Model name: model_name=Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Al__MO_279544746097_004
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.039798453450203
cohesive_energy=2.8885682080333717
mass=26.981538
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=[1.5056214591519898e-19, 2.0394747244839598e-19, 2.4380321839578e-19, 2.7578266401041997e-19, 3.0273287717093396e-19, 3.2568886398288595e-19, 3.45506186768832e-19, 3.6276803782354794e-19, 3.7786534824572995e-19, 3.9110253159583794e-19, 4.0281924932028003e-19, 4.1312765378343593e-19, 4.2215271476275795e-19, 4.3001940203569794e-19, 4.368606962628779e-19, 4.4276952368907e-19, 4.47787540906758e-19, 4.5198203933457e-19, 4.55405890801428e-19, 4.58123182372692e-19, 4.602012054669899e-19, 4.616447666142239e-19, 4.624891137003419e-19, 4.62763085904756e-19, 4.624682854040999e-19, 4.61529409896576e-19, 4.59845522254242e-19, 4.57251598283796e-19, 4.53577807262034e-19, 4.48627081462974e-19, 4.4224080539985e-19, 4.3414500686824795e-19, 4.23907098176988e-19, 4.1109449163489e-19, 3.95170458069564e-19, 3.7546688982463196e-19, 3.5114104199061e-19, 3.2126845864967997e-19, 2.8439276124153597e-19, 2.38749953292144e-19, 1.8202488956537398e-19, 1.112521013293554e-19, 2.22513495283188e-20, -9.064009893294539e-20, -2.3527162781973e-19, -4.2323418399070797e-19, -6.715058730187139e-19, -1.00609482820347e-18, -1.4683644437049537e-18, -2.12690550340134e-18, -3.1030796829648597e-18, -4.630739081717519e-18, -7.20260107991334e-18, -1.202935045103442e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.010092200757204281
Energy: 0.09461494204832485
Energy: 0.0943506212707857
Energy: 0.0937707077888967
Energy: 0.014584181847313594
Energy: 0.011204835664812725
Energy: 0.09435142687445186
Energy: 0.09497024705325839
Energy: 0.09334222655235051
Energy: 0.01366530269809212
Energy: 0.09257647618184994
Energy: 0.0974281622108977
Energy: 0.09438995371765826
Energy: 0.09491068852694158
Energy: 0.09439506006282851
Energy: 0.0927083997768303
Energy: 0.09712817977352477
Energy: 0.09413818146332578
Energy: 0.09538479688917374
Energy: 0.09396273585178963
Energy: 0.09476613618380846
Energy: 0.013120070150828968
Energy: 0.010418040612550987
Energy: 0.09295384721187923
Energy: 0.09374802247319076
Energy: 0.09692439155556754
Energy: 0.012360938809098186
Energy: 0.010472172788208431
Energy: 0.09269190088715736
Energy: 0.09449713069563896
Energy: 0.09400792496471992
Energy: 0.011356503604220785
Energy: 0.01129807917003896
Energy: 0.09609867887407365
Energy: 0.09262085617620122
Energy: 0.09447548992182905
Energy: 0.011763723631452687
Energy: 0.010656652101385843
Energy: 0.09456441115646355
Energy: 0.09246702495241352
Energy: 0.09350974936152749
Energy: 0.09334994804835244
Energy: 0.09509331343221895
Energy: 0.011659023737282118
Energy: 0.010807372473430964
Energy: 0.09303334146436955
Energy: 0.09364440429584203
Energy: 0.09460350665275921
Energy: 0.012368645367358561
Energy: 0.09598198716632163
Energy: 0.09472655377266075
Energy: 0.09295033621993332
Energy: 0.09333319470301435
Energy: 0.011001833349484364
Energy: 0.010544670135479594
Energy: 0.09529862177430107
Energy: 0.09244986736424199
Energy: 0.0938186049048843
Energy: 0.01151685743873645
Energy: 0.010620214744621341
Energy: 0.01063487385526919
Energy: 0.09524556792090565
Energy: 0.09377587794152138
Energy: 0.09518883541185767
Energy: 0.09604814684373869
Energy: 0.014307459572062033
Energy: 0.09603062241900039
Energy: 0.09339535330241722
Energy: 0.09577112303417228
Energy: 0.09528786492871917

minimum gb energy = 0.010092200757204281 eV
minimum distance =  2.81211713461904 Angstroms
sigma value = 3


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

Energy: 0.8226995082465641
Energy: 0.7325956725407031
Energy: 0.8356127114396587
Energy: 0.7313762001824109
Energy: 0.7534680181513328
Energy: 0.7496008236628932
Energy: 0.7327777274537601
Energy: 0.8372336909085634
Energy: 0.732189760833981
Energy: 0.8174205667631719
Energy: 0.5849435854436807
Energy: 0.782220236756213
Energy: 0.8425659072017426
Energy: 0.7306272819330462
Energy: 0.5855067892386684
Energy: 0.5862369891299861
Energy: 0.7445909886208205
Energy: 0.8371045535496454
Energy: 0.8375131823254689
Energy: 0.691831589606875
Energy: 0.7459928139228281
Energy: 0.8264655300705012
Energy: 0.7289304300564221
Energy: 0.6161073063451984
Energy: 0.5851144369677934
Energy: 0.5828508500279099
Energy: 0.8277360908376291
Energy: 0.7302032918736736
Energy: 0.5827357725991379
Energy: 0.5846968335927051
Energy: 0.5840918819027033
Energy: 0.8370016187991646
Energy: 0.6669178427093839
Energy: 0.5826489489732888
Energy: 0.58566223371772
Energy: 0.5834679032441152
Energy: 0.8041905802892281
Energy: 0.7294141027215048
Energy: 0.6714853125501068
Energy: 0.5851951042798472
Energy: 0.8806416359240943
Energy: 0.8183363235302801
Energy: 0.8842251197582951
Energy: 0.6750639796602906
Energy: 0.5870526236711011
Energy: 0.7322138445292268
Energy: 0.8155531525085746
Energy: 0.8283763211308635
Energy: 0.6661303597791824
Energy: 0.5886020523104547
Energy: 0.8152604160568291
Energy: 0.8196591966077499
Energy: 0.7437134577277078
Energy: 0.7565520554425929
Energy: 0.6857311223029982
Energy: 0.8148786163180026
Energy: 0.818854784712669
Energy: 0.6858266515250838
Energy: 0.6651537165326773
Energy: 0.6842891038457763
Energy: 0.8789127990553298
Energy: 0.834802696265616
Energy: 0.7685450172790637
Energy: 0.5874763515734581
Energy: 0.8119399229674829
Energy: 0.8763753055394183
Energy: 0.8330481525476607
Energy: 0.5868937494868987
Energy: 0.6646810932485601
Energy: 0.7476257796669911
Energy: 0.8797984398713038
Energy: 0.8163019284307758
Energy: 0.7972031322266853
Energy: 0.7995840135550183
Energy: 0.8171438019151398
Energy: 0.8800201099569327
Energy: 0.8146891851044538
Energy: 0.7528730074469099
Energy: 0.7524176024706822
Energy: 0.8181699190350036
Energy: 0.8846634016439086
Energy: 0.7418566312013019
Energy: 0.587432138218361
Energy: 0.7818523114360898
Energy: 0.7683337300020509
Energy: 0.8766104693019782
Energy: 0.648263505318365
Energy: 0.579716548670311
Energy: 0.7069413288161422
Energy: 0.8082155166120502
Energy: 0.8334472509060031
Energy: 0.6669357230563123
Energy: 0.670263782697569
Energy: 0.6546240774350408
Energy: 0.7275489337737768
Energy: 0.7293789317019821
Energy: 0.6700033152724241
Energy: 0.6668412537061376
Energy: 0.6514381644322087
Energy: 0.7286151432337804
Energy: 0.6550969278077724
Energy: 0.6891078028063279
Energy: 0.6847900447963816
Energy: 0.6656384651889178
Energy: 0.7299673319429604
Energy: 0.6936133220894422
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Energy: 0.7399138184687798
Energy: 0.6722348100729597
Energy: 0.7887906437529728
Energy: 0.9195094841887065
Energy: 0.8767162444522729
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Energy: 0.6705894906721431
Energy: 0.6744932265236769
Energy: 0.80638112659882
Energy: 0.8807906703426424
Energy: 0.7854393728750153
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Energy: 0.7834388672847958
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Energy: 0.8192979597300449
Energy: 0.6842315956076236
Energy: 0.6668408227887788
Energy: 0.7097762043806942
Energy: 0.8232634453790023
Energy: 0.81426303398019
Energy: 0.6681046787830655
Energy: 0.6771890425107332
Energy: 0.8515891895432909
Energy: 0.8464002176352738
Energy: 0.6762763895291563
Energy: 0.6661753618382283
Energy: 0.6793990463849053
Energy: 0.8791318523119134
Energy: 0.7847314296928514
Energy: 0.8175102370326108
Energy: 0.7495495597095875
Energy: 0.8120691786077321
Energy: 0.8158777915236107
Energy: 0.8787340040882671
Energy: 0.7971037513985265
Energy: 0.7947609041156398
Energy: 0.8143241245302568
Energy: 0.8782304042533412
Energy: 0.8130990209898914
Energy: 0.7529476506084624
Energy: 0.5796993182281696
Energy: 0.7623512439824847
Energy: 0.8823472999331878
Energy: 0.8829332807041953
Energy: 0.676441983423965
Energy: 0.6835887577641714
Energy: 0.9107869815797658
Energy: 0.8803434948789807
Energy: 0.8195287979553195
Energy: 0.6684838686681991
Energy: 0.688589672473007
Energy: 0.8257179881229466
Energy: 0.7274521505988942
Energy: 0.6530940863765496
Energy: 0.6728792682050865
Energy: 0.6501752157607543
Energy: 0.7281795549694975
Energy: 0.7324114610118578
Energy: 0.7512767691955013
Energy: 0.6727828240794863
Energy: 0.6889197059212792
Energy: 0.733439315706265
Energy: 0.728052156784936
Energy: 0.7570522258280062
Energy: 0.7323997929677194
Energy: 0.6891457646141412
Energy: 0.7292389453012725
Energy: 0.7291997623766245
Energy: 0.6847582848599169
Energy: 0.7326985887718827
Energy: 0.7325448592623484
Energy: 0.8777434901336258
Energy: 0.8323692056794322
Energy: 0.6669065488121839
Energy: 0.6696050499860344
Energy: 0.7837167055798224
Energy: 0.8798324716959472
Energy: 0.6854937466649894
Energy: 0.6677063632729414
Energy: 0.6713752231652205
Energy: 0.8144571634682671
Energy: 0.821254441045491
Energy: 0.6845240198671645
Energy: 0.6692020496611217
Energy: 0.7662862840033909
Energy: 0.8141369198027836
Energy: 0.8194668389329662
Energy: 0.8108613078297372
Energy: 0.8196480986763481
Energy: 0.7809351678878653
Energy: 0.8778370835481605
Energy: 0.761408888302767
Energy: 0.6796955464994578
Energy: 0.664700577783268
Energy: 0.824977646309666
Energy: 0.8747988642450428
Energy: 0.8778975110719225
Energy: 0.5899572212222437
Energy: 0.6716732656655878
Energy: 0.9112063342823057
Energy: 0.8847828108492571
Energy: 0.8132558602799511
Energy: 0.7521577017847431
Energy: 0.7526483144445834
Energy: 0.817337833968298
Energy: 0.8777841798234287
Energy: 0.8127297605622653
Energy: 0.7120639374098692
Energy: 0.8007079605092485
Energy: 0.818162833534824
Energy: 0.8786282342188657
Energy: 0.8212413684801695
Energy: 0.5803142324343902
Energy: 0.728247012870722
Energy: 0.8098516331160291
Energy: 0.8802825873627442
Energy: 0.769225795753402
Energy: 0.5962141215591336
Energy: 0.6950211562061144
Energy: 0.8102674757241833
Energy: 0.8036819309676805
Energy: 0.6892217303468523
Energy: 0.6700932410933739
Energy: 0.7440472726553803
Energy: 0.7274298722857957
Energy: 0.6841192886806439
Energy: 0.5878913476624467
Energy: 0.6698781837591479
Energy: 0.7203673110299614
Energy: 0.728548008749613
Energy: 0.6938489759760494
Energy: 0.6665622907489147
Energy: 0.6676449231117282
Energy: 0.6856017961375662
Energy: 0.7294745132190688
Energy: 0.6641931442254138
Energy: 0.6684123961522607
Energy: 0.6700562615413086
Energy: 0.6209791244526118
Energy: 0.7282326922891913
Energy: 0.6835713082177628
Energy: 0.5894002633116326
Energy: 0.670081331637903
Energy: 0.8799970163846345
Energy: 0.8323100128675384
Energy: 0.5844410540163952
Energy: 0.587577597006356
Energy: 0.7600097300283309
Energy: 0.8783035980632491
Energy: 0.8310596132594209
Energy: 0.8774889136410714
Energy: 0.8259495975479978
Energy: 0.6836981129743783
Energy: 0.8226897507974059
Energy: 0.814226555783649
Energy: 0.6834470684008928
Energy: 0.5851697847887075
Energy: 0.6842440735089769
Energy: 0.8215772987882116
Energy: 0.8145679055312194
Energy: 0.585250262118977
Energy: 0.5864740544788222
Energy: 0.836007299672823
Energy: 0.7314858584662907
Energy: 0.7320268793624807
Energy: 0.5877345676346212
Energy: 0.5858864968774605
Energy: 0.8380801158278856
Energy: 0.8027860912725822
Energy: 0.9085104393975458
Energy: 0.8159346331579427
Energy: 0.7324258084469868
Energy: 0.8361270493741624
Energy: 0.7310780451168705
Energy: 0.7539066378077806
Energy: 0.7494538122492287
Energy: 0.7327545216362874
Energy: 0.8358020836048554
Energy: 0.7308528012904204
Energy: 0.7529670186920561

minimum gb energy = 0.5796993182281696 eV
minimum distance =  2.45205373483884 Angstroms
sigma value = 75


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

Energy: 0.9192007028389236
Energy: 0.8847430547172265
Energy: 0.8849150995158384
Energy: 0.8848406723619646
Energy: 0.8616263622635687
Energy: 0.866311625779638
Energy: 0.8849628588837389
Energy: 0.7883697372519587
Energy: 0.8848967886340094
Energy: 0.9039232122069003
Energy: 0.8545523575873207
Energy: 0.9756785444459934
Energy: 0.8138453810003942
Energy: 0.7765826307025316
Energy: 0.7633382511749587
Energy: 0.793445094236138
Energy: 0.8773115468584383
Energy: 0.7639414404382713
Energy: 0.8016861740489569
Energy: 0.8293847047893523
Energy: 0.8342410884576558
Energy: 0.9593409918741955
Energy: 0.9353353465767891
Energy: 0.8270346566422703
Energy: 0.8340796488519621
Energy: 0.7915911054775517
Energy: 0.959279078568522
Energy: 0.9351186084976361
Energy: 0.7918337866396726
Energy: 0.7979645961527443
Energy: 0.7922459676760863
Energy: 0.7998120699724857
Energy: 0.9756316902139078
Energy: 0.7913917272405021
Energy: 0.8127841978026651
Energy: 0.7968659039762478
Energy: 0.804596093076452
Energy: 0.791357011600151
Energy: 0.9340231972282662
Energy: 0.835056792390406
Energy: 0.936321072714495
Energy: 0.8099709086682421
Energy: 0.8847571171685952
Energy: 0.9154908231598701
Energy: 0.9142473174267813
Energy: 0.9150859680915971
Energy: 0.7945357411807108
Energy: 0.8795993484848977
Energy: 0.912661672234069
Energy: 0.9291541759228611
Energy: 0.92687993733269
Energy: 0.921945041675966
Energy: 0.950707133271247
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Energy: 0.9120030369274152
Energy: 0.8961676284237307
Energy: 0.8512067708489189
Energy: 0.9514243316291225
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Energy: 0.8695436241608896
Energy: 0.9402454568817034
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Energy: 0.8585877053322593
Energy: 0.872363993778714
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Energy: 0.8234143432384333
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Energy: 0.9590962136973584
Energy: 0.8312906749672644
Energy: 0.8597829696504902
Energy: 0.8754566463622733
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Energy: 0.9520483193579854
Energy: 0.9318241111997891
Energy: 0.9229039498132023
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Energy: 0.7994093853992803
Energy: 0.8799250761479143
Energy: 0.9440445069190556
Energy: 0.8371757341565603
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Energy: 0.883569346862071
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Energy: 0.8347683323182974
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Energy: 0.8313332471529019
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Energy: 0.8435429684218254
Energy: 0.777945768950927
Energy: 0.8434389029662815
Energy: 0.9059359109177254
Energy: 0.9353606183750638
Energy: 0.8346630893073367
Energy: 0.8825826201829536
Energy: 0.8026531980880132
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Energy: 0.7873062370803848
Energy: 0.9138738679403512
Energy: 0.8173334136872996
Energy: 0.8525243335818262
Energy: 0.8808918349531831
Energy: 0.8357903647596782
Energy: 0.9356474723486586
Energy: 0.9391103863043988
Energy: 0.9150788526592482
Energy: 0.924469417794711
Energy: 0.9012520496816744
Energy: 0.9088572507737835
Energy: 0.941632738937829
Energy: 0.9068780880593822
Energy: 0.9180677712609533
Energy: 0.9097789458273148
Energy: 0.9026110856132264
Energy: 0.9302744819468746
Energy: 0.9057541234981961
Energy: 0.7865784744840276
Energy: 0.9245833852122387
Energy: 0.7787355866219028
Energy: 0.9330895642908279
Energy: 0.9263331637559548
Energy: 0.8238699828549703
Energy: 0.9152973172216262
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Energy: 0.8195661665190638
Energy: 0.8313051446815836
Energy: 0.7981763455509541
Energy: 0.7959819718058911
Energy: 0.8581324024071539
Energy: 0.8408957448790461
Energy: 0.7831722593901604
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Energy: 0.7659334032190209
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Energy: 0.8739759973920007
Energy: 0.8586674553509319
Energy: 0.7905335366473009
Energy: 0.8070377080304499
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Energy: 0.8382661094812768
Energy: 0.9460155751732211
Energy: 0.8271416782069425
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minimum gb energy = 0.7599501770999666 eV
minimum distance =  2.55232062062683 Angstroms
sigma value = 105


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

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Energy: 0.8726096727065679
Energy: 0.801265997305563
Energy: 0.910896244556705
Energy: 0.8445334340226147
Energy: 0.8673708518135858
Energy: 0.8738019565540435
Energy: 0.8012951952417315
Energy: 0.9528068328766647
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Energy: 0.9447962095519957
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Energy: 0.8121907996710095
Energy: 0.9061546557525593
Energy: 0.8583868366403599
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Energy: 0.8997124957552572
Energy: 0.8177338061169522
Energy: 0.945044419383778
Energy: 0.8540289610305569
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Energy: 0.9196540966925069
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Energy: 0.8653588702071675
Energy: 0.8857354819643086
Energy: 0.9432218264589995
Energy: 0.9198007354752642
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Energy: 0.8664072352087316
Energy: 0.8044218780065678
Energy: 0.8186067442044236
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Energy: 0.8604950347420287
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Energy: 0.8580998228264238
Energy: 0.9238991535675772
Energy: 0.8755253670655031
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Energy: 0.779167474662889
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Energy: 0.8582022951420905
Energy: 0.8353416586661258
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Energy: 0.8587876226319885
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Energy: 0.8351410376986925
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Energy: 0.8962471296601908
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Energy: 0.8617135039135966
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Energy: 0.8843363458327622
Energy: 0.8098767397793144
Energy: 0.9021109755944351
Energy: 0.8566722591987547
Energy: 0.8797080919081114
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Energy: 0.8100860066003065
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Energy: 0.8894132960193873
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Energy: 0.8176338369013916
Energy: 0.8776321293615994
Energy: 0.9088205610625665
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Energy: 0.847794935476886
Energy: 0.8181212202670016
Energy: 0.8542218163874998
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Energy: 0.8651497532460017
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Energy: 0.8533998787517717
Energy: 0.8021085888425957
Energy: 0.8023320705742195
Energy: 0.8873403739905563
Energy: 0.8882457777189219
Energy: 0.8597807367452993
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Energy: 0.8037650704838233
Energy: 0.9081515908789722
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Energy: 0.8032965970602658
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Energy: 0.8462894118620055
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Energy: 0.8041978617211998
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Energy: 0.909985828490495
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Energy: 0.9485855728990663
Energy: 0.9064418374363151
Energy: 0.8502597641152744
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Energy: 0.8362338980537164
Energy: 0.9171378435729116
Energy: 0.9517193481001801
Energy: 0.8775670488463196
Energy: 0.9318124409353237
Energy: 0.9007135168867813
Energy: 0.9407535758272505
Energy: 0.9260793753868294
Energy: 0.9238439338734155
Energy: 0.8999884021088023
Energy: 0.9483421075856285
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Energy: 0.9260419640833801
Energy: 0.9324587395834149
Energy: 0.9321103678034699
Energy: 0.8904654554292758
Energy: 0.8694761164147463
Energy: 0.8487198853039598
Energy: 0.943822054473682
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Energy: 0.8880409583879461
Energy: 0.873224491615021
Energy: 0.8756148120246579
Energy: 0.9554095583883508
Energy: 0.8036747454438912
Energy: 0.80111609275093
Energy: 0.8671291643791242
Energy: 0.8432949363506788
Energy: 0.8432845262999124
Energy: 0.8717690698520624
Energy: 0.8011064006346263
Energy: 0.8709642114005351
Energy: 0.8746298057084956
Energy: 0.852403799590419
Energy: 0.9504574812864603
Energy: 0.9511747984489132
Energy: 0.8435677800008248
Energy: 0.8678176510222531
Energy: 0.8695494093948309
Energy: 0.8521387662091665
Energy: 0.9444608550620476
Energy: 0.8745186133095302
Energy: 0.8716819911723896
Energy: 0.8471917039079205
Energy: 0.8726045370809145
Energy: 0.943493241955118
Energy: 0.8469751066144254
Energy: 0.9052949528491714
Energy: 0.8417803895255006
Energy: 0.9017168687770031
Energy: 0.9467515681814636
Energy: 0.8076062179568951
Energy: 0.9186151849962437
Energy: 0.8582931364878132
Energy: 0.9475758384365613
Energy: 0.9117213238832489
Energy: 0.9492391153927877
Energy: 0.9491307447951922
Energy: 0.8838169706525993
Energy: 0.9189014464424589
Energy: 0.8081157192410243
Energy: 0.9432425089644642
Energy: 0.9470221715507278
Energy: 0.842646047775888
Energy: 0.922742701019085
Energy: 0.8525657103332327
Energy: 0.8680675669195607
Energy: 0.8664170233974658
Energy: 0.8029818553523215
Energy: 0.86782648996485
Energy: 0.8530543772301158
Energy: 0.82595158636412
Energy: 0.8646346651456915
Energy: 0.8025343220627781
Energy: 0.8658233499448632
Energy: 0.9134147660142801
Energy: 0.861950706766278
Energy: 0.8627984672530725
Energy: 0.8186271189645329
Energy: 0.8780875087937375
Energy: 0.8725010471644116
Energy: 0.8634213178629416
Energy: 0.8642742595883275
Energy: 0.8146138009034164
Energy: 0.8779656084890543
Energy: 0.8639532804214167
Energy: 0.8767294347385071
Energy: 0.8012732282185628
Energy: 0.8634793751206412
Energy: 0.8251468636677965
Energy: 0.8462333257210473
Energy: 0.868255354893515
Energy: 0.8075857995442806
Energy: 0.864316588226754
Energy: 0.9181273955622975
Energy: 0.8674411947895894
Energy: 0.880825273656988
Energy: 0.8803157760856747
Energy: 0.8266517578360425
Energy: 0.8742422862015995
Energy: 0.8269037285052983
Energy: 0.8247226575284115
Energy: 0.8243992591623226
Energy: 0.8499902111986536
Energy: 0.8095201773806036
Energy: 0.8416571057071022
Energy: 0.8675679458476203
Energy: 0.8763626448750357
Energy: 0.8763986659784725
Energy: 0.8103266000644266
Energy: 0.8266990431914174
Energy: 0.8237597247798216
Energy: 0.8677720438001238
Energy: 0.8673417656983088
Energy: 0.8533595183281727
Energy: 0.8532251686384169
Energy: 0.816196053115096
Energy: 0.8130601312282301
Energy: 0.8600393852134776
Energy: 0.8092619806762924
Energy: 0.8718874601725465
Energy: 0.8148124444508649
Energy: 0.826379921813013
Energy: 0.8911595883475131
Energy: 0.8105332366725826
Energy: 0.8920047783052908
Energy: 0.8734963591161162
Energy: 0.8542208615882786
Energy: 0.8693474474598193
Energy: 0.8870927630590483
Energy: 0.9261669927508359
Energy: 0.9398577113139305
Energy: 0.8766043169385991
Energy: 0.9013974717026191
Energy: 0.8917027266942759
Energy: 0.8758371776126376
Energy: 0.8670811516842519
Energy: 0.7726394759454729
Energy: 0.7722107421168922
Energy: 0.8562473076391189
Energy: 0.8106538183865137
Energy: 0.8447957164313331
Energy: 0.7728058749407133
Energy: 0.7715564950340329
Energy: 0.8918420289976186
Energy: 0.8133598156199564
Energy: 0.7709344083012971
Energy: 0.7719965231326503
Energy: 0.7714304664485411
Energy: 0.7704880537820796
Energy: 0.7656677445948872
Energy: 0.7708533150056075
Energy: 0.7719944694858285
Energy: 0.771021620793988
Energy: 0.8396398470232089

minimum gb energy = 0.7656677445948872 eV
minimum distance =  2.48193390140067 Angstroms
sigma value = 165


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

Energy: 0.896575203554615
Energy: 0.8180418772031245
Energy: 0.8190610119739472
Energy: 0.8466531380068794
Energy: 0.8435529910671455
Energy: 0.8616048686940284
Energy: 0.8206807645118174
Energy: 0.8650479328196086
Energy: 0.8470956491614319
Energy: 0.8874139332882719
Energy: 0.8680684525515199
Energy: 0.8619102549782229
Energy: 0.8589138830836829
Energy: 0.8489044673493041
Energy: 0.8831959563111043
Energy: 0.8093045422351552
Energy: 0.8100889682495035
Energy: 0.848086614681717
Energy: 0.8620934324593661
Energy: 0.8511975547843025
Energy: 0.8168805337948496
Energy: 0.8841611545251341
Energy: 0.8927163624135291
Energy: 0.821273508557894
Energy: 0.8836382045325049
Energy: 0.8531292122556722
Energy: 0.8478312185570236
Energy: 0.8316923873316704
Energy: 0.8178983796021947
Energy: 0.8836157414256909
Energy: 0.8837593527950703
Energy: 0.815994981604187
Energy: 0.933002660073766
Energy: 0.8547496619975116
Energy: 0.861067345511061
Energy: 0.848618237065002
Energy: 0.8480445437819359
Energy: 0.8190718244125601
Energy: 0.8177879794650107
Energy: 0.8842690245366656
Energy: 0.8484101778350525
Energy: 0.8930966883438284
Energy: 0.9187674926320828
Energy: 0.9176652351632254
Energy: 0.8068123570826955
Energy: 0.8476088301370727
Energy: 0.8627290337125294
Energy: 0.8191374249841291
Energy: 0.8672072310010026
Energy: 0.8082186420520261
Energy: 0.8578322452258603
Energy: 0.8645289109835588
Energy: 0.8616432263066025
Energy: 0.8484375902252578
Energy: 0.8065102632540152
Energy: 0.8590253888495542
Energy: 0.8649170845146842
Energy: 0.8068301957038252
Energy: 0.8487402416714398
Energy: 0.8313176710046174
Energy: 0.9002149718979948
Energy: 0.9268780693749726
Energy: 0.8487344880139518
Energy: 0.8078518779369215
Energy: 0.9165583872666159
Energy: 0.8397941776739727
Energy: 0.849392016485492
Energy: 0.8481595265718752
Energy: 0.8646731937819256
Energy: 0.8668966473493395
Energy: 0.8627316920409603
Energy: 0.9060312807996649
Energy: 0.8637730506270541
Energy: 0.864033241653349
Energy: 0.9168168700601051
Energy: 0.8031913030043614
Energy: 0.896596379862012
Energy: 0.9430645256774958
Energy: 0.9470102191473596
Energy: 0.8101399674534486
Energy: 0.802955591172401
Energy: 0.8675482243473158
Energy: 0.9107945054342343
Energy: 0.9431759924556906
Energy: 0.9013625851687344
Energy: 0.8031641581383198
Energy: 0.8392252410816907
Energy: 0.8302876744749161
Energy: 0.8632944245081648
Energy: 0.8134811314920567
Energy: 0.9018364523500683
Energy: 0.8843105055445227
Energy: 0.8619740185202565
Energy: 0.8473772001774631
Energy: 0.9361151087726487
Energy: 0.8374540761346027
Energy: 0.8799064298117694
Energy: 0.811071879060071
Energy: 0.8484811392052163
Energy: 0.9289185379879206
Energy: 0.8837746449543669
Energy: 0.8160881511227229
Energy: 0.884492244842273
Energy: 0.8468464848224293
Energy: 0.8864361747550957
Energy: 0.8471350364814131
Energy: 0.8212002379337027
Energy: 0.9209632424675033
Energy: 0.882044498810171
Energy: 0.8847770406150758
Energy: 0.8479523219446418
Energy: 0.95084419205032
Energy: 0.8848112302197956
Energy: 0.8068982663831545
Energy: 0.8486222744335551
Energy: 0.8818641589730494
Energy: 0.8615084379402566
Energy: 0.9215806225469537
Energy: 0.9216995418572816
Energy: 0.8682885684350161
Energy: 0.8895730698985984
Energy: 0.8881866338054953
Energy: 0.807499739785483
Energy: 0.8067172511378862
Energy: 0.8157042364621133
Energy: 0.8902318893415354
Energy: 0.8593683715929167
Energy: 0.8618464031505075
Energy: 0.9392585634481168
Energy: 0.8317729052885057
Energy: 0.8470614143106152
Energy: 0.8545539878364706
Energy: 0.8580592809965374
Energy: 0.8485614409081806
Energy: 0.8083713846128211
Energy: 0.8832538203402404
Energy: 0.8547086504375516
Energy: 0.8293044024794958
Energy: 0.8485695788493071
Energy: 0.8723437231239114
Energy: 0.8488302933307612
Energy: 0.9434656965412775
Energy: 0.8948123603966569
Energy: 0.8207129895643919
Energy: 0.8086272063400093
Energy: 0.8416875421484182
Energy: 0.8481262634813049
Energy: 0.8486916184524984
Energy: 0.8206308173299415
Energy: 0.8652543569139695

minimum gb energy = 0.802955591172401 eV
minimum distance =  2.58544112700561 Angstroms
sigma value = 41


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

Energy: 0.7549198610925915
Energy: 0.6742400901086419
Energy: 0.7447060414483136
Energy: 0.6733700374533945
Energy: 0.6745286806362605
Energy: 0.7723943675833886
Energy: 0.6740497316641934
Energy: 0.6745255398738167
Energy: 0.7433148583620491
Energy: 0.7929871896379395
Energy: 0.747255147282936
Energy: 0.7857668600877531
Energy: 0.6742622635875843
Energy: 0.6741819987100729
Energy: 0.7824365637392144
Energy: 0.7867355675700659
Energy: 0.6737257605203072
Energy: 0.7399182252180369
Energy: 0.7954040271512464
Energy: 0.841404246038842
Energy: 0.7400483974322553
Energy: 0.7420158951113695
Energy: 0.743257313936801
Energy: 0.734067582391613
Energy: 0.8222944037523199
Energy: 0.7835145949060998
Energy: 0.7735926844192847
Energy: 0.7895421137727889
Energy: 0.8052695541030434
Energy: 0.7905306214875875
Energy: 0.7679351488517996
Energy: 0.7403635471285605
Energy: 0.8492326542924757
Energy: 0.7939159491299436
Energy: 0.7878910262654438
Energy: 0.7966652744420998
Energy: 0.7407092599112762
Energy: 0.7410523741213508
Energy: 0.7940668025491748
Energy: 0.8346741558996246
Energy: 0.8095236794521984
Energy: 0.7526650133741748
Energy: 0.7903554976266711
Energy: 0.7887331650466796
Energy: 0.784096190186557
Energy: 0.7894600451361213
Energy: 0.7385133827853456
Energy: 0.7410417304432629
Energy: 0.8083501978111726
Energy: 0.825129681446132
Energy: 0.7913819038800951
Energy: 0.7919899141870911
Energy: 0.7975142258415847
Energy: 0.729746676332091
Energy: 0.8230602069373447
Energy: 0.7369878435589429
Energy: 0.7914001318958811
Energy: 0.8123732061448793
Energy: 0.728227772077885
Energy: 0.8022061579471338
Energy: 0.7808613343067727
Energy: 0.8316744301692027
Energy: 0.7883533703838591
Energy: 0.7287592146146007
Energy: 0.8100864418845736
Energy: 0.7473664692412965
Energy: 0.7374846530814078
Energy: 0.7384718363864461
Energy: 0.717017100546013
Energy: 0.7449585392981748
Energy: 0.7728436891929413
Energy: 0.6978123499247294
Energy: 0.696511568574658
Energy: 0.7143439362345081
Energy: 0.7409180531401257
Energy: 0.7390786746566499
Energy: 0.7154511841100634
Energy: 0.7156331223645129
Energy: 0.7497975423539666
Energy: 0.7623910724409765
Energy: 0.7859924278488291
Energy: 0.6897727121409892
Energy: 0.7409425006786126
Energy: 0.7277788958673851
Energy: 0.714568382351309
Energy: 0.7855698768374778
Energy: 0.7338364137063593
Energy: 0.7388014109401418
Energy: 0.6972010626261519
Energy: 0.6979886385162454
Energy: 0.7683099286636651
Energy: 0.6876700414100555
Energy: 0.7144992091130363
Energy: 0.7114033667973416
Energy: 0.7921713960842385
Energy: 0.7638314204937394
Energy: 0.7125733923615167
Energy: 0.7485691598354887
Energy: 0.7792247207708
Energy: 0.83235048489422
Energy: 0.7317477829546628
Energy: 0.7116986742304738
Energy: 0.6742499499400743
Energy: 0.7478509951408382
Energy: 0.7953696771047764
Energy: 0.7316817423987918
Energy: 0.7487137290011564
Energy: 0.6752491005098975
Energy: 0.7494176634643273
Energy: 0.7867237517065622
Energy: 0.6744888453242956
Energy: 0.7472677333512255
Energy: 0.6761208754747298
Energy: 0.7201063370563356
Energy: 0.8012244519029943
Energy: 0.6742089091461896
Energy: 0.6766014517576604
Energy: 0.6748382953087375
Energy: 0.7464009400079368
Energy: 0.8211221578100061
Energy: 0.6742639142958554
Energy: 0.7463374428208897
Energy: 0.6737362761555509
Energy: 0.7924542628657579
Energy: 0.6880611307338365
Energy: 0.674103166558979
Energy: 0.7445387502968206
Energy: 0.6735398376296211
Energy: 0.8041869543586116
Energy: 0.7195711309342132
Energy: 0.6747526258735815
Energy: 0.7505964438108803
Energy: 0.6739204693315032
Energy: 0.793093398334172
Energy: 0.7910415437377891
Energy: 0.6748896533247682
Energy: 0.7496941188871449
Energy: 0.674156110448094
Energy: 0.8158915959501977
Energy: 0.8061002311837622
Energy: 0.6777675953218166
Energy: 0.7932536900105783
Energy: 0.7891205020526084
Energy: 0.8140786864306381
Energy: 0.7765437882807426
Energy: 0.6787418957300234
Energy: 0.7964653962357949
Energy: 0.7949248778534381
Energy: 0.7816048682904054
Energy: 0.8137461659477723
Energy: 0.6742224625930997
Energy: 0.7996160362809692
Energy: 0.8212265940075306
Energy: 0.826515811725323
Energy: 0.812703901600071
Energy: 0.6778467335842056
Energy: 0.7916422310722104
Energy: 0.8224024776876326
Energy: 0.8063377661273358
Energy: 0.8058100565426569
Energy: 0.7511355792163825
Energy: 0.7627214420655276
Energy: 0.822332778458838
Energy: 0.821902236165266
Energy: 0.8024310418260577
Energy: 0.7142034918513906
Energy: 0.7457799053661066
Energy: 0.8232553245025173
Energy: 0.8238622422554833
Energy: 0.740833415198526
Energy: 0.7659532131318458
Energy: 0.8077578671734872
Energy: 0.7678462736663071
Energy: 0.8241760422380249
Energy: 0.7311841907240271
Energy: 0.7432983966819201
Energy: 0.7484969669713325
Energy: 0.7100948065335932
Energy: 0.7780361298822951
Energy: 0.7312840385930602
Energy: 0.7348973706211532
Energy: 0.8250573902092061
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Energy: 0.838849555023397
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Energy: 0.6764071637172762
Energy: 0.6907988434353867
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Energy: 0.7308341064442371
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Energy: 0.8360057720158833
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Energy: 0.8037270428372345
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Energy: 0.7821744475672463
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Energy: 0.7932614274062675
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Energy: 0.8305295865906205
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Energy: 0.8255977303190744
Energy: 0.7762158258605886
Energy: 0.6739754027713734
Energy: 0.6982923793109949
Energy: 0.7418353816977694
Energy: 0.742768668789473
Energy: 0.6758198064203443
Energy: 0.727024263267811
Energy: 0.7426354671516125
Energy: 0.7393795182390998
Energy: 0.8296183554864764
Energy: 0.7520519511442509
Energy: 0.7328794269071695
Energy: 0.7605686974235549
Energy: 0.7843606583361233
Energy: 0.6904684221414836
Energy: 0.6972008473238747
Energy: 0.712476842165912
Energy: 0.6745708011935282
Energy: 0.8017017206887702
Energy: 0.7403936398361884
Energy: 0.7872402739152268
Energy: 0.7322780410076039
Energy: 0.731978986543803
Energy: 0.8150905991661975
Energy: 0.7367292261864153
Energy: 0.6775818279030873
Energy: 0.7436161824055119
Energy: 0.7322288834994748
Energy: 0.740151324273482
Energy: 0.7440790030961888
Energy: 0.786054683370438
Energy: 0.7510771843309461
Energy: 0.7381801388282512
Energy: 0.8013627961290527
Energy: 0.755585484059434
Energy: 0.7432515960349603
Energy: 0.674294033756418
Energy: 0.783000908728835
Energy: 0.7874034757410111
Energy: 0.7408466246703265
Energy: 0.675343253543042
Energy: 0.748609872590618
Energy: 0.7910561865649373
Energy: 0.6741504964489868
Energy: 0.6750398138231596
Energy: 0.738133901887079
Energy: 0.6736384744697237
Energy: 0.7807983046932521
Energy: 0.6741942594195612
Energy: 0.6743404279422607
Energy: 0.673933267732995
Energy: 0.7274660138984244

minimum gb energy = 0.6733700374533945 eV
minimum distance =  2.58524897980586 Angstroms
sigma value = 185


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

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Energy: 0.5625308283801539
Energy: 0.6313591985332414
Energy: 0.4815996655799765
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Energy: 0.3810009167280001
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Energy: 0.38372528406686046
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Energy: 0.32988533274532217
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Energy: 0.4813258104051745
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Energy: 0.5893784026412332
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Energy: 0.5062385674606724
Energy: 0.5442906355714078
Energy: 0.5696534411443203
Energy: 0.49599945683050517
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Energy: 0.3307942952936925
Energy: 0.6329201322280769
Energy: 0.6037347676062481
Energy: 0.5139928020831133
Energy: 0.5100230548721438
Energy: 0.42219336063225643
Energy: 0.47965641712213375
Energy: 0.524429475250756
Energy: 0.5036947027890796
Energy: 0.33134695192218955
Energy: 0.3316847760783246
Energy: 0.5014718757872616
Energy: 0.4811430882361987
Energy: 0.5005352494075583
Energy: 0.42335622599343314
Energy: 0.42546857448338204
Energy: 0.5279390073697352
Energy: 0.6086299027319555
Energy: 0.498725540982154
Energy: 0.4816405806985885
Energy: 0.5659338216916886
Energy: 0.5491390210282935
Energy: 0.5139397539845234
Energy: 0.4822700482425714
Energy: 0.5050174599377244
Energy: 0.5066041135154838
Energy: 0.5875418100519504
Energy: 0.611027264597843
Energy: 0.5260507776980281
Energy: 0.549442899024049
Energy: 0.48094328384043794
Energy: 0.5425568653103141
Energy: 0.5085177667315217
Energy: 0.6257519679542558
Energy: 0.33078237940401756
Energy: 0.49893582597675085
Energy: 0.5202955413725692
Energy: 0.6058371967284486
Energy: 0.5721653840527876

minimum gb energy = 0.32988533274532217 eV
minimum distance =  2.62807982816108 Angstroms
sigma value = 33


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

Energy: 0.704100283800003
Energy: 0.6903472568968627
Energy: 0.6980823413364144
Energy: 0.6894410095649949
Energy: 0.6817783177776122
Energy: 0.6799300275010782
Energy: 0.6904365073119417
Energy: 0.6909675652278372
Energy: 0.7024052099955398
Energy: 0.693195967856763
Energy: 0.7054035509002724
Energy: 0.6914708597944806
Energy: 0.6902684970095586
Energy: 0.6881662278349919
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Energy: 0.7032545904291249
Energy: 0.700230420988239
Energy: 0.6928342950066501
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Energy: 0.6971438877436023
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Energy: 0.6870082565746816
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Energy: 0.6971314630310584
Energy: 0.7019632744587978
Energy: 0.696392809615949
Energy: 0.6901414907628061
Energy: 0.6863976786563354
Energy: 0.7034792186287898
Energy: 0.7009222698114128
Energy: 0.6935148560672992
Energy: 0.7041404490640514
Energy: 0.6896925899069775
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Energy: 0.7014348048507126
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Energy: 0.6939648829549975
Energy: 0.6975278060785326
Energy: 0.6846964609895371
Energy: 0.7095932962629015
Energy: 0.7012973334011204
Energy: 0.7051650802757713
Energy: 0.6980947668045604
Energy: 0.7026655536218902
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Energy: 0.7038866275411074
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Energy: 0.6919385039071012
Energy: 0.6853281254605885
Energy: 0.6958383786662995
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Energy: 0.6919350958258204
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Energy: 0.6951810903038217
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Energy: 0.692654941964328
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Energy: 0.6991069243041158
Energy: 0.700979540126853
Energy: 0.6960231218291397
Energy: 0.6994945028809839
Energy: 0.7038469172111478
Energy: 0.6994342547359834
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Energy: 0.7087686711984269
Energy: 0.7033461964433808
Energy: 0.7063071532284113
Energy: 0.7020301183973715
Energy: 0.6875487298169033
Energy: 0.6922411651244781
Energy: 0.6984865980930389
Energy: 0.7007841525221739
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Energy: 0.6865766329475818
Energy: 0.7013418829757542
Energy: 0.7057822205412646
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Energy: 0.6881795616535097
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Energy: 0.701829798373536
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Energy: 0.7510175463256983
Energy: 0.697467209210795
Energy: 0.688373301108848
Energy: 0.6980370559805377
Energy: 0.6959964025541329
Energy: 0.6898125125001595
Energy: 0.7008277657481973
Energy: 0.6955156308899649
Energy: 0.7032645934088874
Energy: 0.6966874745661777
Energy: 0.6909865107934579
Energy: 0.6837506396194173
Energy: 0.6872815447321459
Energy: 0.6989917518872794
Energy: 0.6946855406498157
Energy: 0.6898578905716791
Energy: 0.6908131943643607
Energy: 0.6901835201856195
Energy: 0.6847629757032123
Energy: 0.6947524969370495
Energy: 0.6941547479060759
Energy: 0.6964377661960617
Energy: 0.6933362753283077
Energy: 0.6883059481798738
Energy: 0.6992597628772738
Energy: 0.6955996265580874
Energy: 0.6926076391444195
Energy: 0.6903411188159573
Energy: 0.6896212962471794
Energy: 0.6882523231098777
Energy: 0.6985462728306675
Energy: 0.6956233114304781
Energy: 0.6909922225326542
Energy: 0.6901856769845566
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Energy: 0.7025503467895429
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Energy: 0.6858211337695356
Energy: 0.682086000803745
Energy: 0.6899806329724796
Energy: 0.6897634407880371
Energy: 0.6984884451265894
Energy: 0.6929025715575522

minimum gb energy = 0.6774759121618572 eV
minimum distance =  2.55407759120756 Angstroms
sigma value = 219


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

Energy: 0.9344353942698957
Energy: 0.94951760386475
Energy: 0.9558524631806997
Energy: 0.9460246123937635
Energy: 0.955000354060223
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Energy: 0.9414519179946346
Energy: 0.9600300211252032
Energy: 0.9607111377999537
Energy: 0.9407121404903266
Energy: 0.9433541901984382
Energy: 0.9574945357294673
Energy: 0.9512176943976338
Energy: 0.9613227927999103
Energy: 0.9403977901937772
Energy: 0.9431434253520965
Energy: 0.9566184679993313
Energy: 0.9500080289628511
Energy: 0.9390367492665758
Energy: 0.9697136159620549
Energy: 0.9418353005078381
Energy: 0.9487263838575043
Energy: 0.9513046249345448
Energy: 0.9493603731458151
Energy: 0.9684299253947913
Energy: 0.9448854392317749
Energy: 0.948583436682676
Energy: 0.9459731596756846
Energy: 0.9479880277574613
Energy: 0.9461876061517971
Energy: 0.9460207376109665
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Energy: 0.9501647225267413
Energy: 0.9479365734570429
Energy: 0.9357517983106863
Energy: 0.94596097325661
Energy: 0.9479020046530544
Energy: 0.9487593243721023
Energy: 0.9563923169219886
Energy: 0.9507603922995231
Energy: 0.9447812030490639
Energy: 0.962842138931766
Energy: 0.957852053241047
Energy: 0.9557956573189736
Energy: 0.9501712622017624
Energy: 0.9409847357166733
Energy: 0.9633895194314813
Energy: 0.9607078196285419
Energy: 0.9655227547120137
Energy: 0.93820735200423
Energy: 0.960176119045654
Energy: 0.9459882420708425
Energy: 0.9414905085653529
Energy: 0.9364437120128685
Energy: 0.9397536084542416
Energy: 0.9605024887277674
Energy: 0.9587871406224427
Energy: 0.9452507922723157
Energy: 0.96067288250916
Energy: 0.9375478522256179
Energy: 0.945322838666515
Energy: 0.9470541462250932
Energy: 0.9505136153482513
Energy: 0.9576812372615953
Energy: 0.935548004802099
Energy: 0.9409080990695068
Energy: 0.9488687871582181
Energy: 0.9544296430751087
Energy: 0.9715446682612547
Energy: 0.9487742731518181
Energy: 0.942370177147527
Energy: 0.9416098607599868
Energy: 0.9491714355588359
Energy: 0.9530080446253142
Energy: 0.9703983969947987
Energy: 0.9425787107569487
Energy: 0.9455124066316815
Energy: 0.9488280782726106

minimum gb energy = 0.9344353942698957 eV
minimum distance =  2.58149738809111 Angstroms
sigma value = 15


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

Energy: 1.076022663728434
Energy: 1.069398885920613
Energy: 1.1090929014891437
Energy: 1.0664978449978324
Energy: 1.0897710545447645
Energy: 1.059877906381853
Energy: 1.071715966098647
Energy: 1.0860260403380544
Energy: 1.071983138812626
Energy: 1.0974596816206175
Energy: 1.0888451916341613
Energy: 1.0753589185203962
Energy: 1.0677706575439
Energy: 1.0671677173406648
Energy: 1.0747390417538705
Energy: 1.078073343520423
Energy: 1.0711062825842543
Energy: 1.0685059730069006
Energy: 1.0669082887730712
Energy: 1.075958917714821
Energy: 1.084830070184851
Energy: 1.0761629818105682
Energy: 1.074365973275537
Energy: 1.0771222898700137
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minimum gb energy = 1.0565171724585127 eV
minimum distance =  2.53731480183351 Angstroms
sigma value = 293


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

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Energy: 1.0470519097168554
Energy: 1.0466296281571905
Energy: 1.0542981034265082
Energy: 1.0831770933741403
Energy: 1.1033216718253789
Energy: 1.0534175176111158
Energy: 1.113607585644786
Energy: 1.112468684679142
Energy: 1.0518605401691128
Energy: 1.1038683854348235
Energy: 1.0524343568053631
Energy: 1.1140579787683502
Energy: 1.1145713014278669
Energy: 1.0522890538986345
Energy: 1.066231846469678
Energy: 1.1027034595785632
Energy: 1.0537203514562818
Energy: 1.052414072489365
Energy: 1.0811490830080681
Energy: 1.1031699161438302
Energy: 1.1246090431254214
Energy: 1.0540262646741088
Energy: 1.053178110233097
Energy: 1.053809737897285
Energy: 1.1042734018930382
Energy: 1.049065753107375
Energy: 1.1222087383838288
Energy: 1.098830514823712
Energy: 1.051969127348272
Energy: 1.1044874222795125
Energy: 1.054166287926968
Energy: 1.1342177569003924
Energy: 1.0986070932690206
Energy: 1.0520279922959135
Energy: 1.103844336068994
Energy: 1.0729576108018575
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Energy: 1.0526475959321062
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Energy: 1.0521749509867977
Energy: 1.0544807905560494
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Energy: 1.0535521245809432
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Energy: 1.0863385559570526
Energy: 1.0999189286364501
Energy: 1.051925576509526
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Energy: 1.0989947139973946
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Energy: 1.1004881699333422
Energy: 1.0516278649035689
Energy: 1.0558020345825108
Energy: 1.0993461190769833
Energy: 1.0516895440277427
Energy: 1.0526275469040784
Energy: 1.1004061897589017
Energy: 1.0528933647854983
Energy: 1.0812310086685308
Energy: 1.0519996951918433
Energy: 1.0531766549573403
Energy: 1.0997467277888548
Energy: 1.052823347022416
Energy: 1.0825217237754554
Energy: 1.0518628535993206
Energy: 1.051705298951082
Energy: 1.0511250057671349
Energy: 1.0750629458184424
Energy: 1.0981003669228506
Energy: 1.124276042562915
Energy: 1.090182535660295
Energy: 1.0517009052618145
Energy: 1.0739862576843568
Energy: 1.09896465197653
Energy: 1.0729826004491603
Energy: 1.0520018633057933
Energy: 1.0552697510988618
Energy: 1.103257233690357
Energy: 1.1059098700494938
Energy: 1.046844798071668
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Energy: 1.053288213399795
Energy: 1.1061525004703003
Energy: 1.0528624872071781
Energy: 1.087334138525462
Energy: 1.0538136688444204
Energy: 1.1031993177540902
Energy: 1.08492159968905
Energy: 1.1232574239848239
Energy: 1.086124115905541
Energy: 1.0544390012587477
Energy: 1.054228640753962
Energy: 1.0851437198281757
Energy: 1.0805360165566613
Energy: 1.0731803231912433
Energy: 1.0522503878264422
Energy: 1.140578018992135
Energy: 1.046148766202039
Energy: 1.0530934288513416
Energy: 1.0549443846682673
Energy: 1.052324177557668
Energy: 1.0466939384571317
Energy: 1.0480129131889744
Energy: 1.0526761867996752
Energy: 1.0537159418097202
Energy: 1.0535336248619434
Energy: 1.0487706578260694
Energy: 1.0478067552044492
Energy: 1.0843784064510762
Energy: 1.0532276545416495
Energy: 1.0544889767278218
Energy: 1.0481146172347124
Energy: 1.047491292588725
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Energy: 1.0541693231277705
Energy: 1.084801995876505
Energy: 1.0981282860214916
Energy: 1.1002228323426337
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Energy: 1.0553213841464297
Energy: 1.0811008886703926
Energy: 1.099475343148602
Energy: 1.05495513554648
Energy: 1.0515125819791653
Energy: 1.1001701575291996
Energy: 1.080512014798814
Energy: 1.0509388576242666
Energy: 1.1013393635212974
Energy: 1.0523594163404275
Energy: 1.0999398484881588
Energy: 1.0802006031632927
Energy: 1.0503593603578902
Energy: 1.1010980183593913
Energy: 1.0523195665715321
Energy: 1.0518076441032247
Energy: 1.0519136453566316
Energy: 1.0798744425244993
Energy: 1.0807298839660207
Energy: 1.097727757276739
Energy: 1.0842650732968586
Energy: 1.051394656911109
Energy: 1.1205633841545337
Energy: 1.0804843856342008
Energy: 1.0515884796861117
Energy: 1.1292664476633945
Energy: 1.0521497790527756
Energy: 1.0528509166799975
Energy: 1.0880863253261104
Energy: 1.0505630711919391
Energy: 1.0990552638676845
Energy: 1.0520028231199998
Energy: 1.0532373910025878
Energy: 1.0879499552716605
Energy: 1.051011336468787
Energy: 1.0522380372345588
Energy: 1.0825720559985375
Energy: 1.052959892249621
Energy: 1.0543208573464664
Energy: 1.0516868862910906
Energy: 1.052515601559215
Energy: 1.0812171431372555
Energy: 1.0534458464336256
Energy: 1.0547390380601156
Energy: 1.0519919262390816
Energy: 1.0728768485824267
Energy: 1.0985779740854211
Energy: 1.074628519232159
Energy: 1.051516589638016
Energy: 1.052815260676128
Energy: 1.0729735210986295
Energy: 1.0985814722141578
Energy: 1.0794365177048322
Energy: 1.0508527107301104
Energy: 1.050159523591539
Energy: 1.052465157236091
Energy: 1.1073389312480286
Energy: 1.0536781973740017
Energy: 1.1003007178643887
Energy: 1.103627384200614
Energy: 1.0468123419292494
Energy: 1.1058789734365457
Energy: 1.0536283526302879
Energy: 1.0915481024020246
Energy: 1.1033099688683998
Energy: 1.0535503207127186
Energy: 1.0990698778363195
Energy: 1.1322062422049801
Energy: 1.051871702219777
Energy: 1.1040430489981308
Energy: 1.0527333678604984
Energy: 1.1233705404666685
Energy: 1.113319759831612
Energy: 1.0522611093094965
Energy: 1.103852338532124
Energy: 1.048613480864513
Energy: 1.0733690551747634
Energy: 1.051965652863076
Energy: 1.0830341130082197
Energy: 1.1136727075969135
Energy: 1.0479369908540601
Energy: 1.073923489317917
Energy: 1.0523665056888136
Energy: 1.0832347293257407
Energy: 1.1412911602064313

minimum gb energy = 1.046148766202039 eV
minimum distance =  2.55428705558749 Angstroms
sigma value = 293


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

Energy: 1.0589016378363971
Energy: 1.0558528524985131
Energy: 1.1173857304841637
Energy: 1.0565251315948498
Energy: 1.0436125915691261
Energy: 1.058543261707723
Energy: 1.0551412865661363
Energy: 1.1179482228929272
Energy: 1.0551332253011374
Energy: 1.0440253946377736
Energy: 1.121539271755382
Energy: 1.0539110843057984
Energy: 1.0532917764651923
Energy: 1.053836752451697
Energy: 1.0533237900676509
Energy: 1.123143027054397
Energy: 1.05455771424384
Energy: 1.0453786245640613
Energy: 1.0545611059658255
Energy: 1.0530372184077925
Energy: 1.0554836291236893
Energy: 1.0549521227116132
Energy: 1.0575712282147773
Energy: 1.0564122273814542
Energy: 1.1233087056354865
Energy: 1.0544701976362876
Energy: 1.0544328558760578
Energy: 1.0551915282350308
Energy: 1.0558644413440137
Energy: 1.1217875254018852
Energy: 1.1187963998052277
Energy: 1.0446603764050197
Energy: 1.045135510668875
Energy: 1.053605245266663
Energy: 1.1213944474340676
Energy: 1.1180584865240841
Energy: 1.0452123525678998
Energy: 1.0442532791584407
Energy: 1.054414060507357
Energy: 1.0496445877911789
Energy: 1.0547885537292132
Energy: 1.044887136512424
Energy: 1.0457320697556787
Energy: 1.0560282361839513
Energy: 1.054827333645649
Energy: 1.0540718395584456
Energy: 1.0450878066917826
Energy: 1.0451840812254425
Energy: 1.0546325011914712
Energy: 1.0539604356214185
Energy: 1.0543978330962434
Energy: 1.1183354081659278
Energy: 1.0543563823797175
Energy: 1.055699071067221
Energy: 1.0442219296232955
Energy: 1.0551020309559316
Energy: 1.117470864013953
Energy: 1.0552479154010768
Energy: 1.0577129627043662
Energy: 1.0437951345952996
Energy: 1.1179168404866349
Energy: 1.0490065382146114
Energy: 1.0536150565440194
Energy: 1.0539675854338373
Energy: 1.0547239996955704
Energy: 1.1181281590216972
Energy: 1.0481943384617551
Energy: 1.0532664975659938
Energy: 1.0536688429241408
Energy: 1.054244157974788
Energy: 1.0542721387839133
Energy: 1.1245931865457697
Energy: 1.0560617376543258
Energy: 1.0456101799805064
Energy: 1.0442116899111022
Energy: 1.0548537051487044
Energy: 1.1268941047014105
Energy: 1.0570745132116948
Energy: 1.058843417824156
Energy: 1.0441093189649222
Energy: 1.0539404099017227
Energy: 1.045082046276558
Energy: 1.0533654400799861
Energy: 1.0459574628742738
Energy: 1.1219002021409654
Energy: 1.0533917130135404
Energy: 1.0534930265612443
Energy: 1.0530605255264176
Energy: 1.0475074609851323
Energy: 1.1211298466297117
Energy: 1.0577359545818137
Energy: 1.0575629735257972
Energy: 1.1276013507818088
Energy: 1.1179158887741776
Energy: 1.0567497798245857
Energy: 1.0579526117747275
Energy: 1.0577622600155088
Energy: 1.1285719199900346
Energy: 1.1197743321681253
Energy: 1.0552692823952166
Energy: 1.0445507697041598
Energy: 1.0535026839632136
Energy: 1.0584771799315693
Energy: 1.1183254197582018
Energy: 1.1218788429251958
Energy: 1.0474543291052076
Energy: 1.0534839394638473
Energy: 1.0480807235184955
Energy: 1.1180753301296447
Energy: 1.1232914843700212
Energy: 1.0590264042883666
Energy: 1.056000534401541
Energy: 1.0578007918412682
Energy: 1.05661264559887
Energy: 1.0435847645519494
Energy: 1.0591851655730384
Energy: 1.0551603315987503
Energy: 1.0565654932494901
Energy: 1.0554572388775063
Energy: 1.0439286206797045
Energy: 1.121400537815603
Energy: 1.0539791499651427
Energy: 1.0532598921151122
Energy: 1.053748258438918
Energy: 1.0530165988204432
Energy: 1.1228794076359272
Energy: 1.0545021546944253
Energy: 1.0454973754034937
Energy: 1.054312775051809
Energy: 1.0531760503774257
Energy: 1.0558703681246369
Energy: 1.055224148411412
Energy: 1.0580052718727457
Energy: 1.056613731211341
Energy: 1.1235713739868962
Energy: 1.0547233061966588
Energy: 1.054514811388719
Energy: 1.055394786549665
Energy: 1.118249322408176
Energy: 1.1218395417946587
Energy: 1.1191585397699486
Energy: 1.0445984526671979
Energy: 1.0452346322472312
Energy: 1.0534330657473974
Energy: 1.1219698487789487
Energy: 1.1184344824462031
Energy: 1.0450416932787636
Energy: 1.0443717981477667
Energy: 1.0542087654491696
Energy: 1.1225578378898575
Energy: 1.0550949639451737
Energy: 1.0450835530584552
Energy: 1.0455490038836188
Energy: 1.0560927976337589
Energy: 1.0548727978310062
Energy: 1.0542079717478736
Energy: 1.0450695618169616
Energy: 1.0451079543439248
Energy: 1.0547149605262778
Energy: 1.0540705812777458
Energy: 1.0543132336232712
Energy: 1.1184204952951289
Energy: 1.0543368881074826
Energy: 1.0553771171941508
Energy: 1.044524646054676
Energy: 1.0549578977685492
Energy: 1.1175900646249828
Energy: 1.0550264993963772
Energy: 1.0574570664136294
Energy: 1.0439970794195805
Energy: 1.1181216267333012
Energy: 1.0499058012687394
Energy: 1.0536914170797629
Energy: 1.0539783834899885
Energy: 1.0553246883535343
Energy: 1.1181669261308889
Energy: 1.0482961665907355
Energy: 1.0532848062297149
Energy: 1.0537483338020852
Energy: 1.0545690746857037
Energy: 1.0542035665401166
Energy: 1.1242180937190653
Energy: 1.0560246121783117
Energy: 1.046146991802807
Energy: 1.0444642052587174
Energy: 1.054396093982026
Energy: 1.1267547866773024
Energy: 1.0564929688041713
Energy: 1.0586545659432467
Energy: 1.0444642152462047
Energy: 1.0541655391830143
Energy: 1.0448783000119215
Energy: 1.053418620651956
Energy: 1.0457796594583368
Energy: 1.1218634851240652
Energy: 1.053530439427395
Energy: 1.053435268124619
Energy: 1.053093972492182
Energy: 1.047265876380837
Energy: 1.054272565645879
Energy: 1.0574028812765093
Energy: 1.0570652294944618
Energy: 1.1266232569660055
Energy: 1.1179438098570365
Energy: 1.0561749464266177
Energy: 1.05795369836041
Energy: 1.057729528354453
Energy: 1.1344525463886883
Energy: 1.0545667560250673
Energy: 1.0556871588150785
Energy: 1.0446236472083368
Energy: 1.0536276120206407
Energy: 1.0588473129398968
Energy: 1.1187841061664294
Energy: 1.1215483398956392
Energy: 1.0478358492656692
Energy: 1.0534151956918605
Energy: 1.0479433119699086
Energy: 1.1182153154666674
Energy: 1.1227227708620366

minimum gb energy = 1.0435847645519494 eV
minimum distance =  2.56130431817212 Angstroms
sigma value = 15


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

Energy: 1.0420319231855446
Energy: 1.0092361122340752
Energy: 1.0901789543381244
Energy: 1.0951377385679981
Energy: 1.0828858448545908
Energy: 1.0221214867263169
Energy: 1.0338473704874929
Energy: 1.1251804368235108
Energy: 1.1300360921981796
Energy: 1.0180355704913602
Energy: 1.016017255824221
Energy: 1.0874440755015902
Energy: 1.0201941413432363
Energy: 1.019255851869952
Energy: 1.0499157636008578
Energy: 1.0104440908904966
Energy: 1.0865358754531507
Energy: 1.0405452663562924
Energy: 1.0856476808586475
Energy: 1.097332995910256
Energy: 1.1130592088275084
Energy: 1.0369203228635588
Energy: 1.0137288868421899
Energy: 1.0649276179057168
Energy: 1.0655078866047394
Energy: 1.1061237635635985
Energy: 1.0540618195995521
Energy: 1.014196193634655
Energy: 1.0572478869779929
Energy: 1.0180249522908655
Energy: 1.0185972089048685
Energy: 1.0144764110204032
Energy: 1.0769445756683025
Energy: 1.1086876166203472
Energy: 1.0118384568366905
Energy: 1.010192248439173
Energy: 1.014771012647764
Energy: 1.074235127167437
Energy: 1.113712147957053
Energy: 1.072053032267264
Energy: 1.0243910165253163
Energy: 1.0700231669542615
Energy: 1.0131995364063775
Energy: 1.0149135289639266
Energy: 1.1228563004820786
Energy: 1.014116235414848
Energy: 1.0706608649096698
Energy: 1.038797053655409
Energy: 1.014799573597197
Energy: 1.122769449569022
Energy: 1.0022513715703834
Energy: 1.0147232221171358
Energy: 1.015812546033204
Energy: 1.148677368918341
Energy: 1.0028896285773583
Energy: 1.0163085932556386
Energy: 1.0148422206252796
Energy: 1.015727855416172
Energy: 1.1581048378395349
Energy: 1.0335678836477133
Energy: 1.0131784043135204
Energy: 1.0159973707128014
Energy: 1.0150997690504786
Energy: 1.0360265559967328
Energy: 1.138276162193293
Energy: 1.0131080704686772
Energy: 1.0158299965412592
Energy: 1.0157199671349122
Energy: 1.020802554707509
Energy: 1.128575667881902
Energy: 1.0685426383237824
Energy: 1.0163539444529022
Energy: 1.0530351960640292
Energy: 1.013821180347834
Energy: 1.1210448040358187
Energy: 1.053048528694201
Energy: 1.0160326181402544
Energy: 1.0421905032939265
Energy: 1.013942131410958
Energy: 1.0687644893514452
Energy: 1.0186356633052205
Energy: 1.0021273655875265
Energy: 1.0959423248652125
Energy: 1.0137452221063017
Energy: 1.015903675797734
Energy: 1.0192007116373891
Energy: 1.002202517478435
Energy: 1.093531574301061
Energy: 1.0137106359142396
Energy: 1.0153614662095638
Energy: 1.0937260859100866
Energy: 1.0536140322582768
Energy: 1.021025607656095
Energy: 1.0096813035267869
Energy: 1.0082659281517363
Energy: 1.0579255766355866
Energy: 1.026108537642593
Energy: 1.0205813435938689
Energy: 1.0101542739422624
Energy: 1.008675539845279
Energy: 1.1248320908569038
Energy: 1.0476394319838855
Energy: 1.0100978105257268
Energy: 1.0092401588139426
Energy: 1.028087491591794
Energy: 1.107874222402237
Energy: 1.0231921857812067
Energy: 1.0290018076000014
Energy: 1.009541606292495
Energy: 1.0277067916125664
Energy: 1.0100576666791183
Energy: 1.0803743523905538
Energy: 1.0722142909583403
Energy: 1.010007834191586
Energy: 1.0981288523843866
Energy: 1.031270459006791
Energy: 1.0945402596694929
Energy: 1.0110830496893009
Energy: 1.010489489027652
Energy: 1.1187031326409904
Energy: 1.11735386767571
Energy: 1.0466163938468
Energy: 1.02182207697726
Energy: 1.057143094761084
Energy: 1.057580553408069
Energy: 1.1189117399975763
Energy: 1.0450106448661942
Energy: 1.022199812265209
Energy: 1.0565607448024819
Energy: 1.116257853331121
Energy: 1.0238711942144796
Energy: 1.0861455269200004
Energy: 1.1130739318497935
Energy: 1.101149912933414
Energy: 1.032857475432322
Energy: 1.0234256234038326
Energy: 1.0884767673239173
Energy: 1.1046565228540175
Energy: 1.0985527156130361
Energy: 1.0314126497851717
Energy: 1.0486057979252057
Energy: 1.0111531380494836
Energy: 1.0097793402607558
Energy: 1.110055913234033
Energy: 1.0122225691139835
Energy: 1.046854488492698
Energy: 1.010573019038099
Energy: 1.009239686480927
Energy: 1.0387021194489143
Energy: 1.0126880169758843
Energy: 1.1473454138155066
Energy: 1.1049898697645102
Energy: 1.0097601146068325
Energy: 1.009342278703881
Energy: 1.030150131996792
Energy: 1.143344879485192
Energy: 1.105797706901951
Energy: 1.011179686579452
Energy: 1.0119076156677411
Energy: 1.02194650299301
Energy: 1.0079839149205658
Energy: 1.0378458900914604
Energy: 1.0650873012776938
Energy: 1.1440090209938625
Energy: 1.0117857544237148
Energy: 1.0079811376058483
Energy: 1.0376993243544619
Energy: 1.0889701924154682
Energy: 1.1486473360128218
Energy: 1.0138307878679467
Energy: 1.1579352929418096
Energy: 1.1692124994464022
Energy: 1.0052098146279476
Energy: 1.06410743406381
Energy: 1.0140854329022972
Energy: 1.156924168264841
Energy: 1.170102401539091
Energy: 1.010384049398787
Energy: 1.066669072991991
Energy: 1.0144833933013788
Energy: 1.0163382734658244
Energy: 1.009598014425307
Energy: 1.0305890160507916
Energy: 1.0152022980655089
Energy: 1.013746014905512
Energy: 1.016017861353
Energy: 1.0097848824698792
Energy: 1.014095655694432
Energy: 1.0151482764120325
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Energy: 1.058269718574116
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Energy: 1.010156656051497
Energy: 1.0667964689691094
Energy: 1.0026644905010487
Energy: 1.0184835755742827
Energy: 1.009566439177832
Energy: 1.0099943815008132
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Energy: 1.0029966603461746
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Energy: 1.026973106958571
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Energy: 1.075805807904278
Energy: 1.0388771749667187
Energy: 1.0092290118080773
Energy: 1.009025130984356
Energy: 1.0144844303430403
Energy: 1.0287981011702363
Energy: 1.0280323806827523
Energy: 1.1036724138557092
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Energy: 1.1184156329305979
Energy: 1.0613789174412482
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Energy: 1.0347449627357301
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Energy: 1.1092716049368534
Energy: 1.0307851819982266
Energy: 1.0121967858706922
Energy: 1.0218966139242482
Energy: 1.0669049422731156
Energy: 1.073012379145884
Energy: 1.0086454546396375
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Energy: 1.0142307203354353
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Energy: 1.063029091053676
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Energy: 1.0604697954595037
Energy: 1.0145105546690594
Energy: 1.0490378757158931
Energy: 1.063593735261054
Energy: 1.0098879101811051
Energy: 1.1267606425045216
Energy: 1.1286408120090226
Energy: 1.1063603349947921
Energy: 1.0097371935326662
Energy: 1.0097534371492718
Energy: 1.1287187432429941
Energy: 1.1288764721427527
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Energy: 1.0097910591664263
Energy: 1.037775827975024
Energy: 1.0721381649882211
Energy: 1.0128674038922962
Energy: 1.0147404490805143
Energy: 1.1400248553277825
Energy: 1.0378896626327314
Energy: 1.109722043964945
Energy: 1.0124509192422007
Energy: 1.0144604169086457
Energy: 1.12410408296271
Energy: 1.2339030411764311
Energy: 1.0154102151268471
Energy: 1.016724651019166
Energy: 1.1557835067172906
Energy: 1.0028296748479362
Energy: 1.0090215478115603
Energy: 1.0148089702978784
Energy: 1.0680265200794496
Energy: 1.15619271424957
Energy: 1.0029175139372581
Energy: 1.0140191218281867
Energy: 1.0150395867246729
Energy: 1.0152429474379143
Energy: 1.0277445558210245
Energy: 1.1630854808698359
Energy: 1.0142813054405708
Energy: 1.014872338134755
Energy: 1.015681504272442
Energy: 1.0273259127448402
Energy: 1.1447990681293851
Energy: 1.0134942899557664
Energy: 1.01670956104192
Energy: 1.0142292655064322
Energy: 1.014130495670187
Energy: 1.0695704947391025
Energy: 1.013477668383482
Energy: 1.017250569246451
Energy: 1.0145225699846265
Energy: 1.0138345946696776
Energy: 1.0692322262056133
Energy: 1.0515245530104862
Energy: 1.021558365753553
Energy: 1.0909440151890069
Energy: 1.0341373320998348
Energy: 1.0774191511925175
Energy: 1.0511365571131768
Energy: 1.0789735930703264
Energy: 1.0706847957966297
Energy: 1.0124586995010088
Energy: 1.0659194905042217
Energy: 1.0886550249436477
Energy: 1.0024342581513506
Energy: 1.0409960815055734
Energy: 1.0097952321754453
Energy: 1.0086760053404276
Energy: 1.0578202107100565
Energy: 1.0026272387939696
Energy: 1.0404792612007394
Energy: 1.0089104711589558
Energy: 1.0536049961876885
Energy: 1.133544907800769
Energy: 1.0389605032348483
Energy: 1.030480186183851
Energy: 1.0107985402406237
Energy: 1.0091154137953957
Energy: 1.1276952777309273
Energy: 1.03825788178631
Energy: 1.0295586039167275
Energy: 1.0106704219413614
Energy: 1.008496131862807
Energy: 1.0103152439768035
Energy: 1.1191685718721662
Energy: 1.0104059935616734
Energy: 1.01043294302552
Energy: 1.0324522510132392
Energy: 1.010352354497611
Energy: 1.1188670903500177
Energy: 1.0101808167222959
Energy: 1.0096705767943106
Energy: 1.0324482758192655
Energy: 1.1150922074459744
Energy: 1.0412616986246555
Energy: 1.020639862712217
Energy: 1.0546628331796555
Energy: 1.051082660292295
Energy: 1.1255639307453866
Energy: 1.0098398438007
Energy: 1.0212863459386947
Energy: 1.0749385722971019
Energy: 1.0615227241548986
Energy: 1.0217572425262458
Energy: 1.0824861163581685
Energy: 1.0558012526455383
Energy: 1.0250317043493566
Energy: 1.0128902550484011
Energy: 1.0212719732981939
Energy: 1.0843370695604875
Energy: 1.022622461485915
Energy: 1.0244864205356699
Energy: 1.0123623575530127
Energy: 1.0455678838092868
Energy: 1.0119891093451185
Energy: 1.009783108748613
Energy: 1.1091587360178445
Energy: 1.06295046470326
Energy: 1.0475547676222143
Energy: 1.0111853564316993
Energy: 1.0086669588573287
Energy: 1.0252924668015326
Energy: 1.0605434399692066
Energy: 1.19981528762164
Energy: 1.1234119825007953
Energy: 1.0295903798467338
Energy: 1.1240519303166945
Energy: 1.0351701971568696
Energy: 1.0497919120577823
Energy: 1.1049663080349834
Energy: 1.0120813495439795
Energy: 1.1257033900709346
Energy: 1.0356464697192165
Energy: 1.0084904180310095
Energy: 1.1173748971887636
Energy: 1.1510215432177051
Energy: 1.0552752772670984
Energy: 1.018936580484897
Energy: 1.0087027435920313
Energy: 1.119724158607403
Energy: 1.1349498835931882
Energy: 1.0574539394218219
Energy: 1.01396796688019
Energy: 1.129039973997426
Energy: 1.185814683417236
Energy: 1.172146157971599
Energy: 1.0348728666456841
Energy: 1.0131646720945209
Energy: 1.1259491890811157
Energy: 1.1862882464203663
Energy: 1.1708858484092648
Energy: 1.0251298258299444
Energy: 1.0140789799479872
Energy: 1.0163852709916203
Energy: 1.0435343759815057
Energy: 1.043482088194403
Energy: 1.0153426144513098
Energy: 1.012457786392466
Energy: 1.0159408113018575
Energy: 1.0204933445227153
Energy: 1.014118747069482
Energy: 1.0157634688300263
Energy: 1.0130097924443024
Energy: 1.0152189946341694
Energy: 1.0127215938477285
Energy: 1.0744144363012882
Energy: 1.0148849002540452
Energy: 1.0134968555010162
Energy: 1.0710638847496927
Energy: 1.0336637068224968
Energy: 1.0595283091891965
Energy: 1.0151045797179536
Energy: 1.0131946488306878
Energy: 1.075749918654669
Energy: 1.0140223435454754
Energy: 1.0162302195363042
Energy: 1.0527610211005152
Energy: 1.1064818222672481
Energy: 1.0531777941216098
Energy: 1.0141148089292227
Energy: 1.0158407230863047
Energy: 1.05311904819521
Energy: 1.116140418670444
Energy: 1.0158732864271145
Energy: 1.017176677933585
Energy: 1.0566717415004618
Energy: 1.0022006200379985
Energy: 1.0186246341474983
Energy: 1.0101975475667524
Energy: 1.0106720940310505
Energy: 1.0910030513120856
Energy: 1.0025546475922709
Energy: 1.0184981287468404
Energy: 1.0147668384032027
Energy: 1.0170702714073163
Energy: 1.0158523012186667
Energy: 1.0155529668789498
Energy: 1.0115256411609965
Energy: 1.0084963869849135
Energy: 1.01126256043774
Energy: 1.0577340793666263
Energy: 1.016130300342923
Energy: 1.0176206717882108
Energy: 1.0160370249947503
Energy: 1.0124695979623188
Energy: 1.0110887320846116
Energy: 1.1062605180416483
Energy: 1.1205331722711769
Energy: 1.0092004572421278
Energy: 1.0757917099393124
Energy: 1.0306574267023383
Energy: 1.1358412011989916
Energy: 1.102870720848946
Energy: 1.0252544034903017
Energy: 1.121748284723823
Energy: 1.0412207619009441
Energy: 1.0383708228508017
Energy: 1.000489760082617
Energy: 1.0199088650588393
Energy: 1.1166999738496346
Energy: 1.0787349657581544
Energy: 1.0677093198408767
Energy: 1.0029347084989089

minimum gb energy = 1.0000734900603647 eV
minimum distance =  2.51274408145901 Angstroms
sigma value = 437


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

Energy: 1.0206713327537253
Energy: 0.9665023282765018
Energy: 0.9395339373101445
Energy: 1.012403814947489
Energy: 0.9019497342503935
Energy: 1.0057064073453577
Energy: 0.9658099525079374
Energy: 0.9403593499703153
Energy: 0.9997260057710952
Energy: 1.005474894123717
Energy: 0.9023067430189703
Energy: 1.0577979851982364
Energy: 0.9018990603429743
Energy: 1.1086731469567859
Energy: 0.9041863216577467
Energy: 0.9023487529844458
Energy: 1.0581158595742761
Energy: 0.9022261260118746
Energy: 1.0570755898648814
Energy: 0.9050047741697567
Energy: 1.0066097834740415
Energy: 0.9042066173033972
Energy: 0.9562583360891359
Energy: 0.937899220477324
Energy: 0.9039004976239765
Energy: 1.0067868768320376
Energy: 1.0193487973470836
Energy: 0.9566926981745442
Energy: 0.9373324678243657
Energy: 0.9027116932169628
Energy: 0.9380745250064457
Energy: 0.9427131877011063
Energy: 1.0462509623318021
Energy: 1.006593280624024
Energy: 0.9031274298598947
Energy: 0.9382516172877235
Energy: 0.9371739870418864
Energy: 1.045387643427881
Energy: 1.0071444457327123
Energy: 0.95504299644233
Energy: 0.9906218195915348
Energy: 0.9665107986260301
Energy: 0.9149572029568083
Energy: 0.9372156110104463
Energy: 1.0076295053981779
Energy: 0.9907622021583988
Energy: 0.9659362440603472
Energy: 0.9134153238331187
Energy: 0.915199326827504
Energy: 1.0066553813709458
Energy: 0.9025198520002843
Energy: 0.9428736179972209
Energy: 0.9557106495261937
Energy: 0.915744263022684
Energy: 1.0051924811547626
Energy: 0.9040637755210187
Energy: 0.9064754246049976
Energy: 0.9969044012013166
Energy: 0.9163327523610522
Energy: 1.0055242311256567
Energy: 1.0103208006662714
Energy: 1.005211273961792
Energy: 1.0084147224809992
Energy: 0.9409548173844661
Energy: 0.9547390132214527
Energy: 1.0094708074643315
Energy: 1.0060209805637392
Energy: 1.0073627520493051
Energy: 0.9395401296457807
Energy: 0.9547100007041925
Energy: 1.0135176890201698
Energy: 0.9019227084312927
Energy: 0.9067685929829031
Energy: 0.938487870220908
Energy: 1.059457973452753
Energy: 1.018740903321436
Energy: 0.9017945151012663
Energy: 0.9073985663363853
Energy: 0.9382182867411362
Energy: 1.0590320254419252
Energy: 0.9378129135438177
Energy: 1.0475431291767023
Energy: 0.966484742483728
Energy: 0.9060796911547622
Energy: 0.9373140706474844
Energy: 0.9373558514033851
Energy: 1.0480903491483484
Energy: 0.9657759591851833
Energy: 1.0725917990674536
Energy: 0.9363991690395876
Energy: 0.9675431054545748
Energy: 0.9126519090340356
Energy: 0.9026895005303278
Energy: 1.110091053481629
Energy: 0.9679026045741469
Energy: 0.9137854653659967
Energy: 0.9131731084217121
Energy: 0.9048436620394193
Energy: 1.1077884622043113
Energy: 0.9675498982611808
Energy: 0.9018230794714356
Energy: 0.9027214152086872
Energy: 0.9662860210989787
Energy: 1.0053764662835993
Energy: 0.9016768126228077
Energy: 0.9019081827342368
Energy: 0.9028717738937584
Energy: 0.9668076725067393
Energy: 1.0062322284758662
Energy: 0.9418437688771089
Energy: 0.9027490383977141
Energy: 0.9030742258015583
Energy: 0.9018260974305545
Energy: 1.0707056860747157
Energy: 0.9027190709239267
Energy: 0.9028183292070597
Energy: 0.9029317264167344
Energy: 0.9017657814137399
Energy: 0.9688777115269769
Energy: 0.9027332360406609
Energy: 0.9018942947765878
Energy: 0.9065201006861671
Energy: 0.954932099930995
Energy: 1.0592550592119798
Energy: 0.9662690359318118
Energy: 0.9018091245343561
Energy: 0.9069229131060336
Energy: 0.9550312873182364
Energy: 1.0576422079932943
Energy: 0.9041337386045243
Energy: 0.9015430915372485
Energy: 0.9692510008975589
Energy: 1.130960474697807
Energy: 0.9023531545257096
Energy: 0.9042936715116298
Energy: 1.0747107634382027
Energy: 0.9671200181166086
Energy: 1.0171342794477127
Energy: 0.9021141932803887
Energy: 0.900844274071993

minimum gb energy = 0.900844274071993 eV
minimum distance =  2.51243187685104 Angstroms
sigma value = 33