Model name: model_name=MEAM_LAMMPS_LeeBaskesKim_2001_Fe__MO_196726067688_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.567322969436645
cohesive_energy=4.225801906680588
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[0.0, 3.1107861525744e-19, 3.7156078319094e-19, 4.17195580257162e-19, 4.55479590926592e-19, 4.8827134009467e-19, 5.16706770994902e-19, 5.4154371317517e-19, 5.63323702337766e-19, 5.8244728264119e-19, 5.9922207199917e-19, 6.138932034367079e-19, 6.2665934685642e-19, 6.376839242749739e-19, 6.471047228828939e-19, 6.550387015744619e-19, 6.61588399654254e-19, 6.668387324838719e-19, 6.70866604541748e-19, 6.737425115997779e-19, 6.7552573419342e-19, 6.7627074632823e-19, 6.762723485048639e-19, 6.769949301667979e-19, 6.75839760813684e-19, 6.725937509532e-19, 6.6767667086345385e-19, 6.610212291258179e-19, 6.523101947667599e-19, 6.41162249747388e-19, 6.27111160667208e-19, 6.09594563527686e-19, 5.879203180229339e-19, 5.61237668360298e-19, 5.284939844912399e-19, 4.8836747069271e-19, 4.39203078501786e-19, 3.78887536938222e-19, 3.04714769667192e-19, 2.1316799897706597e-19, 9.96319948559436e-20, -4.2045600970735195e-20, -2.2017271522091395e-19, -4.46191772979294e-19, -7.361280653744699e-19, -1.1129696227510739e-18, -1.6105079524967998e-18, -2.27999348078004e-18, -3.20180580715194e-18, -4.50773998152534e-18, -6.42517691179752e-18, -9.373085787759479e-18, -1.419188836277592e-17, -2.2771896716705398e-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: 0.02049901827743745
Energy: -0.04546335017753058
Energy: -0.18695258320377306
Energy: 0.4879652882238191
Energy: 0.5034361307116199
Energy: 0.2930842320594038
Energy: -0.03845430240420176
Energy: 0.04772885451342494
Energy: 0.13008754749139273
Energy: -0.11527864352479751
Energy: 0.8647598022891422
Energy: 0.2559842275618214
Energy: -0.02265824439488593
Energy: -0.05633562368396055
Energy: 0.06302118936029263
Energy: 0.17275726408923683
Energy: -0.19128593627366522
Energy: 0.7551032531129496
Energy: 0.19315999219438873
Energy: -0.10829813888910897
Energy: -0.10834167723150678
Energy: 0.018992255649928323
Energy: 0.0959085126616872
Energy: -0.07772546763045586
Energy: 0.2667943422387734
Energy: 0.6386217849881597
Energy: -0.133472143128655
Energy: -0.03891899398483209
Energy: -0.020815766432681338
Energy: 0.1472026028204782
Energy: -0.15173026414483873
Energy: -0.08852895646708639
Energy: 0.20186782603340078
Energy: -0.036744063827922266
Energy: -0.11523021188875185
Energy: 0.06649794313124768
Energy: 0.1044710780234992
Energy: 0.42394341313085415
Energy: 1.1090975586180736
Energy: 0.20204989416201438
Energy: 0.07074302171728263
Energy: -0.11646848105605549

minimum gb energy = -0.19128593627366522 eV
minimum distance =  2.48384306063582 Angstroms
sigma value = 5


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

Energy: 0.8554187569446631
Energy: 0.9463265138667913
Energy: 0.8563329860056933
Energy: 1.167621846439097
Energy: 1.0223844121439352
Energy: 0.916793595760601
Energy: 0.9978663364278851
Energy: 0.8643210305503569
Energy: 0.880913990145451
Energy: 0.8438041405953618
Energy: 0.9282920471137667
Energy: 0.8626895413521204
Energy: 0.7051357891565796
Energy: 0.7927192447474528
Energy: 0.7439215410579697
Energy: 0.6780234589286228
Energy: 0.7742355333962716
Energy: 0.6767231881871533
Energy: 0.7904078319309535
Energy: 0.7349362698586313
Energy: 0.7565597606790874
Energy: 0.6980036130613964
Energy: 1.038210838455851
Energy: 0.8634892034721359
Energy: 0.9357544683523676
Energy: 0.8985223839710166
Energy: 0.9899805805319652
Energy: 0.8919941839075182
Energy: 1.1327494570436571
Energy: 0.7150133288273042
Energy: 0.8602130853310833
Energy: 0.7513339840977965
Energy: 0.8159087017245812
Energy: 1.0124421468873062
Energy: 0.8032571537386662
Energy: 0.8864952120687059
Energy: 0.6715120101658978
Energy: 0.8882382612777844
Energy: 0.7437392454853985
Energy: 0.7123354079966839
Energy: 1.0338383571052576
Energy: 0.7719403618519549
Energy: 0.8556571580068971
Energy: 0.7456941676338922
Energy: 0.8046624866675309
Energy: 0.9053565716979513
Energy: 0.9737428945391899
Energy: 0.9980298993853409
Energy: 0.9194586640811346
Energy: 0.7512419985217236
Energy: 0.897067609140428
Energy: 0.882925704266975
Energy: 0.9523497226845735
Energy: 0.8809958665400556
Energy: 0.8468479037443296
Energy: 0.9014432445075138
Energy: 1.0838391996800236
Energy: 0.7650066360408694
Energy: 0.8895146705446881
Energy: 0.7435931021580114
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Energy: 0.7666767487435118
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Energy: 0.8739352362808144
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Energy: 0.8378873839458635
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Energy: 0.9788305135983982
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Energy: 0.9268793436636935
Energy: 0.9319730115904793
Energy: 0.7280298013137295
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Energy: 0.967847333260607
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Energy: 0.7506037345540127
Energy: 0.8281523138162151
Energy: 0.9710048773816734
Energy: 0.6408836030781956
Energy: 0.7100114824302023
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Energy: 0.9102309886822789
Energy: 0.98056992771309
Energy: 0.8620441319369093
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Energy: 0.9886319202720337
Energy: 0.923593108659224
Energy: 0.8634053206992411
Energy: 0.8534861365099372
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Energy: 0.8214178744287016
Energy: 0.7565457307496065
Energy: 0.844421103727115
Energy: 0.8345907993075858
Energy: 0.696947881941689
Energy: 0.6957670804770056
Energy: 0.8785603681591415
Energy: 0.7714208735804081
Energy: 0.8404913345376596
Energy: 0.9787712844627563
Energy: 0.7938927788986895
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Energy: 0.8555438510508467
Energy: 0.753282036789372
Energy: 0.9667564315637142
Energy: 0.8490474392120282
Energy: 0.9318356251075101
Energy: 0.8353050252579254
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Energy: 0.8913515415507793
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Energy: 0.8975323085518455
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Energy: 0.8943365295837066
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Energy: 0.8509676157991859
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Energy: 0.7704786527962403
Energy: 0.711889779182817
Energy: 0.79003412273727
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Energy: 0.6728218636609399
Energy: 0.7106079830726664
Energy: 0.9197584451080422
Energy: 0.8237680240827768
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Energy: 0.7890462294881739
Energy: 0.8069899955553292
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Energy: 0.7908941202884924
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Energy: 0.8967467034715746
Energy: 0.9961525154208121
Energy: 0.9969228774184771
Energy: 0.8028459277965072
Energy: 0.8148538807024417
Energy: 0.8529532320754164
Energy: 0.8911907308368993
Energy: 0.6693846065006078
Energy: 0.7995289944899459
Energy: 0.7935689163423515
Energy: 0.7685026691854884
Energy: 0.7906294008880651
Energy: 0.9953665427849654
Energy: 0.7148612561876645
Energy: 0.7692331671395738
Energy: 0.7260767986112541
Energy: 0.845344186377679
Energy: 0.8204939758060414
Energy: 0.8764627165304932
Energy: 0.8020801900262144
Energy: 0.9718322606742185
Energy: 0.8662874011963608
Energy: 0.9112677296922228
Energy: 0.8535775263256604
Energy: 0.998682397784123
Energy: 0.857604025922372
Energy: 0.9124034275699908
Energy: 0.7173005298220468
Energy: 0.8446413953500436
Energy: 0.7125083789030773
Energy: 0.6675037478699224
Energy: 0.7687254847618386
Energy: 0.8043861244875857
Energy: 0.8182161516631105
Energy: 0.699008137489522
Energy: 0.8505391022090604
Energy: 0.7452913639495449
Energy: 0.6987886666260084
Energy: 0.9502012292737183
Energy: 0.790247259302367
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Energy: 0.9050459701731559
Energy: 0.8650994578188411
Energy: 0.8669155913197036
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Energy: 0.8830147335172993
Energy: 0.7693736773985621
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Energy: 0.806588624094278
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Energy: 0.9460776028506287
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Energy: 0.8042023816621444
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Energy: 0.9124240849955989
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Energy: 1.1349538936603774
Energy: 0.9744705280631312
Energy: 0.8939689995077792
Energy: 0.8166077793237826
Energy: 0.8874394610738123
Energy: 0.8314366146602835
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Energy: 0.812852309730898
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Energy: 0.8457435311047127
Energy: 0.7550935459812519
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Energy: 0.9318833991673475
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Energy: 0.7001512456417583
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Energy: 0.8123347246777379
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Energy: 0.8502179522261333
Energy: 0.8538131006994178
Energy: 0.716854682815907
Energy: 0.832315419433373
Energy: 0.8263414010785168
Energy: 0.8286874517808029
Energy: 1.0004085952055668
Energy: 0.7813168420369621
Energy: 0.9287669745164612
Energy: 0.763798571116631
Energy: 0.8225957381049752
Energy: 0.7212500668988105
Energy: 0.8768777240919648
Energy: 0.8260262277564148
Energy: 0.6524132028868087
Energy: 1.1952254430634026
Energy: 0.7981743043373539
Energy: 0.8599467340270688
Energy: 0.9051418317707691
Energy: 0.9364631352619052
Energy: 0.762785098235979
Energy: 0.7636656524509627
Energy: 0.8838718119536019
Energy: 0.834463335764164
Energy: 0.9330316472915918
Energy: 0.7969591402864896
Energy: 0.7827985448946405
Energy: 0.9532970440115894
Energy: 0.7418373069029172
Energy: 1.284129719314736
Energy: 0.7546051343267036
Energy: 0.8082514139678589
Energy: 0.7880306862906061
Energy: 0.7010114363082846
Energy: 0.8062482861334026
Energy: 0.8527541926713418
Energy: 0.8330752345525743
Energy: 0.7249162995128837
Energy: 0.8846285621336988
Energy: 0.7901631200400775
Energy: 0.7179071712189472
Energy: 0.8408922246672472
Energy: 0.8355771976342231
Energy: 1.200430805938185
Energy: 0.7139090345173372
Energy: 0.7880967524427518
Energy: 0.8525901314714673
Energy: 0.8027237531425935
Energy: 0.8934013593735953
Energy: 0.88079827776452
Energy: 0.8321844288666016
Energy: 0.8139812953856908
Energy: 0.6975942325804343
Energy: 0.7456556463990421
Energy: 0.7864047744480662
Energy: 0.7870043587666878
Energy: 0.8385573817668992
Energy: 0.6533542409996721
Energy: 0.7682673222464885
Energy: 0.7765205619275584
Energy: 0.6715966663157119
Energy: 0.7571515482561973
Energy: 0.7880329227542522
Energy: 0.7202666084189484
Energy: 0.912174722774168
Energy: 0.9276645042751857
Energy: 0.7628939986277469
Energy: 0.9267551555433153
Energy: 0.9835515049091771
Energy: 0.7176748603078752
Energy: 0.8747615849964259
Energy: 0.98066825651533
Energy: 0.8761495734053995
Energy: 0.9597047267967047
Energy: 0.817458637312942
Energy: 1.0214140182919644
Energy: 0.8188604211289219
Energy: 0.7501876912901944

minimum gb energy = 0.6338312209709885 eV
minimum distance =  2.24993300087738 Angstroms
sigma value = 401


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

Energy: 0.9950356873009454
Energy: 1.0183130920620986
Energy: 0.9505798271117449
Energy: 0.7281108266272046
Energy: 1.32517171817271
Energy: 0.9533371253917465
Energy: 0.9621290685235243
Energy: 0.8996929715727724
Energy: 0.7810452125346484
Energy: 0.7906670394876388
Energy: 1.17136520973538
Energy: 0.8212672338229073
Energy: 0.649713908403327
Energy: 0.801301323203167
Energy: 1.030875759035532
Energy: 0.7466946154694314
Energy: 0.7394963251461408
Energy: 0.8009242526804223
Energy: 0.7520869178531264
Energy: 0.8105698355212255
Energy: 0.8472403710690886
Energy: 0.8567696140656397
Energy: 0.781058607210418
Energy: 0.8608209486510471
Energy: 0.9378281865218082
Energy: 0.8389250516591888
Energy: 0.7955723215544015
Energy: 0.9944452047222038
Energy: 1.2078093955726101
Energy: 0.7791253143074338
Energy: 0.9026503064080176
Energy: 0.8411801988671184
Energy: 0.7649491148449961
Energy: 1.0799521118499464
Energy: 1.0996716300731992
Energy: 1.2018224276071514
Energy: 0.6790919953290421
Energy: 0.8408374072084082
Energy: 0.7141968397541534
Energy: 0.7485903161349343
Energy: 0.736489515146138
Energy: 0.7111152856882668
Energy: 1.2053376398199773
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Energy: 0.9091009887193818
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Energy: 1.0027478543814092
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Energy: 0.8637616027610471
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Energy: 1.2272063961432953
Energy: 0.9078171173221508
Energy: 0.894189505273131
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Energy: 0.7526407938592224
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Energy: 0.759012983587347
Energy: 1.2049667907606338
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Energy: 0.8430327962549109
Energy: 0.7313924238423075
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Energy: 0.985693002935208
Energy: 0.7923487413792527
Energy: 0.8986955519580353
Energy: 1.0126309001306115
Energy: 0.8476510025797789
Energy: 0.8395010637157176
Energy: 0.9159147217301894
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Energy: 0.6749187159429181
Energy: 0.816076162902043
Energy: 0.8455472462559862
Energy: 0.7500635782431356
Energy: 0.8834589582085647
Energy: 0.9266912643716471
Energy: 0.9471819926845472
Energy: 0.6786040876702518
Energy: 1.1473499347445064
Energy: 0.7124807085078941
Energy: 0.7439950997140156
Energy: 0.8230993429916597
Energy: 1.0542989225509778
Energy: 0.9687935177875142
Energy: 0.7346873441880786
Energy: 0.8983049049114001
Energy: 0.8832733319152157
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Energy: 0.8521598298445255
Energy: 1.075853749780601
Energy: 0.8518536595342545
Energy: 0.8523926762343579
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Energy: 0.7357322079848743
Energy: 0.930817907604886
Energy: 0.9328562361344567
Energy: 1.253334129573342
Energy: 0.6847911613161651
Energy: 0.8524073125254416
Energy: 0.8142750757429582
Energy: 0.7551937515747749
Energy: 0.712517842950608
Energy: 0.7832790596725461
Energy: 1.1991806390099136
Energy: 0.8420124313768445
Energy: 0.8962381136754698
Energy: 0.8337972204804988
Energy: 0.8108707943304986
Energy: 0.9244756249287656
Energy: 0.824848471121036
Energy: 1.199764860653601
Energy: 0.8083273261375022
Energy: 0.8847690418349243
Energy: 0.8375858543396774
Energy: 0.7966396242479606
Energy: 0.7827821135040637
Energy: 0.8931840631561312
Energy: 1.202217133897918
Energy: 0.7523423372310366
Energy: 0.819823526423254
Energy: 0.8174409494979659
Energy: 0.7924755145717977
Energy: 0.7548020244184783
Energy: 0.6483019359389269
Energy: 0.8798358004046881
Energy: 0.7563481653126775
Energy: 0.7525804251144005
Energy: 1.1873493320807602
Energy: 0.8086129049769039
Energy: 0.7991090560517614
Energy: 0.9588557444718789
Energy: 1.0887731025903298
Energy: 0.8594480391414492
Energy: 0.7107077958381253
Energy: 0.7572107361019831
Energy: 1.0788695864547515
Energy: 0.8698257380984981
Energy: 0.7854678628886508
Energy: 0.9300168924206826
Energy: 0.8164927568145262
Energy: 0.680472544476711
Energy: 0.8943893339784099
Energy: 0.8327167739383193
Energy: 0.7440663731568228
Energy: 0.8711839488007488
Energy: 0.9194919032482296
Energy: 1.0811790238253698
Energy: 0.6861028526861581
Energy: 0.7969958802449296
Energy: 0.7287612616164509
Energy: 0.6876143487875378
Energy: 0.865193139745089
Energy: 1.0352724814591712
Energy: 0.8425607097227736
Energy: 0.8486570518168443
Energy: 0.8824708204423568
Energy: 0.8437033408301347
Energy: 0.893729394630331
Energy: 0.908006704212264
Energy: 1.0453309373205133
Energy: 0.7946745509713544
Energy: 1.0312248737585488
Energy: 0.6785304761409018
Energy: 0.7176680299792694
Energy: 0.701479004590902
Energy: 0.8499022051984967
Energy: 0.8808752866662823
Energy: 0.7392091043145501
Energy: 0.8523387881600158
Energy: 0.8099929313622758
Energy: 0.6582960402781377
Energy: 0.9300527329592895
Energy: 0.9155045636330572
Energy: 0.9474626396273402
Energy: 0.8476602824063197
Energy: 0.9730903562435042
Energy: 0.9543364564306934
Energy: 0.8078909129580044
Energy: 1.182820486687096
Energy: 1.0613835837406393
Energy: 1.1693420008607256
Energy: 0.8172069464114626
Energy: 0.8618984992531578
Energy: 0.8277878190024014
Energy: 0.7586650816017292
Energy: 0.876837527798978
Energy: 0.9208012504098347
Energy: 0.953511039234614
Energy: 0.742641532230222
Energy: 0.8337106373076499
Energy: 0.8286921815036573
Energy: 0.784724402524805
Energy: 1.1866662430498498
Energy: 0.7525855782494909
Energy: 0.9031040875964812
Energy: 0.8803115620317187
Energy: 0.972608016417783
Energy: 0.8696093503507465
Energy: 0.9872568608851671
Energy: 1.090559802246961
Energy: 0.9797447481115138
Energy: 1.0894213931837646
Energy: 0.8726029525908742
Energy: 0.7380623722965906
Energy: 0.7752628078412723
Energy: 1.1809284607756956
Energy: 0.7244322880506547
Energy: 0.8786099269324884
Energy: 0.9496054400833775
Energy: 0.7634519035802678
Energy: 0.7143587121633967
Energy: 0.7246450848498193
Energy: 0.6749020630841722
Energy: 0.7811611585162619
Energy: 0.8271442420146673

minimum gb energy = 0.6483019359389269 eV
minimum distance =  2.28476659585499 Angstroms
sigma value = 311


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

Energy: 0.781184554193517
Energy: 0.8545456909652381
Energy: 1.0075693102920864
Energy: 0.9059345997217307
Energy: 1.0639249206235808
Energy: 0.8699682479452895
Energy: 0.8236103775054338
Energy: 0.8475951884527037
Energy: 0.8263403615609347
Energy: 0.9977934470743031
Energy: 0.7744902660210105
Energy: 0.7648433497482534
Energy: 0.7679684462772719
Energy: 0.8474044272365823
Energy: 1.0052379147715647
Energy: 0.8520566167702559
Energy: 0.9111696143525335
Energy: 0.8001485878218325
Energy: 0.8600114088985185
Energy: 0.8453027500005724
Energy: 0.8195212006092203
Energy: 0.8386967490509069
Energy: 0.7661093589816633
Energy: 1.041197724259705
Energy: 0.7904642937789833
Energy: 0.7772767046640869
Energy: 0.8760641886529044
Energy: 0.85104969921437
Energy: 0.9783171195884087
Energy: 0.8929957251103753
Energy: 0.8472841802904285
Energy: 0.8356480925662387
Energy: 0.8064437304403167
Energy: 1.0796846027093134
Energy: 0.8725058516303579
Energy: 0.7960707440901388
Energy: 0.7112340611534386
Energy: 0.7222484332148368
Energy: 0.7469576978997128
Energy: 0.7493689956038333
Energy: 0.6741784583851661
Energy: 0.7438224358612501
Energy: 0.8502935136533614
Energy: 0.8796258001095935
Energy: 0.9175543438203485
Energy: 0.8829680330929991
Energy: 0.8259635130498603
Energy: 0.7932106792339856
Energy: 0.9477416802180368
Energy: 0.9340749716881656
Energy: 0.8645372211847672
Energy: 0.911924292607249
Energy: 1.0383797665343997
Energy: 0.8964734417436261
Energy: 0.8710430829777361
Energy: 0.8781722353072126
Energy: 1.0745841816102342
Energy: 0.8637107885077338
Energy: 0.9008076186089033
Energy: 0.8510175916246728
Energy: 0.8175266711886636
Energy: 0.7191129463292975
Energy: 0.8127974011689514
Energy: 0.835172624093997
Energy: 0.8022663515567742
Energy: 0.9738402028968288
Energy: 0.6754549067626524
Energy: 0.8191229245254174
Energy: 0.8013184622723736
Energy: 0.8075724083591828
Energy: 1.0294796272891882
Energy: 0.8290441964643155
Energy: 0.9421252232234005
Energy: 1.05532826235931
Energy: 0.8307575370820017
Energy: 0.8913919032692732
Energy: 0.8119107522452805
Energy: 0.7807296664137522
Energy: 0.7191807523261617
Energy: 0.7833846121285984
Energy: 0.6790738169230862
Energy: 0.7423507760078163
Energy: 0.809749215734127
Energy: 0.7519298918726178
Energy: 0.81555774048682
Energy: 0.908061156336896
Energy: 0.9213776376633346
Energy: 0.8582227272401648
Energy: 0.8709974664981697
Energy: 0.8868411886778039
Energy: 0.8929283343489324
Energy: 0.9773384382645152
Energy: 1.0128408210094797
Energy: 1.0971010620397037
Energy: 0.9476622865843572
Energy: 0.9090074910533971
Energy: 0.9398420711604214
Energy: 0.8755185597162498
Energy: 0.9225907384114752
Energy: 0.8910184863254298
Energy: 0.8372378640946158
Energy: 0.8609020883163169
Energy: 0.8121467961253063
Energy: 0.9104123728483069
Energy: 0.8283578820309807
Energy: 0.9340808877386321
Energy: 0.7876175970190674
Energy: 0.8615682655694955
Energy: 0.6958857041573006
Energy: 0.8008722037509327
Energy: 0.6976164454540956
Energy: 0.9234343028840836
Energy: 1.2006687657031223
Energy: 0.8148000598080986
Energy: 0.8481876653299781
Energy: 1.0570532908637031
Energy: 0.9042898137383085
Energy: 0.9628495740594254
Energy: 0.87095209795549
Energy: 0.7294841894679055
Energy: 0.7304870371919071
Energy: 0.7201001865873079
Energy: 0.754311871180773
Energy: 0.7198249254961708
Energy: 0.6578807398363669
Energy: 0.9890171849358623
Energy: 0.9794356104864804
Energy: 0.7859852050472221
Energy: 0.9224705042442425
Energy: 0.8245297023292922
Energy: 0.8030266757841169
Energy: 0.9403304994463894
Energy: 0.9113288108096418
Energy: 0.9764907804196251
Energy: 0.8970694843984104
Energy: 0.888957481474015
Energy: 1.0125330327110467
Energy: 0.8898997624514798
Energy: 0.9068489660469397
Energy: 0.877253553786398
Energy: 0.9120120458538483
Energy: 0.8173881629199276
Energy: 0.9659086363132209
Energy: 0.8324940107130863
Energy: 0.860528741215178
Energy: 0.8212885847223972
Energy: 0.8400794456945273
Energy: 0.8361070980333534
Energy: 0.7541113232835437
Energy: 0.7722943958337353
Energy: 0.7348286753475775
Energy: 0.8345292084425154
Energy: 0.7508513182450195
Energy: 0.8224739153841005
Energy: 0.798080290277175
Energy: 0.9237574248871465
Energy: 0.9750414317741062
Energy: 1.0874113076683973
Energy: 0.9629374547201763
Energy: 1.1202368891225605
Energy: 0.7539450347226146
Energy: 0.8364702580849165
Energy: 0.7516949455613118
Energy: 0.8781966748949211
Energy: 0.6573530209253432
Energy: 0.7844573849837378
Energy: 0.7276549809409052
Energy: 0.7488544941800269
Energy: 0.8915288116086136
Energy: 0.8185685256143564
Energy: 0.7285405766667642
Energy: 0.8456678368842554
Energy: 0.8545352145167562
Energy: 0.9025246003220835
Energy: 0.8914306834502506
Energy: 0.9496406816978248
Energy: 0.9727587789459485
Energy: 0.9417615377665634
Energy: 0.9740149810815741
Energy: 0.8426481955094652
Energy: 1.013497939284017
Energy: 0.9358141392025977
Energy: 0.9856909350015357
Energy: 0.8453792664741239
Energy: 1.0667887757190064
Energy: 0.7800069137653663
Energy: 0.8591882464160859
Energy: 0.829763955526745
Energy: 0.8538168772483329
Energy: 0.7887249654034774
Energy: 0.7147246779535109
Energy: 0.8744725358511831
Energy: 0.6827790544591555
Energy: 0.8380174319432998
Energy: 0.6972058936486492
Energy: 0.8029063501534294
Energy: 1.0378301653518256
Energy: 0.8244942826978481
Energy: 0.7577647918112159
Energy: 0.966338130625791
Energy: 0.9448193990664238
Energy: 1.172133874693828
Energy: 0.8712756040062406
Energy: 0.9170370545319665
Energy: 0.7889149622972341
Energy: 0.9646850989571911
Energy: 0.6530898985508732
Energy: 0.8006712012434719
Energy: 0.680919403240062
Energy: 0.8229913474596053
Energy: 1.1685197097048707
Energy: 0.8403371577486014
Energy: 0.788236748619427
Energy: 0.8246236245801146
Energy: 0.7536156644071431
Energy: 0.9728228462479923
Energy: 0.7656454352846229
Energy: 0.9150618945884671
Energy: 0.9191050159194718
Energy: 0.9486306764480631
Energy: 0.9401638353114671
Energy: 0.8542256134799731
Energy: 0.9624219628107598
Energy: 0.9987570727738159
Energy: 0.9405298581871483
Energy: 0.8941213240245289
Energy: 1.0031372821058084
Energy: 0.8119158109805727
Energy: 0.8498164634869865
Energy: 0.9046902519884047
Energy: 0.8618754877027346
Energy: 0.8086669265148797
Energy: 0.6893897405345303
Energy: 0.9213309273642926
Energy: 0.6793655665581422
Energy: 0.8448501177793728
Energy: 0.8205846718724182
Energy: 0.8672358565743447
Energy: 0.95380033405476
Energy: 0.8589548625885192
Energy: 0.8145401843604895
Energy: 0.7659138814503397
Energy: 0.8297066348713548
Energy: 0.9964553523266867
Energy: 0.8867221276237847
Energy: 0.8655658361714104
Energy: 0.7808466717777779
Energy: 1.0300477391588962
Energy: 0.6708452154384978
Energy: 0.7781640738836209
Energy: 0.8575478219877277
Energy: 0.7197114130372839

minimum gb energy = 0.6530898985508732 eV
minimum distance =  2.28025364289215 Angstroms
sigma value = 39


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

Energy: 0.8802396736686692
Energy: 0.9330578685404919
Energy: 1.2965249417352547
Energy: 1.0331607072667173
Energy: 0.7261916616230035
Energy: 0.9409504621657198
Energy: 0.9493258127584767
Energy: 0.8878989040060555
Energy: 0.7943214887995678
Energy: 0.7072094299647828
Energy: 0.7365055932388751
Energy: 0.9242977265556126
Energy: 1.0943082510793378
Energy: 1.012747235704161
Energy: 1.2206693026029374
Energy: 0.7198734988635852
Energy: 0.964795422769576
Energy: 0.9789280310355242
Energy: 0.9065396153977521
Energy: 1.0096703861255083
Energy: 1.1742309967452742
Energy: 1.0147635385596663
Energy: 0.7981926855956923
Energy: 0.6254272703355349
Energy: 0.790281717743999
Energy: 0.9879120472301839
Energy: 0.8042209168271418
Energy: 1.246370248179471
Energy: 0.935512335331819
Energy: 0.9700067250876152
Energy: 0.7595194650211611
Energy: 0.8658927764525517
Energy: 0.7954833481420852
Energy: 1.0863025047455177
Energy: 0.9483446371668992
Energy: 0.8952308810745099
Energy: 0.7874990176991886
Energy: 0.8204729870188301
Energy: 0.8444364957148742
Energy: 0.9161802322680941
Energy: 0.9308251544605584
Energy: 0.896013061003381
Energy: 1.2706106246435882
Energy: 0.6553528345551939
Energy: 0.8257976452667062
Energy: 1.345997976444636
Energy: 0.8931289425852931
Energy: 0.8862293486875829
Energy: 1.1328995767644623
Energy: 0.9019997322291853
Energy: 0.9289819983741748
Energy: 1.07658108307746
Energy: 0.5857074216469209
Energy: 0.8765774649175481
Energy: 0.7836503530340041
Energy: 1.127898109858167
Energy: 0.904657055405223
Energy: 0.9261437748016643
Energy: 1.0856303831294383
Energy: 0.6524885672283233
Energy: 0.8048007519819413
Energy: 0.7765891711002572
Energy: 1.1302563968853683
Energy: 0.7199315557357914
Energy: 0.7153460469488251
Energy: 0.870859101564905
Energy: 0.8599811424587076
Energy: 0.9546275538090057
Energy: 1.0018271195987323
Energy: 1.188623730202896
Energy: 0.8210414904638139
Energy: 0.9150116614424786
Energy: 0.7540015184519177
Energy: 0.5652550041607463
Energy: 0.9367195358559911
Energy: 1.0394538218418814
Energy: 1.1646474721172129
Energy: 1.02292803330353
Energy: 0.9674728024458451
Energy: 0.5484974034202506
Energy: 0.7154952753447348
Energy: 0.6954665329116799
Energy: 1.287603938266242
Energy: 1.0570241649374037
Energy: 0.8963454494120617
Energy: 0.9803541067343472
Energy: 0.9339376697064581
Energy: 0.7365342227083355
Energy: 0.7775278686290413
Energy: 0.6807633594284345
Energy: 1.1378565425804912
Energy: 1.3093155019432117
Energy: 0.7643013247809727
Energy: 0.8257437620336521
Energy: 0.7058585709972671
Energy: 0.8897804041768157
Energy: 0.8941724923269133
Energy: 1.0356122736293862
Energy: 0.8932318995157336
Energy: 0.8040041117610671
Energy: 0.8800142222568904
Energy: 1.0421052150050412
Energy: 0.912010588798335
Energy: 0.8893469303385166
Energy: 0.899751224911317
Energy: 0.8814786663890016
Energy: 0.9451655274154255
Energy: 1.2990438568185874
Energy: 0.7303053468731869
Energy: 0.716555965899331
Energy: 0.9489615299275279
Energy: 0.9463018465128181
Energy: 0.9116032282946859
Energy: 0.7386125908436826
Energy: 0.7058476769215897
Energy: 0.7343181866356342
Energy: 0.94809064754655
Energy: 0.9466025443240348
Energy: 1.013731979451678
Energy: 0.8421277161695645
Energy: 0.8188901974044419
Energy: 0.9919431075869675
Energy: 0.9094769129971934
Energy: 0.908315517769265
Energy: 1.0024221353610876
Energy: 0.7360756177214447
Energy: 0.6992403659876296
Energy: 0.8132890462660846
Energy: 0.6128937637362547
Energy: 0.6417003106945754
Energy: 0.9443596333701434
Energy: 0.7020699149297565
Energy: 1.2460286781369418
Energy: 0.9359189892038877
Energy: 0.9666201981585927
Energy: 0.7580075708209827
Energy: 0.8684867608941177
Energy: 0.7650454279552592
Energy: 1.1323423152107792
Energy: 1.0550673749756145
Energy: 0.9118440496220872
Energy: 0.7944727342617441
Energy: 0.8218755847521066
Energy: 0.7975586353745623
Energy: 0.9309296476375516
Energy: 0.8763067976584453
Energy: 0.8797609221699146
Energy: 0.9969200501980829
Energy: 0.8892933781566829
Energy: 0.8118354960151635
Energy: 1.3473580192522332
Energy: 0.8979597733735202
Energy: 0.8905459399790422
Energy: 1.1329804600795954
Energy: 0.9014870470953744
Energy: 0.9302389832308402
Energy: 1.048680817550986
Energy: 0.5820209434161007
Energy: 0.9048504343747339
Energy: 0.780120038442116
Energy: 1.1271511715048959
Energy: 0.9100886826349693
Energy: 0.9227791829344185
Energy: 0.9483303560661474
Energy: 0.6589709734482814
Energy: 0.775334326869909
Energy: 0.7751905716627917
Energy: 0.8909921204497793
Energy: 1.249502615278767
Energy: 0.6252194017980895
Energy: 0.7263589294935597
Energy: 0.9702796969691196
Energy: 0.9584046973358044
Energy: 1.0032768776824978
Energy: 1.1479296173400706
Energy: 0.8085782721270414
Energy: 0.9195229261705415
Energy: 0.7518989205774249
Energy: 0.555639060166704
Energy: 0.9344174776468472
Energy: 0.9205633831397959
Energy: 0.924599213413342
Energy: 1.0196585966553569
Energy: 0.9599136095175594
Energy: 0.554637258795602
Energy: 0.7273629229312334
Energy: 0.5841688386274572
Energy: 0.8662120923452675
Energy: 1.0457400003229709
Energy: 0.8980031883135169
Energy: 0.9554954907281449
Energy: 0.9401859732026887
Energy: 0.723260618138647
Energy: 0.9297033985510927
Energy: 0.6824337400484016
Energy: 1.139303599540688
Energy: 1.0591090532068832
Energy: 0.6575942897851587
Energy: 0.8357481998287072
Energy: 0.706735459881732
Energy: 0.9044871878336381
Energy: 0.8905863046264769
Energy: 1.0188064237518453
Energy: 0.8899481438137429
Energy: 0.8064782463565597
Energy: 0.7030199023809847
Energy: 0.8662613081252653
Energy: 0.9100440044832682
Energy: 0.8804157429943302
Energy: 0.8906190772373307

minimum gb energy = 0.5484974034202506 eV
minimum distance =  2.2581238833068 Angstroms
sigma value = 21


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

Energy: 1.081658563473736
Energy: 1.2028879834593778
Energy: 1.2172107889611807
Energy: 1.2423820601598359
Energy: 0.8183826487125923
Energy: 1.1259718245860773
Energy: 1.098799534236172
Energy: 1.1971412763259623
Energy: 1.0053540916229922
Energy: 1.1030087457962778
Energy: 0.9120013267153138
Energy: 0.8986287145773036
Energy: 1.1533811141007535
Energy: 0.7654731762980421
Energy: 1.1683371178619961
Energy: 0.9464252043511225
Energy: 0.7767779330498646
Energy: 0.8453508205208975
Energy: 1.0965882817001926
Energy: 0.8138818373378213
Energy: 0.9231014306730997
Energy: 0.9547152449019091
Energy: 0.9747276139152858
Energy: 1.0631224756599507
Energy: 0.7864668451221691
Energy: 0.9813753101630683
Energy: 1.0045059362899587
Energy: 0.9269206016367699
Energy: 0.8165251018109346
Energy: 0.9420797945208557
Energy: 0.8482714683146045
Energy: 0.7503676773859242
Energy: 0.6256886363513641
Energy: 1.0854702103509029
Energy: 0.7831352817086179
Energy: 0.6722327929041538
Energy: 0.7858652470495996
Energy: 1.0939001511461521
Energy: 0.793249728285804
Energy: 0.8212939332272655
Energy: 0.8437844187196277
Energy: 0.7455384540465997
Energy: 0.7892361420264455
Energy: 0.7109899698542322
Energy: 1.0099531903136465
Energy: 1.068945695342626
Energy: 0.8453863831257212
Energy: 0.8283718349749274
Energy: 0.7425895318217919
Energy: 0.9993555966333898
Energy: 0.6146967556888424
Energy: 0.8157016970091308
Energy: 0.8153774353571074
Energy: 1.0145938289700291
Energy: 0.7610458728654563
Energy: 0.916936235251806
Energy: 0.7906446696379156
Energy: 0.9008727794737988
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Energy: 0.8636116425908211
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Energy: 0.7913583141379782
Energy: 1.1954832365442272
Energy: 1.1691917133449565
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Energy: 0.6937157599453052
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Energy: 0.8785710119693841
Energy: 1.1057285714757894
Energy: 1.1611530056416943
Energy: 0.6726122563776873
Energy: 0.730093599441014
Energy: 0.6982714880694696
Energy: 0.8930349793965329
Energy: 0.8975768479025237
Energy: 0.8092470171169172
Energy: 1.2052971100304362
Energy: 0.7982159510112902
Energy: 0.8446128821273087
Energy: 0.9625850120986427
Energy: 1.0444852680970842
Energy: 1.1078995925480657
Energy: 0.9617702314905617
Energy: 0.9896186470105072
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Energy: 0.8903156696046504
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Energy: 0.9822770712895866
Energy: 0.9352611283372216
Energy: 0.7516473240552373
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Energy: 1.0818395555072353
Energy: 0.7758753114035789
Energy: 1.2198264885706387
Energy: 0.7315184550625909
Energy: 0.9481761927554354
Energy: 1.0011050816905445
Energy: 0.9727794945592186
Energy: 1.0749483355763934
Energy: 1.0147784882473556
Energy: 0.941001366626883
Energy: 0.8961387975920603
Energy: 0.9821948353683617
Energy: 1.0412286473123449
Energy: 0.9728421849152659
Energy: 0.9288584847453594
Energy: 0.6977591874364222
Energy: 0.846836570231726
Energy: 0.6766063961842292
Energy: 0.8328022546129192
Energy: 0.6626672737923541
Energy: 0.5937147784014137
Energy: 0.9598671937745752
Energy: 0.6700107416969269
Energy: 0.8150799628682693
Energy: 0.8934016801852981
Energy: 1.1598806310694338
Energy: 0.8051779390633774
Energy: 1.02765257849698
Energy: 0.7159927279242293
Energy: 0.8863582882628174
Energy: 1.1830076413027004
Energy: 0.6228214513954095
Energy: 0.8289100924953571
Energy: 0.83942226269796
Energy: 0.7573527560489267
Energy: 0.8382786847186917
Energy: 0.6407924936131976
Energy: 1.0044475069985084
Energy: 0.7650462599714825
Energy: 0.8045783699248762
Energy: 0.6340966474215034
Energy: 0.8854002098104258
Energy: 0.8358179961433215
Energy: 0.646936689521987
Energy: 1.031500370371226
Energy: 0.8615233625820564
Energy: 0.918273868203202
Energy: 0.8980031789017932
Energy: 0.8714287821467255
Energy: 0.8856941784449873
Energy: 0.8245590837251671
Energy: 1.189139609313959
Energy: 0.8350498879470896
Energy: 0.989780455610019
Energy: 0.6901130845220519
Energy: 0.6613254554537527
Energy: 0.9200280792288866
Energy: 0.8559659090925045
Energy: 1.062477337408705
Energy: 0.9948061828549732
Energy: 0.9942008930685122
Energy: 1.157721164683059
Energy: 0.8650988688134436
Energy: 1.0741861943199236
Energy: 1.0772572262286235
Energy: 1.2007889313983375
Energy: 0.7561324495430994
Energy: 1.1433462653740745
Energy: 1.3108950998859321
Energy: 1.0828090758686892
Energy: 1.0903916555896245
Energy: 1.067715248462395
Energy: 0.9566210397884688
Energy: 0.9749364393227138
Energy: 0.7379005824503166
Energy: 0.709067082190544
Energy: 0.8321398686017951
Energy: 1.0904394445449537
Energy: 0.8558210737806201

minimum gb energy = 0.5937147784014137 eV
minimum distance =  2.25911181504044 Angstroms
sigma value = 113


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

Energy: 0.986587120233822
Energy: 1.319380648851998
Energy: 1.1636369390370127
Energy: 0.9205335243481195
Energy: 1.018718742789009
Energy: 1.0149822842800267
Energy: 1.2451685355069513
Energy: 0.7732897549154883
Energy: 0.7488954357831796
Energy: 0.8831916201987121
Energy: 0.6875000244612932
Energy: 0.7880751139373305
Energy: 0.6772137706906461
Energy: 0.860538832179805
Energy: 1.167958209327312
Energy: 0.7488661070430033
Energy: 0.8443148292108512
Energy: 0.8783070646485978
Energy: 0.7719908267164809
Energy: 0.8598142288416248
Energy: 0.7327085604018553
Energy: 0.9855510436539058
Energy: 0.6351769372480819
Energy: 1.012468707869942
Energy: 0.7511469437695685
Energy: 0.7933311905273407
Energy: 0.9909784869948203
Energy: 0.7775678959935899
Energy: 0.801639457724664
Energy: 0.6584802647885178
Energy: 0.6607869630834675
Energy: 0.6158236365874253
Energy: 0.664768029746397
Energy: 0.7044067310975697
Energy: 0.8023440605201516
Energy: 0.8605892495693499
Energy: 0.6442327793141311
Energy: 1.008089444128218
Energy: 0.4666616084718758
Energy: 0.8308113588335323
Energy: 0.8306003981361065
Energy: 0.7261219153906441
Energy: 0.8593928480157974
Energy: 0.5671722934087843
Energy: 0.7912015942668275
Energy: 0.7904231106757703
Energy: 0.7574156502668782
Energy: 0.7057656778091923
Energy: 0.6780575205961218
Energy: 0.9146764721704658
Energy: 0.466871947031862
Energy: 0.5183923594520137
Energy: 0.7389336154081284
Energy: 0.6505200781153144
Energy: 0.491037015615629
Energy: 0.661228645973612
Energy: 0.7430576339621231
Energy: 0.5883561974134559
Energy: 1.1129538622253132
Energy: 0.6044133501383833
Energy: 0.6679759887182269
Energy: 1.1176794250819193
Energy: 0.6792507619102797
Energy: 1.0562622518453975
Energy: 0.7337436641576404
Energy: 0.656940130089545
Energy: 0.5923595465712309
Energy: 0.5052218090285376
Energy: 0.5888900458582301
Energy: 0.7414526066306547
Energy: 1.0524796390263604
Energy: 0.541843151219535
Energy: 0.7298536217505666
Energy: 0.6517246079526752
Energy: 0.5461586212621922
Energy: 0.7602386371617763
Energy: 0.5444370441315787
Energy: 0.7296331083282409
Energy: 0.5277315171991195
Energy: 1.0572775745079759
Energy: 0.7454227155761733
Energy: 0.8882119295494214
Energy: 1.070409894419753
Energy: 0.5382648556733606
Energy: 0.8575286448392326
Energy: 0.507299039929904
Energy: 0.6844985640236817
Energy: 0.8976395395980982
Energy: 0.5195429749552894
Energy: 0.5783964956140754
Energy: 0.7257455637935126
Energy: 1.0902675591398596
Energy: 0.6251387220607207
Energy: 0.7154030049247331
Energy: 0.6833109640959958
Energy: 0.7807420523671743
Energy: 0.8402433943449804
Energy: 0.6812949705427344
Energy: 0.8380145452741742
Energy: 1.078391025940953
Energy: 1.0921989236970775
Energy: 0.7297862509554449
Energy: 1.0130118570499578
Energy: 0.8433837406009844
Energy: 0.8192649688988441
Energy: 0.7504420825964295
Energy: 0.5381177621244743
Energy: 0.6226826932335636
Energy: 0.648944211694954
Energy: 0.4979276863049679
Energy: 0.8283622411825304
Energy: 0.6855691124752129
Energy: 0.7992286064389367
Energy: 0.7515875636059555
Energy: 0.8737693447930064
Energy: 0.6067018159057298
Energy: 0.7174554790390237
Energy: 0.7372490279495987
Energy: 0.6576483357116021
Energy: 0.8182053671080153
Energy: 0.671614028806456
Energy: 0.8628186493701884
Energy: 0.8476720589360253
Energy: 0.7559850721643646
Energy: 0.7651137934045289
Energy: 0.747059742082828
Energy: 0.6724539810079957
Energy: 0.8762288857382825
Energy: 0.5555021569005292
Energy: 0.596543499649508
Energy: 0.6240731176759442
Energy: 0.8113447533899023
Energy: 0.7634031474544718
Energy: 1.034140305861137
Energy: 0.7396358374569294
Energy: 0.9777208672010592
Energy: 0.9972520333165885
Energy: 0.9254028470478323
Energy: 1.0787042306988073
Energy: 0.7730099227119225
Energy: 1.1410227097514425
Energy: 0.8677042841177967
Energy: 0.9410806142441238
Energy: 0.8617324382632322
Energy: 0.807470489258968
Energy: 0.7956018141532067
Energy: 0.6845825043051965
Energy: 0.7730925706495193
Energy: 0.8616924911673669
Energy: 0.8753197098009604
Energy: 0.6065237094501538
Energy: 0.7313431542712137
Energy: 0.7467092952365993
Energy: 0.8098993320229348
Energy: 0.9756435372701759
Energy: 0.9489881298525908
Energy: 1.1642552189669308
Energy: 0.9125138368806986
Energy: 1.010382384264419
Energy: 0.9159471522132859
Energy: 0.9830780587494528
Energy: 0.7359026746797976
Energy: 0.8585644106746527
Energy: 0.6849224678101462
Energy: 0.5654235860355238
Energy: 0.6811331453422307
Energy: 0.6593088345823034
Energy: 0.8063025063341397
Energy: 1.0530200909751695
Energy: 0.6814361926668856
Energy: 1.0303829459236944
Energy: 0.7179078540238988
Energy: 0.8067865272973334
Energy: 0.9006378403278695
Energy: 0.7359331129410434
Energy: 1.085768374670498
Energy: 0.6210672176931628
Energy: 1.03032637526483
Energy: 0.5886183769736181
Energy: 0.6974691161744632
Energy: 0.9690525514174717
Energy: 0.6850850969734278
Energy: 0.9885612381867166
Energy: 0.676397852112529
Energy: 0.6948277816803323
Energy: 0.6964503928323104
Energy: 0.5767100196497407
Energy: 0.8034660586012133
Energy: 0.820285717812674
Energy: 0.7857367534912374
Energy: 0.7529935307918247
Energy: 1.0373170217247347
Energy: 0.8228424794129733
Energy: 0.7969770963314765
Energy: 0.769471526763812
Energy: 1.0807822730797132
Energy: 1.100228417788727
Energy: 0.5764539901158222
Energy: 0.7534459291947927
Energy: 0.7866887546759325
Energy: 0.8536831507912092
Energy: 0.6952187585132226
Energy: 0.6072541179150748
Energy: 1.1275330056306268
Energy: 0.4659858663639644
Energy: 0.8667616184090118
Energy: 0.7421859291082603
Energy: 0.681952138891752
Energy: 0.49932185168955256
Energy: 0.6627238712756222
Energy: 0.9196955854006849
Energy: 0.59086030092264
Energy: 0.895455826144254
Energy: 0.6181205783145447
Energy: 0.7021252344091488
Energy: 1.1655446187162866
Energy: 0.6688424056825881
Energy: 0.9872678224139041
Energy: 0.9447426257405352
Energy: 0.8487829845490452
Energy: 0.4398821018630542
Energy: 0.5847405727551884
Energy: 0.8777095170638516
Energy: 0.5713328801889123
Energy: 1.0616759140141967
Energy: 0.5813030862526918
Energy: 0.8464334594846001
Energy: 0.826919143959068
Energy: 0.8223236787273227
Energy: 0.7708020822363508
Energy: 0.5446897153228972
Energy: 0.6761372812627751
Energy: 0.5545399473371794
Energy: 1.1263692779308363
Energy: 0.730941465161932
Energy: 0.8615162187105266
Energy: 1.0536645264750428
Energy: 0.5440472330429326
Energy: 0.9049789444763625
Energy: 0.4880787243719734
Energy: 0.5578454039355034
Energy: 1.006112307189238
Energy: 0.8111070786844371
Energy: 0.7237007020354349
Energy: 0.7093226161693139
Energy: 0.9843308904285922
Energy: 0.9049922136861454
Energy: 0.7306496969860605
Energy: 0.6755048166047993
Energy: 1.0005667626280472
Energy: 0.7174123335350732
Energy: 0.6144292509101454
Energy: 0.9379795184559893
Energy: 0.6127946037872046
Energy: 1.0862232168073176
Energy: 0.549296140856387
Energy: 0.8141416717270721
Energy: 0.9936150861733739
Energy: 0.9218031590031007
Energy: 0.7282376657910935
Energy: 0.5434354708258234
Energy: 0.5813292947580356
Energy: 0.731871159351606
Energy: 0.5449387177508052
Energy: 0.77577584622011
Energy: 0.6067839464187474
Energy: 0.8963706568218555
Energy: 0.8857172658478643
Energy: 0.9201001642306442
Energy: 0.6433055855027889
Energy: 0.806131308492052
Energy: 0.9267468685296405
Energy: 0.697971138439812
Energy: 0.8211875084619001
Energy: 0.6597303912816247
Energy: 0.9064395184777553
Energy: 0.7161513900967663
Energy: 0.7494583968641888
Energy: 0.9865599317521503
Energy: 0.6369289672138524
Energy: 0.877766024376912
Energy: 0.8123611669507611
Energy: 0.6262034704659553
Energy: 0.6533564127743922
Energy: 0.6428681561511443
Energy: 0.633981759588198
Energy: 0.6923470527929371
Energy: 1.0365590347013396
Energy: 0.9129499655874099
Energy: 1.0547179224629568
Energy: 1.1385230628339877
Energy: 0.9613497298765663
Energy: 0.9499773175717618
Energy: 0.9214349058874023
Energy: 0.9990671270697634
Energy: 0.7625188008364507
Energy: 0.8382506558751139
Energy: 0.7894853004053616
Energy: 0.6970025865368954
Energy: 0.7350032124634432
Energy: 0.8071741997556564
Energy: 1.253597506231141
Energy: 0.8193349571716209
Energy: 0.9814367995821695
Energy: 0.7515856078050648
Energy: 0.7324611568427233
Energy: 0.7881133745151173
Energy: 0.7007821424321293
Energy: 0.984294151835922
Energy: 0.9988965406955961
Energy: 1.1595698645097565
Energy: 0.7142623444562795
Energy: 0.7667860031730631
Energy: 1.0792347634103474
Energy: 0.8245111783519644

minimum gb energy = 0.4398821018630542 eV
minimum distance =  2.23577994969426 Angstroms
sigma value = 365


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

Energy: 0.9262909728708016
Energy: 0.4197309771501785
Energy: 0.45299374530160025
Energy: 0.43677516880680234
Energy: 0.43644104968779995
Energy: 0.4354358839790651
Energy: 0.4293647078822082
Energy: 0.9408187926447249
Energy: 0.45325659306318755
Energy: 0.43762060602599306
Energy: 0.43776877896685734
Energy: 0.3889813137739165
Energy: 0.45271940728011684
Energy: 0.33455267606862715
Energy: 0.9253844516295936
Energy: 0.46992897109713483
Energy: 0.40785730907845297
Energy: 0.4349978982947853
Energy: 0.4395140345466072
Energy: 0.43712817735022425
Energy: 0.3694829230341806
Energy: 0.9235433767537954
Energy: 0.46894453667028296
Energy: 0.4058038760228013
Energy: 0.4493057250216863
Energy: 0.437347091700588
Energy: 0.41367619570804937
Energy: 0.4275759317925958
Energy: 0.9116427190117832
Energy: 1.0933695796378144
Energy: 0.8501327958594908
Energy: 0.3408677162487987
Energy: 0.9347340665925015
Energy: 0.32887209239692755
Energy: 0.2783631471600781
Energy: 0.9294160345826459
Energy: 0.4640466122645662
Energy: 0.49282628303901094
Energy: 0.4621842606378051
Energy: 0.4640314516808842
Energy: 0.4152630858872286
Energy: 0.42792005574911507
Energy: 0.9136843086212483
Energy: 0.4655498867983837
Energy: 0.4254067701206626
Energy: 0.40261480206367134
Energy: 0.4350374256822091
Energy: 0.43221792218261434
Energy: 0.45843430045002015
Energy: 0.910705707491377
Energy: 0.3560020661669612
Energy: 0.4490171928842683
Energy: 0.40991470042256645
Energy: 0.4331095515122459
Energy: 0.4314654076158441
Energy: 0.4648108616101771
Energy: 0.9292864740786152
Energy: 0.2972107121625868
Energy: 0.47252952718382657
Energy: 0.41854793214988684
Energy: 0.41516529998163815
Energy: 0.4356775065618082
Energy: 0.4118280096545349
Energy: 0.9138816323263816
Energy: 1.1122829215708425
Energy: 0.837264541227963
Energy: 0.9481993939233199
Energy: 0.9313938289578728
Energy: 0.8407938037026399
Energy: 1.089427641965944
Energy: 0.9264473668211107
Energy: 0.469064304302826
Energy: 0.41057355768128395
Energy: 0.393254565802999
Energy: 0.4783480285960203
Energy: 0.41509616832981566
Energy: 0.4475215544990339
Energy: 0.9223470622211474
Energy: 0.46417354884232026
Energy: 0.42191985401248056
Energy: 0.43354475401805015
Energy: 0.42717467394114905
Energy: 0.42892545126156206
Energy: 0.4594274789936454
Energy: 0.914159154381872
Energy: 0.3078360845139831
Energy: 0.9084262088457551
Energy: 0.4248000051170562
Energy: 0.4006805549252612
Energy: 0.3957956312909671
Energy: 0.4682837496493961
Energy: 0.9288249486197735
Energy: 0.4558932604128209
Energy: 0.4108115821814148
Energy: 0.42730264246503336
Energy: 0.442532817647607
Energy: 0.42702828816979127
Energy: 0.4706426624772728
Energy: 0.91012045077873
Energy: 0.3282899680448577
Energy: 0.907147246236788
Energy: 0.5364133625992498
Energy: 0.40868756934614553
Energy: 0.4315816465525008
Energy: 0.4143435762871099
Energy: 0.9193647539123243
Energy: 0.37972301408211934
Energy: 0.4171918875540882
Energy: 0.4146291414539709
Energy: 0.41313077847826196
Energy: 0.48561143396825845
Energy: 0.4145889793227884
Energy: 0.9199534118274162
Energy: 0.4515373714943507
Energy: 0.48491456793911425
Energy: 0.44249103533908596
Energy: 0.4394403145549103
Energy: 0.41235233117237163
Energy: 0.417554986388538
Energy: 0.9103143406953064
Energy: 0.44285830592683967
Energy: 0.44677474798715117
Energy: 0.41379968864796857
Energy: 0.4039461661206633
Energy: 0.4305760006813164
Energy: 0.42821283194436777
Energy: 0.9294217233117322
Energy: 0.42726203334226837
Energy: 0.44327818738454217
Energy: 0.4434875124299631
Energy: 0.39776590814681345
Energy: 0.4474531195634532
Energy: 0.4204353719675806
Energy: 0.891661522540925
Energy: 0.3089282965639416
Energy: 0.8999605540987535
Energy: 0.42596267783651554
Energy: 0.3889059989554862
Energy: 0.44824759804655456
Energy: 0.45125495072870103

minimum gb energy = 0.2783631471600781 eV
minimum distance =  2.38819964817088 Angstroms
sigma value = 23