy: 0.9790074655771606
Energy: 0.9809473926731727
Energy: 1.041122373743458
Energy: 0.9809533161368376
Energy: 0.9708160047998108
Energy: 0.980219779156668
Energy: 0.9815334597076902
Energy: 0.9837545199126718
Energy: 0.9809072115437552
Energy: 0.982681190054536
Energy: 0.9890088638897919
Energy: 1.0422632746709708
Energy: 0.981668985589387
Energy: 0.9802377006126113
Energy: 0.9813479087403791
Energy: 1.0565191160634666
Energy: 1.0422818310296411
Energy: 1.0577263576131757
Energy: 0.9688512997226921
Energy: 0.9699276414747346
Energy: 0.9807813075747154
Energy: 1.0636547387862414
Energy: 1.0566046201170542
Energy: 0.9686412165340703
Energy: 0.9704855097748937
Energy: 0.9823040522779263
Energy: 0.9682250741110782
Energy: 0.9827926481584797
Energy: 0.970426999674938
Energy: 0.9682606978697303
Energy: 0.9837768558632014
Energy: 0.9824822568764441
Energy: 0.9811396275218557
Energy: 0.9723310191372879
Energy: 0.9680411759416824
Energy: 0.981010659168965
Energy: 0.9806260652017572
Energy: 0.9807102590927467
Energy: 1.0577838851732997
Energy: 0.9912116148305923
Energy: 0.9817739460122601
Energy: 0.9717355335201815
Energy: 0.9813971630008178
Energy: 1.0552010136133565
Energy: 0.9891847977654591
Energy: 0.9845924469465918
Energy: 0.9741504666799913
Energy: 1.0582511509088892
Energy: 0.9683504790449835
Energy: 0.9803213390110533
Energy: 0.9809736056720946
Energy: 0.9810797894656995
Energy: 0.9895516187271404
Energy: 0.9670922732660527
Energy: 0.9802533115693228
Energy: 0.9807045229050504
Energy: 0.9807693142741655
Energy: 0.9825044031699834
Energy: 1.0383718679786316
Energy: 0.9890301397157117
Energy: 0.9683342141246133
Energy: 0.9705220397494873
Energy: 0.9854826445939894
Energy: 1.0380483314927431
Energy: 0.9870618581099214
Energy: 0.9688379241121974
Energy: 0.9709834871963282
Energy: 0.9804918375353697
Energy: 0.9720766014815375
Energy: 0.9793222859712901
Energy: 0.969139085152642
Energy: 1.0420524000946123
Energy: 0.9801859146817291
Energy: 0.9794100059599185
Energy: 0.9793220773984447
Energy: 0.9684892502472764
Energy: 1.046518195324152
Energy: 0.9851521496933283
Energy: 0.9837958853428712
Energy: 1.0385993448236
Energy: 1.057909754979343
Energy: 0.9870696285399869
Energy: 0.9945879052484236
Energy: 0.9860638310097881
Energy: 1.039050601314171
Energy: 0.9879217861187168
Energy: 0.9816628718445835
Energy: 0.969001558078545
Energy: 0.9889507358211614
Energy: 0.9812807935727202
Energy: 0.9848153698187219
Energy: 1.0441200812834586
Energy: 0.9693529353547874
Energy: 0.9832871204849274
Energy: 0.9667753176401157
Energy: 0.9870027599842967
Energy: 1.0438917661193805
Energy: 0.9678618939910868
Energy: 0.987999104587887
Energy: 1.0533431127109765
Energy: 0.9874340663803814
Energy: 0.9722180843187045
Energy: 0.9681915449405111
Energy: 0.9893218324238657
Energy: 1.0560214598988953
Energy: 0.988331332043688
Energy: 0.9711757173560255
Energy: 1.0426882138102038
Energy: 0.9806605999661142
Energy: 0.979201166507774
Energy: 0.9790403830570424
Energy: 0.9808700673857489
Energy: 1.0417134915460546
Energy: 0.9808858295408491
Energy: 0.9721244627723928
Energy: 0.9797868451697065
Energy: 0.981590670651481
Energy: 0.9848579120263894
Energy: 0.9816458718666002
Energy: 0.982918636874604
Energy: 1.0575257639934632
Energy: 1.0420692016609092
Energy: 0.9818875340165509
Energy: 0.9806413332551489
Energy: 0.9813906784225765
Energy: 1.0553423815979248
Energy: 1.0424381378866876
Energy: 1.0586963686047894
Energy: 0.9687661270007297
Energy: 0.9697918246723731
Energy: 0.9803982727224113
Energy: 1.065024646924249
Energy: 1.0570644736695352
Energy: 0.9685535896209285
Energy: 0.9710047740140948
Energy: 0.9817451912101188
Energy: 1.042449974808698
Energy: 0.9829017083851189
Energy: 0.970595758090672
Energy: 0.9682683862261715
Energy: 0.9823200960935763
Energy: 0.9851218760543018
Energy: 0.9812520648706826
Energy: 0.9703964234774346
Energy: 0.9680800968871425
Energy: 0.9808874018641793
Energy: 0.9810139049033049
Energy: 0.980686421837165
Energy: 1.0578911845066308
Energy: 0.9918528367300335
Energy: 0.9817097166816219
Energy: 0.9715504136700207
Energy: 0.9813099778059516
Energy: 1.0558650967434338
Energy: 0.9893619347480522
Energy: 0.9836799023837881
Energy: 0.9735261437297406
Energy: 1.0578442402707158
Energy: 0.9684618163703919
Energy: 0.9803107993233523
Energy: 0.9811478136696645
Energy: 0.9818584362928046
Energy: 0.986979595485095
Energy: 0.9670880305804147
Energy: 0.9809681272485413
Energy: 0.9810036836226383
Energy: 0.9809833781516367
Energy: 0.982326716884377
Energy: 1.03799949162458
Energy: 0.9895539190300557
Energy: 0.9683325498233232
Energy: 0.9707297628581888
Energy: 0.9849931029722436
Energy: 1.0378768826346614
Energy: 0.9874000832749585
Energy: 0.9686606283946448
Energy: 0.9711838194261538
Energy: 0.980725526190696
Energy: 0.9724173272345765
Energy: 0.9797636341051261
Energy: 0.9693493642713603
Energy: 1.0439005741963714
Energy: 0.9802868034219514
Energy: 0.979047676234073
Energy: 0.9796659699471522
Energy: 0.9685515035649589
Energy: 0.9822237705766246
Energy: 0.9843500587612696
Energy: 0.9833081535210637
Energy: 1.0378576713996106
Energy: 1.0576301019027348
Energy: 0.9870233728028723
Energy: 0.993045946694674
Energy: 0.9854999455956581
Energy: 1.0405267478549387
Energy: 0.9846544830582457
Energy: 0.9823151047081242
Energy: 0.9688356493423372
Energy: 0.9886565554199239
Energy: 0.9809902393484565
Energy: 0.983829826040467
Energy: 1.044124910916439
Energy: 0.969026457980928
Energy: 0.9819924939729026
Energy: 0.9663282082154797
Energy: 0.9854764535408463
Energy: 1.0430004437548817

minimum gb energy = 0.9663282082154797 eV
minimum distance =  2.31627490129254 Angstroms
sigma value = 15


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

Energy: 0.9616330186945348
Energy: 1.059201168466826
Energy: 1.0734925626712781
Energy: 0.998632484257035
Energy: 1.0651054518851322
Energy: 1.0673680565852945
Energy: 1.1096978191459044
Energy: 1.0551611304037596
Energy: 0.9629069199663423
Energy: 1.0240627822834294
Energy: 0.9652092060077774
Energy: 1.0191493215342098
Energy: 1.00001235969571
Energy: 1.0006216906774046
Energy: 1.0385667010541602
Energy: 0.9469758304651407
Energy: 1.0198486185899078
Energy: 0.9985377024407048
Energy: 1.0354144863975103
Energy: 1.0215476971144477
Energy: 1.0825244906495552
Energy: 0.9837795472114284
Energy: 0.9619792283379048
Energy: 1.0290020483151612
Energy: 0.9882964347089789
Energy: 1.0866745553655068
Energy: 1.0460049228645947
Energy: 0.9928770348791712
Energy: 1.015162445214774
Energy: 1.0984896557784152
Energy: 1.0433393652569314
Energy: 0.9665853058850962
Energy: 1.019671201232413
Energy: 1.0946778501244543
Energy: 1.110596910368968
Energy: 1.0301432693226
Energy: 0.958408588650779
Energy: 1.0194207747873505
Energy: 1.0836238127404723
Energy: 1.0990045646532736
Energy: 1.1153838011024502
Energy: 1.0493862088962287
Energy: 0.9567772294977498
Energy: 0.9626035150224702
Energy: 1.0514488996352458
Energy: 1.074215096918661
Energy: 1.048132829274251
Energy: 0.9993104175434209
Energy: 0.963050005045918
Energy: 0.9427270394219557
Energy: 0.9445175855356203
Energy: 0.9620955512364872
Energy: 0.96196745734426
Energy: 1.0569853097425348
Energy: 1.1784044409696026
Energy: 0.9669118854263934
Energy: 0.961775791000346
Energy: 0.9621170554041691
Energy: 1.1106725048466306
Energy: 1.1790134131357337
Energy: 0.9650041720996054
Energy: 0.9618430849068518
Energy: 0.9631113751428311
Energy: 0.9835675886016207
Energy: 1.0385671803704495
Energy: 0.9645432291152818
Energy: 0.9616568593590916
Energy: 0.9632588352863366
Energy: 0.9757052508836114
Energy: 1.0853502742860364
Energy: 0.9674123730635039
Energy: 0.9653927541305213
Energy: 0.9702962060402376
Energy: 0.957669573136204
Energy: 1.035510679081371
Energy: 0.965476871837796
Energy: 0.9641166287291816
Energy: 1.0029357648200579
Energy: 1.031279463379604
Energy: 1.0616591687173746
Energy: 0.9642979221577161
Energy: 1.1868065806751533
Energy: 0.9713469103177
Energy: 1.0240640720592538
Energy: 0.9627574306362289
Energy: 0.964913804158104
Energy: 1.1811844601477757
Energy: 1.0234076102274183
Energy: 1.0492489574361126
Energy: 0.9728941525681315
Energy: 1.0167592962722156
Energy: 0.9636224240225885
Energy: 0.9859328611675743
Energy: 0.9837807286266409
Energy: 0.9836984668052279
Energy: 0.9820527796118923
Energy: 0.9619724776793768
Energy: 0.9863697253403858
Energy: 0.9850215066458943
Energy: 0.9841054869767214
Energy: 1.0222799606378312
Energy: 0.9612011082367481
Energy: 0.9771841200964182
Energy: 0.9809521615114121
Energy: 0.9822557810144571
Energy: 1.0276231793183042
Energy: 0.9916811539994568
Energy: 0.9784343334784165
Energy: 0.981172587918187
Energy: 0.9826849460589067
Energy: 1.1282823237398605
Energy: 1.0456327214779346
Energy: 0.9772622906180888
Energy: 0.9469817851404015
Energy: 1.0596532576224784
Energy: 1.1193970118101217
Energy: 1.0489730573422458
Energy: 0.946550915887007
Energy: 0.9470206767411876
Energy: 1.0723581785075786
Energy: 1.0244369955868926
Energy: 0.97701298707154
Energy: 0.9657900706308797
Energy: 1.067146164369484
Energy: 0.9643463944780349
Energy: 1.0296589299965582
Energy: 1.053305542903838
Energy: 0.964558858825052
Energy: 1.0676300650542894
Energy: 1.0228648677723968
Energy: 1.0004203481185274
Energy: 1.0543733306577234
Energy: 1.0768450516876924
Energy: 1.0465165192574217
Energy: 1.0039912189483646
Energy: 1.0000705570427053
Energy: 1.0525467103364783
Energy: 0.9370279672987188
Energy: 1.0466203564640932
Energy: 1.0109523193620649
Energy: 0.9661131687650498
Energy: 1.032764404689053
Energy: 1.1122949488694938
Energy: 1.0398571899305138
Energy: 1.0028890378964272
Energy: 0.9648067768250497
Energy: 0.9860593294255091
Energy: 1.1125062486133819
Energy: 0.9964111082083655
Energy: 1.0056337132291655
Energy: 1.1464631707013986
Energy: 1.1164471117174868
Energy: 0.9838282930192966
Energy: 1.024437197375483
Energy: 1.0039403053892308
Energy: 1.1263929806632107
Energy: 1.116363718261065
Energy: 0.9838353474821456
Energy: 1.0272675798092736
Energy: 0.9487749562014146
Energy: 0.9491143235306913
Energy: 0.9679276033349162
Energy: 0.998814688191943
Energy: 1.1048761991942648
Energy: 1.065711238593309
Energy: 0.950170739462586
Energy: 0.9874358169424912
Energy: 1.1508032102988226
Energy: 1.1309477683868647
Energy: 1.0674684464411834
Energy: 1.0947563882416607
Energy: 1.1408911250650644
Energy: 1.1455922442943134
Energy: 0.9847362147177761
Energy: 0.9639193179984966
Energy: 1.09027462181211
Energy: 1.1400265811678931
Energy: 1.1448797094189938
Energy: 0.9811520285657626
Energy: 0.9631794374777222
Energy: 0.9641067335695281
Energy: 0.9789137458314257
Energy: 0.9943519694546963
Energy: 0.9660678746970277
Energy: 0.9666571214338018
Energy: 0.9659635562209606
Energy: 0.9920288894161352
Energy: 0.9682744443399975
Energy: 0.9668831013889301
Energy: 0.9687599354397036
Energy: 0.9483005712483481
Energy: 1.062853909995412
Energy: 0.9942474153148766
Energy: 0.9620285203713901
Energy: 0.9629266523157001
Energy: 0.9583188882652758
Energy: 1.0638085720826507
Energy: 1.0018790456687947
Energy: 0.9622518001012497
Energy: 0.9637887482461636
Energy: 1.0333067160297182
Energy: 0.9590243165549834
Energy: 0.9686211550660888
Energy: 0.9623315215629262
Energy: 0.9821947391459378
Energy: 1.0829208680593592
Energy: 0.9575860367745119
Energy: 0.9678297964763036
Energy: 0.9444889650650584
Energy: 1.012609776118689
Energy: 0.9785003432775884
Energy: 0.9785065815906347
Energy: 1.0438358424182643
Energy: 1.1828406648226168
Energy: 0.9646745708490406
Energy: 0.9646008281822409
Energy: 0.9644673186366336
Energy: 0.9994577544052853
Energy: 1.176184600316378
Energy: 0.9659995893753004
Energy: 0.9903607659542637
Energy: 0.982961314266395
Energy: 0.9830294626613003
Energy: 1.0126802461760562
Energy: 0.9761808252144522
Energy: 0.969564092489211
Energy: 0.9653634837304038
Energy: 0.9724416279920214
Energy: 0.9700747570700056
Energy: 0.9492228415213081
Energy: 0.9468179812683784
Energy: 1.0028905214042425
Energy: 1.1146285051329843
Energy: 1.1160151655257342
Energy: 1.0883318647761444
Energy: 0.9679119873141812
Energy: 0.9655501029278858
Energy: 1.1148518351215284
Energy: 1.08730653438476
Energy: 1.0619348666111572
Energy: 0.9649932277923634
Energy: 1.0569567262032333
Energy: 1.0203412081207826
Energy: 1.0631473077925104
Energy: 0.9438267240152627
Energy: 0.9620046726314583
Energy: 1.044069500470337
Energy: 1.0194685519489408
Energy: 1.02145759085886
Energy: 0.9650177356800915
Energy: 0.9636139607588691
Energy: 1.0284418736488778
Energy: 0.9971789528232389
Energy: 1.0213445179488319
Energy: 1.0325310471844293
Energy: 0.9599144306178142
Energy: 1.0300111521336068
Energy: 0.9981118279935153
Energy: 1.0357381518655357
Energy: 1.025077719531035
Energy: 1.0870535981857805
Energy: 1.0428777015594237
Energy: 1.0161956331782107
Energy: 0.9617743170243961
Energy: 0.966094404399858
Energy: 1.0768521230995005
Energy: 1.0128118495418907
Energy: 1.0305666141899623
Energy: 1.0295139613178876
Energy: 0.9788645817074332
Energy: 0.9807197801102088
Energy: 1.0738535263633175
Energy: 1.047935200001207
Energy: 1.0840321732058344
Energy: 1.0973624439352678
Energy: 0.967085509008952
Energy: 1.0946323727515934
Energy: 0.9874971718109418
Energy: 1.1164232286713964
Energy: 1.11432751525691
Energy: 1.0975146748098052
Energy: 1.0391610055207596
Energy: 1.0273021581233175
Energy: 0.9651227070692117
Energy: 1.0539047404275808
Energy: 1.1030444580608092
Energy: 1.0242966036181407
Energy: 1.0255502487069343
Energy: 1.0302260397165415
Energy: 1.011314119597325
Energy: 1.14388699933295
Energy: 0.9627379933351435
Energy: 0.9624236136200216
Energy: 1.1085521854711418
Energy: 1.1478929476196802
Energy: 1.0830184863045578
Energy: 0.9619289093996344
Energy: 0.9622182563082381
Energy: 1.1108089481354042
Energy: 1.1405227527362534
Energy: 0.9642569344227535
Energy: 0.9660619558956978
Energy: 0.9630851311221428
Energy: 0.954663414026077
Energy: 1.0691568937301847
Energy: 0.9631919647912106
Energy: 0.9654541285791234
Energy: 0.9620178183018128
Energy: 0.9900540786835786
Energy: 1.0353799377294608
Energy: 0.9665135889309452
Energy: 0.9649337677709992
Energy: 0.9677044629602252
Energy: 0.9573265399711726
Energy: 1.0805808308320817
Energy: 0.9645058322028258
Energy: 0.9637171793063277
Energy: 0.9687747737902149
Energy: 0.9578815138608503
Energy: 1.0293112332809917
Energy: 0.9829202218579858
Energy: 1.0605425572902878
Energy: 1.0225433696179216
Energy: 1.062519298625108
Energy: 1.0888932934691409
Energy: 0.9947054939476222
Energy: 0.9796762337114661
Energy: 1.025069296520514
Energy: 1.0239960438998754
Energy: 1.0132441179144915
Energy: 0.9855523530321176
Energy: 0.9444988027208104
Energy: 1.0081056766314422
Energy: 0.9481274369778445
Energy: 0.9840210307416588
Energy: 0.9790540921367175
Energy: 0.9436414162623825
Energy: 1.0154710849719666
Energy: 0.9482045736043131
Energy: 0.9844417493457375
Energy: 1.0237520573748908
Energy: 0.986029549804578
Energy: 0.9771098276236837
Energy: 0.9829964650028059
Energy: 0.9823449083227526
Energy: 1.025731814645448
Energy: 0.9558016346212791
Energy: 0.9773029770653135
Energy: 0.9840877115711649
Energy: 0.9825039123420817
Energy: 1.1282275641994624
Energy: 1.0530806098596075
Energy: 0.9466277524921297
Energy: 0.9476604546915405
Energy: 1.0050202878242658
Energy: 1.1177450852506299
Energy: 1.0558976991674955
Energy: 0.9455013762394234
Energy: 0.9460282505705238
Energy: 1.0066329869912651
Energy: 1.027804702974748
Energy: 0.947485685109903
Energy: 0.968542304119132
Energy: 0.969283435189006
Energy: 1.0253855523658333
Energy: 1.0272403468869704
Energy: 0.9462612870472873
Energy: 0.967884482320029
Energy: 0.9717776735754967
Energy: 1.0086823591161582
Energy: 0.9988332706616294
Energy: 1.0513317540884881
Energy: 1.043823318388925
Energy: 0.9685050173977596
Energy: 1.0036647626113984
Energy: 0.996885548539749
Energy: 1.0286717461598405
Energy: 0.9643601099012106
Energy: 0.9687597054110235
Energy: 1.0036501263726219
Energy: 0.9654511637403919
Energy: 1.0332210398502448
Energy: 1.1127613702865198
Energy: 0.9969623376793848
Energy: 1.0105201086445206
Energy: 0.9660516966470942
Energy: 1.033802372347879
Energy: 1.112883671105866
Energy: 0.9948096987821555
Energy: 1.0529153842483665
Energy: 1.1247696237345999
Energy: 1.1136691402707461
Energy: 1.1247992586089381
Energy: 1.1117063660006856
Energy: 1.0032024980751122
Energy: 1.0854178517661284
Energy: 1.1129688966785782
Energy: 0.982643861355546
Energy: 1.1112459140248014
Energy: 0.9483504435248377
Energy: 0.9536823674790524
Energy: 1.087987458575027
Energy: 1.0074709635428787
Energy: 1.1321073923548606
Energy: 1.0247236091700915
Energy: 0.9525914995335549
Energy: 1.086959103078028
Energy: 1.0078436287363426
Energy: 1.0735279378287625
Energy: 1.0304325269134125
Energy: 1.111747192799374
Energy: 1.1419145646743016
Energy: 1.1412216890169526
Energy: 0.951253290638429
Energy: 0.9638582437949585
Energy: 1.1102388625804838
Energy: 1.141789692535475
Energy: 1.1402051958698305
Energy: 1.0241361092411096
Energy: 0.9625594385045332
Energy: 0.9639479935568204
Energy: 0.9675319483387871
Energy: 0.9776043014764982
Energy: 0.9631400585242033
Energy: 0.9683012282897211
Energy: 0.9655782099512166
Energy: 0.9850761627981887
Energy: 0.9685369873424593
Energy: 0.9647261707020098
Energy: 0.9694441292186817
Energy: 0.9703090745368945
Energy: 1.0622723576334623
Energy: 1.0428826163659697
Energy: 0.961830176973767
Energy: 0.9631276078134613
Energy: 1.0156019339213687
Energy: 1.0627328172005015
Energy: 1.0177705009070555
Energy: 0.9617004733896262
Energy: 0.963395501494507
Energy: 1.049217289802949
Energy: 0.958520103105186
Energy: 0.9833190107578693
Energy: 1.02844747715225
Energy: 1.0122415522999297
Energy: 1.0337132411911658
Energy: 0.957587294722093
Energy: 0.9715876540254654
Energy: 1.0417779181459976
Energy: 1.0311548564369322
Energy: 0.9652173223834808
Energy: 0.964275987543818
Energy: 0.9807573376929866
Energy: 1.1772475993732556
Energy: 0.9650821029111957
Energy: 0.9475752718920006
Energy: 0.9468070048773765
Energy: 1.019803563429211
Energy: 1.1825155341565798
Energy: 0.9657488322648695
Energy: 0.9709434353466586
Energy: 0.9650998425103361
Energy: 0.9724345096459155
Energy: 0.9635316991174704
Energy: 0.9494429039716762
Energy: 0.9828769319042139
Energy: 0.9798422993530362
Energy: 0.9887602647569339
Energy: 0.9663125288520806
Energy: 0.9753479580231569
Energy: 0.9656996764850175
Energy: 0.9508023035010653
Energy: 1.1170312682542745
Energy: 1.1150669290124748
Energy: 1.0904013219641224
Energy: 0.9482846665856713
Energy: 1.0041366989046003
Energy: 1.1177470175528943
Energy: 1.0338858204083825
Energy: 1.0785698640862276
Energy: 0.9942951099739009
Energy: 1.0083227626834714
Energy: 1.031544407572563
Energy: 0.9820695120037585
Energy: 0.9385440153181771
Energy: 0.9647100684762555
Energy: 1.0223214129264424
Energy: 1.0234037244279215
Energy: 1.0200281251061198
Energy: 0.9474274166332284

minimum gb energy = 0.9370279672987188 eV
minimum distance =  2.28637013203624 Angstroms
sigma value = 437


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

Energy: 1.335530788490194
Energy: 0.9331959691985589
Energy: 1.0314295723705187
Energy: 0.9785503832143074
Energy: 0.9022961994965044
Energy: 0.9683861863296401
Energy: 0.9359325981302816
Energy: 1.033368939253452
Energy: 0.9924349618821854
Energy: 1.0860887651698394
Energy: 0.8839583210249723
Energy: 1.015601353111701
Energy: 0.8819722497717385
Energy: 1.0712131728987393
Energy: 0.9170231885279067
Energy: 0.8830653182257538
Energy: 1.0151790748372544
Energy: 0.9089557077485777
Energy: 1.0144183275509384
Energy: 0.8944450724964386
Energy: 0.9796208143616298
Energy: 0.9928861426748387
Energy: 1.0125956939314302
Energy: 0.9202005452881048
Energy: 0.8881383563815678
Energy: 0.9794146429272351
Energy: 0.9944115801238586
Energy: 0.9201929140991414
Energy: 0.9182530473655769
Energy: 0.9819232405471866
Energy: 0.9175152631565918
Energy: 0.9219631162949159
Energy: 0.9185702774240037
Energy: 0.9811783008869929
Energy: 0.9819615057941784
Energy: 0.9189932953129397
Energy: 0.9194513542000643
Energy: 1.0119396691851026
Energy: 0.9812121692105766
Energy: 0.8881368315026394
Energy: 0.900339204747002
Energy: 0.93865791132452
Energy: 0.916288975455252
Energy: 0.9276730280530303
Energy: 0.918988436582367
Energy: 0.9001421955394489
Energy: 0.9379218288030629
Energy: 0.9157825887326385
Energy: 0.911849327631361
Energy: 0.8808496827182646
Energy: 0.9422465955589746
Energy: 0.9173957368896393
Energy: 0.8813264739596762
Energy: 0.9008689602973194
Energy: 0.9531554410961732
Energy: 0.9428983055922951
Energy: 0.9164647430423513
Energy: 0.8813656631313402
Energy: 0.9098851734940269
Energy: 0.9537314050304476
Energy: 0.9868927467098744
Energy: 0.9802305139498902
Energy: 0.9790690749104213
Energy: 0.9160462832162416
Energy: 0.9200251940531285
Energy: 0.9865224050612751
Energy: 0.9789651196333512
Energy: 0.9786226053450575
Energy: 0.9161898395002475
Energy: 0.9202920495023645
Energy: 0.9925880693589949
Energy: 0.978414588272321
Energy: 0.9161554708445967
Energy: 0.907251886685639
Energy: 1.014800610796688
Energy: 0.9928180508544346
Energy: 0.8814223638290987
Energy: 0.9171670178827714
Energy: 0.9113178040704009
Energy: 1.0200225638955034
Energy: 0.9170685330761728
Energy: 1.0112936093540927
Energy: 0.93318736009563
Energy: 0.9213930144454882
Energy: 0.9171329547226446
Energy: 0.9154859943683733
Energy: 1.0112066552554304
Energy: 0.9320440104650194
Energy: 0.9199842530726022
Energy: 0.9160211400454155
Energy: 0.8862287272537909
Energy: 0.9157612039532181
Energy: 0.8876818450881618
Energy: 0.8868552914918928
Energy: 0.9468805146491044
Energy: 0.9097767904219696
Energy: 0.9157739349128471
Energy: 0.8882189414289359
Energy: 0.8910224064703073
Energy: 0.9448053843132237
Energy: 0.884275209548528
Energy: 0.8823070102509937
Energy: 0.9384469913716177
Energy: 0.9539937870513553
Energy: 0.8832261785012039
Energy: 0.8840088743238291
Energy: 0.882271615157464
Energy: 0.9346738669911898
Energy: 0.9540678253665138
Energy: 0.921487012385551
Energy: 0.8891022323855351
Energy: 0.888501055246179
Energy: 0.8877972535437808
Energy: 0.9887048246746248
Energy: 0.8853635329267324
Energy: 0.8848861366772567
Energy: 0.881705829194574
Energy: 0.8891569674192435
Energy: 0.9885541552605198
Energy: 0.8847127336466738
Energy: 0.8836895258272881
Energy: 0.8857364508561927
Energy: 1.0134360605673394
Energy: 1.0136026205693918
Energy: 0.885108368051396
Energy: 0.8842035451401421
Energy: 0.8858179738537376
Energy: 1.0151154191405778
Energy: 1.0123222575868314
Energy: 0.8835081303095615
Energy: 1.023173517721341
Energy: 0.8907720987529671
Energy: 1.0631838216473208
Energy: 0.8852595577926394
Energy: 0.8914756511036213
Energy: 1.0811184873609354
Energy: 0.9386977203587972
Energy: 1.1190710436030864
Energy: 0.8867771672980265
Energy: 0.940154107877111

minimum gb energy = 0.8808496827182646 eV
minimum distance =  2.34183190737587 Angstroms
sigma value = 33