Model name: model_name=MEAM_LAMMPS_MahataMukhopadhyayAsleZaeem_2022_AlNi__MO_461927113651_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.521391749382019
cohesive_energy=4.450350014731871
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.9905923153806198e-19, 2.8384161247944e-19, 3.48808272811506e-19, 4.0176822144837597e-19, 4.463071296969419e-19, 4.84454955352482e-19, 5.175094614885359e-19, 5.463566517837059e-19, 5.716566230112e-19, 5.93896436867754e-19, 6.134558092156259e-19, 6.30637551438642e-19, 6.456932052683399e-19, 6.588246449606038e-19, 6.702097121218079e-19, 6.799926026490119e-19, 6.883014906729359e-19, 6.95245324204692e-19, 7.009234381955879e-19, 7.0541754365395795e-19, 7.088061472348679e-19, 7.11153336003678e-19, 7.125231970257479e-19, 7.1296860213e-19, 7.12491153493068e-19, 7.1094985957116e-19, 7.08162072228e-19, 7.03906691088096e-19, 6.979273678900079e-19, 6.89911678190106e-19, 6.794895191859359e-19, 6.662122814199779e-19, 6.4953842918994e-19, 6.288062635459799e-19, 6.032050831112939e-19, 5.71731925312998e-19, 5.331386945532059e-19, 4.85855257730598e-19, 4.2789812017228195e-19, 3.56721423206832e-19, 2.6902948949810996e-19, 1.6049804431094998e-19, 2.5378798317886796e-20, -1.4412588194109418e-19, -3.5915512951387797e-19, -6.36894051194412e-19, -1.005383461777974e-18, -1.51311163491594e-18, -2.2496162117994e-18, -3.3929935448871597e-18, -5.3287433540859595e-18, -8.97712385443272e-18, -1.67919326479638e-17, -3.6084061933284595e-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: 0.02215512848506267
Energy: 0.022919289365853756
Energy: 1.5201361109025648
Energy: 1.1191195588475198
Energy: 1.1169650124527457
Energy: 0.40308828858413615
Energy: 0.02270795681614293
Energy: 0.02239156724422492
Energy: 1.1813760419863923
Energy: 0.3091846392316557
Energy: 0.9952403602239993
Energy: 0.7493086198126065
Energy: 0.02313813340889333
Energy: 0.1534534558882561
Energy: 0.02272790478679192
Energy: 1.1813599337307898
Energy: 0.9946739377314933
Energy: 0.9977674086557441
Energy: 0.943508536775659
Energy: 0.1522152032933608
Energy: 0.15370652676302476
Energy: 0.026164633545998475
Energy: 0.7463393940313315
Energy: 1.3710873172226887
Energy: 1.1191282084264398
Energy: 1.1159373334596545
Energy: 0.40340821217732203
Energy: 0.023111743497413403
Energy: 0.402418839365778
Energy: 1.184801559939472
Energy: 0.3092309422472614
Energy: 0.744338334235988
Energy: 0.7492089677743999
Energy: 0.022903841872790216
Energy: 0.15258975850609185
Energy: 0.022696211173049798
Energy: 1.0350669111332813
Energy: 0.9948002266373441
Energy: 0.9973019225707934
Energy: 0.943280655331077
Energy: 0.15194622653379034
Energy: 0.15384810737036742

minimum gb energy = 0.02215512848506267 eV
minimum distance =  2.46854036154768 Angstroms
sigma value = 5


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

Energy: 1.5818499211262214
Energy: 1.798691145015888
Energy: 1.7256560505122969
Energy: 1.8032601069943681
Energy: 1.7521607461799413
Energy: 1.6972570104585813
Energy: 1.676796043048164
Energy: 1.4677870133996787
Energy: 1.7115029775251156
Energy: 1.5283706296972237
Energy: 1.889360927862686
Energy: 1.7357843903863854
Energy: 1.6126580411606013
Energy: 1.7158101756505197
Energy: 1.6923431523882668
Energy: 1.66396615566941
Energy: 1.6953087801376532
Energy: 1.6866552711735534
Energy: 1.729850341619606
Energy: 1.6985647730732893
Energy: 1.5121625188235182
Energy: 1.584159905972242
Energy: 1.7358734828117657
Energy: 1.5462551014485646
Energy: 1.6827660767582864
Energy: 1.7032545396425274
Energy: 1.5784148249174017
Energy: 1.8854761252155743
Energy: 1.6608333024721709
Energy: 1.778573433406949
Energy: 1.5905126188831271
Energy: 1.6281510509500028
Energy: 1.6184147007904766
Energy: 1.6935585699151037
Energy: 1.9001496470328427
Energy: 1.5722985684199227
Energy: 1.7326484406294682
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Energy: 1.599733299471434
Energy: 1.7163755146560518
Energy: 1.5936514656458198
Energy: 1.8655260412733576
Energy: 1.633968435844532
Energy: 1.8463929812720041
Energy: 1.59292166392641
Energy: 1.6698625773719917
Energy: 1.6713491173667152
Energy: 1.614376599513946
Energy: 1.8837359941176623
Energy: 1.50062000578896
Energy: 1.8223125011795707
Energy: 1.59370865200348
Energy: 1.6118314476021403
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Energy: 1.5962819067859555
Energy: 1.728091382328956
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Energy: 1.6666379731952585
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Energy: 1.6715744495644669
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Energy: 1.663843726045642
Energy: 1.8654365841541092
Energy: 1.642191073729584
Energy: 1.6048585914233322
Energy: 1.6751895153292615
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Energy: 1.7413909563162748
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Energy: 1.6919022078696084
Energy: 1.5998132820573598
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Energy: 1.7321754808998047
Energy: 1.6601706034212556
Energy: 1.9159508304309116
Energy: 1.8185362080995984
Energy: 1.6634818045133362
Energy: 1.8018231497227277
Energy: 1.5649475961591708
Energy: 1.7123202802198045
Energy: 1.6872657030652125
Energy: 1.7544139887439594
Energy: 1.5956420004189404
Energy: 1.68111845423612
Energy: 1.5986231372346642
Energy: 1.5900142084461604
Energy: 1.7879049107465221
Energy: 1.5665763830907602
Energy: 1.679823206818835
Energy: 1.7003696829666355
Energy: 1.5927731500070916
Energy: 1.8805877617762814
Energy: 1.8529007168927256
Energy: 1.7605964785861163
Energy: 1.5929169346399623
Energy: 1.6233110761521377
Energy: 1.7213274951343265
Energy: 1.6967703815312798
Energy: 1.9866750711258185
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Energy: 1.7564961937870398
Energy: 1.5939969325142571
Energy: 1.6606829940402938
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Energy: 1.6765970965060335
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Energy: 1.625486953614274
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Energy: 1.6736418270464342
Energy: 1.540499681267856
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Energy: 1.6692945769312084
Energy: 1.7314449639227616
Energy: 1.649094172263674
Energy: 1.7541059091337048
Energy: 1.6688099180778866
Energy: 1.6581990893399223
Energy: 1.8376913301908677
Energy: 1.5022603513261925
Energy: 1.8359480896301685
Energy: 1.5541367473936343
Energy: 1.6429379559324475
Energy: 1.6313759988298207
Energy: 1.573873465762866
Energy: 1.88499617348408
Energy: 1.7209121035732828
Energy: 1.6548401831938078
Energy: 1.5835200408288543
Energy: 1.5835187745954482
Energy: 1.6773314123997398
Energy: 1.7040880705808301
Energy: 1.6032223210082381
Energy: 1.563728746757269
Energy: 1.7174548300745311
Energy: 1.5516051981550714
Energy: 1.6668860654133526
Energy: 1.7576660570352591
Energy: 1.6269267851702187
Energy: 1.7617957332921645
Energy: 1.6238054575872016
Energy: 1.668822834777675
Energy: 1.6070225319643507
Energy: 1.6376322621588366
Energy: 1.5914296540329165
Energy: 1.6116399979204243
Energy: 1.773867536562499
Energy: 1.5114861983579007
Energy: 1.691909554317805
Energy: 1.6050534051807799
Energy: 1.7051173723336046
Energy: 1.773681338348802
Energy: 1.7094991563713522
Energy: 1.6534451887168138
Energy: 1.6318277682839473
Energy: 1.7197733950826597
Energy: 1.5982745223093382
Energy: 1.62146363655303
Energy: 1.7849084715148904
Energy: 1.6894790412375393
Energy: 1.5065097665026157
Energy: 1.4941851248129114
Energy: 1.6573842297937962
Energy: 1.6247870296382627
Energy: 1.7801219087878255
Energy: 1.6302651878150352
Energy: 1.5468090203303082
Energy: 1.739961636781111
Energy: 1.5884702244909736
Energy: 1.7356467874402801
Energy: 1.6633747030821557
Energy: 1.6790880803210002
Energy: 1.7567239421381198
Energy: 1.602756617145365
Energy: 1.756171992567902

minimum gb energy = 1.4677870133996787 eV
minimum distance =  2.21308819570131 Angstroms
sigma value = 401


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

Energy: 1.5148750912260327
Energy: 1.6672777730737454
Energy: 1.6847892080936648
Energy: 1.7103745494374962
Energy: 1.7910886318843182
Energy: 1.6210059618351136
Energy: 1.5561163845536095
Energy: 1.4892960646271656
Energy: 1.4655011396838624
Energy: 1.5617495261327214
Energy: 1.869372469793175
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Energy: 1.7160025936180459
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Energy: 1.7050902218140103
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Energy: 1.7683129492082588
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Energy: 1.5332194896966553
Energy: 1.5784271174263012
Energy: 1.5749113109037112
Energy: 1.6448157609756917
Energy: 1.6227217760701724
Energy: 1.6042631686701772
Energy: 1.5851041406723871
Energy: 1.6742428451557685
Energy: 1.5153414342564269
Energy: 1.5568441533380208
Energy: 1.5417038859433356
Energy: 1.609580732877016
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Energy: 1.7521488784176762
Energy: 1.6499471212364467
Energy: 1.6095038876157783
Energy: 1.5352150922800423
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Energy: 1.5745128858595026
Energy: 1.4733281586109044
Energy: 1.8178634745612523
Energy: 1.6937537819948287
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Energy: 1.601585139533013
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Energy: 1.6343236332856714
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Energy: 1.5008250710847706
Energy: 1.5878890124150364
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Energy: 1.6672487056515728
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Energy: 1.5871100395596325
Energy: 1.492140277339125
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Energy: 1.828066621432351
Energy: 1.5633709409817649
Energy: 1.5038761858782261
Energy: 1.4865794028769566
Energy: 1.485352956635745
Energy: 1.6559824253460764
Energy: 1.8291519582146374
Energy: 1.8059060927994974
Energy: 1.651313887532157
Energy: 1.503789530290013
Energy: 1.5061890100912776
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Energy: 1.541624670660517
Energy: 1.7373974088419477
Energy: 1.753521047550838
Energy: 1.540518115950937
Energy: 1.7067341608852293
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Energy: 1.5580860736102784
Energy: 1.5755034851508272
Energy: 1.659895620165939
Energy: 1.6431421634386947
Energy: 1.6446250348022298
Energy: 1.7157344009882485
Energy: 1.6758788633142638
Energy: 1.636457316197973
Energy: 1.5622193303142102
Energy: 1.6425560215092783
Energy: 1.573713767699715
Energy: 1.5481442480409286
Energy: 1.7946782915230675
Energy: 1.6473193979021652
Energy: 1.549659726185572
Energy: 1.5377474535754447
Energy: 1.5272844607141263
Energy: 1.6097445934048316
Energy: 1.7192623199195756
Energy: 1.7655524309217958
Energy: 1.6119025817564885
Energy: 1.5602687944682887
Energy: 1.6046371307330929
Energy: 1.6071411975953913
Energy: 1.5495685264746994
Energy: 1.5904885282277346
Energy: 1.6796798067332617
Energy: 1.7204470835731958
Energy: 1.7447112178137119
Energy: 1.6373738845064494
Energy: 1.5990870767200673
Energy: 1.5437102082882261
Energy: 1.6756484505321334
Energy: 1.7917996083431176
Energy: 1.5183948905878313
Energy: 1.5933322643504002
Energy: 1.5544519311181746
Energy: 1.743239524328367
Energy: 1.841344658795493
Energy: 1.6140564914881286
Energy: 1.5500062579842868
Energy: 1.5031702658605939
Energy: 1.5298793925464138
Energy: 1.6204163771588194
Energy: 1.7643092388765833
Energy: 1.688933936913995
Energy: 1.5324469538810028
Energy: 1.5896053807844774
Energy: 1.486926768575793
Energy: 1.4798609432814889
Energy: 1.7235948224446176
Energy: 1.6102760487308752
Energy: 1.7655314342521864
Energy: 1.5530869139050143
Energy: 1.4989519259451598
Energy: 1.4861572064372683
Energy: 1.4841451025567605
Energy: 1.6529601670293732
Energy: 1.7340463198243155
Energy: 1.7384469340814395
Energy: 1.652483489614071
Energy: 1.5021376791277046
Energy: 1.4981944481738203
Energy: 1.5088026621188326
Energy: 1.5382363355081174
Energy: 1.8145161515104347
Energy: 1.731617587444633
Energy: 1.5360177733927103
Energy: 1.5838785124922068
Energy: 1.6295533716170416
Energy: 1.6064480450273948
Energy: 1.5795466460945071
Energy: 1.6460303730748267
Energy: 1.636855879697723
Energy: 1.6725339819580733
Energy: 1.7349275993635378
Energy: 1.526590248122322
Energy: 1.5822698539950375
Energy: 1.515422991163947
Energy: 1.6565323083452068
Energy: 1.5491464152674945
Energy: 1.488891110378355
Energy: 1.8209553494158275
Energy: 1.6507047710128122
Energy: 1.5574205807440031
Energy: 1.531919351615581
Energy: 1.5444067637335075
Energy: 1.6082852040612434
Energy: 1.7168895366556338
Energy: 1.6711577464934442
Energy: 1.6052243101912842
Energy: 1.5416116372731528
Energy: 1.5510874857007435
Energy: 1.638286970036392
Energy: 1.549048295179758
Energy: 1.551697878546896
Energy: 1.6041516293723435
Energy: 1.7187776873522342
Energy: 1.6464116940470666
Energy: 1.6157339089998306
Energy: 1.6257527635391447
Energy: 1.5440647692777671
Energy: 1.6734571131119793
Energy: 1.8249832590653325
Energy: 1.5149820419377116
Energy: 1.5730511107780547
Energy: 1.5252673577844968
Energy: 1.7355270301742578
Energy: 1.849410576663171
Energy: 1.6154303751632189
Energy: 1.5533767235914009
Energy: 1.546342312931272
Energy: 1.5779139165162581
Energy: 1.7122034721131658
Energy: 1.9153128561899049
Energy: 1.6059993100389915
Energy: 1.709367344343161
Energy: 1.6148210378387808
Energy: 1.529119203603421
Energy: 1.4768878379804569
Energy: 1.5796665349249623
Energy: 1.942074791066075
Energy: 1.5754293671979802
Energy: 1.5829058715317197
Energy: 1.6149998026845613

minimum gb energy = 1.4655011396838624 eV
minimum distance =  2.21259228211263 Angstroms
sigma value = 311


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

Energy: 1.6363609183011543
Energy: 1.6454787674179856
Energy: 1.5745385638061848
Energy: 1.6971628726015144
Energy: 1.6090939224941632
Energy: 1.5873449765075742
Energy: 1.6937672834421567
Energy: 1.5296066376102477
Energy: 1.6625230687218164
Energy: 1.5103442713740438
Energy: 1.7065742989466808
Energy: 1.641947138365367
Energy: 1.560199799344339
Energy: 1.753586506160589
Energy: 1.5558529145619862
Energy: 1.6249942463417086
Energy: 1.5352552695003099
Energy: 1.720960997441499
Energy: 1.5104499493245
Energy: 1.6091936970097453
Energy: 1.569694580932454
Energy: 1.4939692297764853
Energy: 1.5852217695596196
Energy: 1.5690759320612104
Energy: 1.686093674453077
Energy: 1.6512319853504749
Energy: 1.5201036801260297
Energy: 1.6792280436665197
Energy: 1.6412112428896681
Energy: 1.6599360990650107
Energy: 1.5756718399967382
Energy: 1.6074627375820731
Energy: 1.6156971374190632
Energy: 1.629069574912227
Energy: 1.6598345089457438
Energy: 1.645309109426371
Energy: 1.7198536285257282
Energy: 1.5217480980692533
Energy: 1.6448929505881507
Energy: 1.5850574745745531
Energy: 1.558764678726162
Energy: 1.6685811565172208
Energy: 1.5856953888194656
Energy: 1.6721462343180915
Energy: 1.593282370022284
Energy: 1.556726774600927
Energy: 1.6305739008752402
Energy: 1.5967669564198088
Energy: 1.6437843960246246
Energy: 1.5841373976477704
Energy: 1.7403513358700937
Energy: 1.5431640001366864
Energy: 1.707826400546342
Energy: 1.6354003909805497
Energy: 1.5684356466349416
Energy: 1.683894931675834
Energy: 1.5841771989093305
Energy: 1.7069279049097437
Energy: 1.502262604222757
Energy: 1.6372289468457468
Energy: 1.6586256045870662
Energy: 1.5269106138945792
Energy: 1.6086775172212116
Energy: 1.4631450390024225
Energy: 1.6282552488971347
Energy: 1.5449603612624412
Energy: 1.6083320344562786
Energy: 1.6972717555686103
Energy: 1.5359216999023393
Energy: 1.6302457164289645
Energy: 1.6496262187844224
Energy: 1.6300063660863842
Energy: 1.605737618134144
Energy: 1.6451984281334295
Energy: 1.6206570437855712
Energy: 1.5983208816082584
Energy: 1.6465702221775145
Energy: 1.5312135162832146
Energy: 1.6401746698857338
Energy: 1.5343599025619257
Energy: 1.5627447869041464
Energy: 1.5402072297961729
Energy: 1.5733456606383869
Energy: 1.6067893817435086
Energy: 1.5938548388187994
Energy: 1.6821854951206934
Energy: 1.5927947667381637
Energy: 1.6208216244161913
Energy: 1.657012331804936
Energy: 1.5856827495648749
Energy: 1.6451646433823581
Energy: 1.5215555264521023
Energy: 1.7644703729517752
Energy: 1.6114317279846564
Energy: 1.7175933858380599
Energy: 1.6187082498842766
Energy: 1.5415628126219199
Energy: 1.6760677643647397
Energy: 1.5523401995499977
Energy: 1.6705804540502502
Energy: 1.5794443826271145
Energy: 1.7115188045061112
Energy: 1.670835116453873
Energy: 1.596334198339204
Energy: 1.6199301802064694
Energy: 1.5069337369221834
Energy: 1.7078705571181125
Energy: 1.460900342701798
Energy: 1.5056513971194603
Energy: 1.5583375887417101
Energy: 1.4876354608255762
Energy: 1.6276380956197027
Energy: 1.6234519808844383
Energy: 1.691616157734582
Energy: 1.647932526720306
Energy: 1.6644294319498518
Energy: 1.6167224439990904
Energy: 1.6548054979237716
Energy: 1.6538259695847843
Energy: 1.5452071608211622
Energy: 1.6467378747099453
Energy: 1.5031345530644251
Energy: 1.6158245349401468
Energy: 1.5881287624905909
Energy: 1.5306698480100847
Energy: 1.66054500810618
Energy: 1.5955753326008908
Energy: 1.542861440094459
Energy: 1.5891539725738177
Energy: 1.6982687738458127
Energy: 1.6782993528044785
Energy: 1.6024145921364712
Energy: 1.70777264768704
Energy: 1.5385650262898827
Energy: 1.7075118934651097
Energy: 1.5642856600158932
Energy: 1.6788762707337432
Energy: 1.6991016032951836
Energy: 1.6080370581138776
Energy: 1.7275761046562177
Energy: 1.5817591068784496
Energy: 1.5653991986859597
Energy: 1.6015116035489774
Energy: 1.642436235592089
Energy: 1.6530229232841676
Energy: 1.5831298217058005
Energy: 1.589904046835751
Energy: 1.48064004084378
Energy: 1.6565427250956157
Energy: 1.5583555005046619
Energy: 1.617759509439798
Energy: 1.5926416683199174
Energy: 1.505223178379796
Energy: 1.6140628485938426
Energy: 1.6690696002798726
Energy: 1.802010231104363
Energy: 1.6850743762669573
Energy: 1.646261349204803
Energy: 1.5959429692684992
Energy: 1.6497552205645365
Energy: 1.6626873737294474
Energy: 1.5452799703099922
Energy: 1.6788939729080712
Energy: 1.5788161352542691
Energy: 1.5440468294170597
Energy: 1.5549094500242746
Energy: 1.5414601688782659
Energy: 1.6504360589230207
Energy: 1.5917002681843386
Energy: 1.764443265088073
Energy: 1.6504881003633245
Energy: 1.6560575916342772
Energy: 1.6508075970095881
Energy: 1.5924562277541754
Energy: 1.6673278789179096
Energy: 1.6210987186286867
Energy: 1.7221191762739294
Energy: 1.6245989617328718
Energy: 1.7048802749084218
Energy: 1.635363037160965
Energy: 1.5593100454725282
Energy: 1.6023911539400066
Energy: 1.5641275816845237
Energy: 1.6995145536807936
Energy: 1.5864867046407791
Energy: 1.630752199913309
Energy: 1.633436092116874
Energy: 1.5936422397291883
Energy: 1.6289923706392548
Energy: 1.514475154608009
Energy: 1.5987668104705575
Energy: 1.5553754198446106
Energy: 1.5470366841911125
Energy: 1.6586363068646728
Energy: 1.5692730645397228
Energy: 1.6134961750126924
Energy: 1.6316825234249386
Energy: 1.618429738688323
Energy: 1.6074374155135525
Energy: 1.6789854870920051
Energy: 1.6402438425885568
Energy: 1.6815833839851682
Energy: 1.5994466299222312
Energy: 1.5207083420193046
Energy: 1.6289464187823317
Energy: 1.5841840196979926
Energy: 1.5886534180662628
Energy: 1.7387738262170593
Energy: 1.5408435209103517
Energy: 1.6457040641582155
Energy: 1.5941119560549137
Energy: 1.662389574078689
Energy: 1.5675874838275772
Energy: 1.7341794094018668
Energy: 1.6504576707735854
Energy: 1.5661881231827648
Energy: 1.5669982777005151
Energy: 1.5584791534770406
Energy: 1.7075256482486805
Energy: 1.6185982923316236
Energy: 1.7700598024155216
Energy: 1.6829532565399312
Energy: 1.620142059177591
Energy: 1.6260267740063399
Energy: 1.5756640694175772
Energy: 1.6910166015511074
Energy: 1.5556609109889497
Energy: 1.5910399623547486
Energy: 1.6712803264094425
Energy: 1.5654535390803637
Energy: 1.6744162131869564
Energy: 1.6720732987613325
Energy: 1.5859835491136578
Energy: 1.561961023279351
Energy: 1.5310447649947037
Energy: 1.6242238018750936
Energy: 1.5959467407433403
Energy: 1.6089077398963072
Energy: 1.689838594958925
Energy: 1.5965648837967095
Energy: 1.5802636566252863
Energy: 1.6493372541245588
Energy: 1.616867946385925
Energy: 1.6530983106442485
Energy: 1.7135142234668244
Energy: 1.5572325506369127
Energy: 1.635359185056093
Energy: 1.5662478743235682
Energy: 1.6345971162006323
Energy: 1.5752954615971835
Energy: 1.5432816779744967
Energy: 1.6338351796036872

minimum gb energy = 1.460900342701798 eV
minimum distance =  2.2083545334407 Angstroms
sigma value = 39


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

Energy: 1.4326748829954614
Energy: 1.5386292872795944
Energy: 1.7703166181332572
Energy: 1.6389529147361646
Energy: 1.6269210926631443
Energy: 1.6922295411226318
Energy: 1.3641696596838015
Energy: 1.370770004587511
Energy: 1.5362269462216314
Energy: 1.491110871715929
Energy: 1.4078335155548998
Energy: 1.395758321756066
Energy: 1.4219392530107635
Energy: 1.6907271782978317
Energy: 1.9525758611314445
Energy: 1.3764996678974564
Energy: 1.4689311095167696
Energy: 1.3866766345584014
Energy: 1.3953649541098396
Energy: 1.4641894406130562
Energy: 1.5710516140597246
Energy: 1.4250812110827487
Energy: 1.3943864172952378
Energy: 1.4974123332388927
Energy: 1.4697319446779407
Energy: 1.4084650339611249
Energy: 1.524850047636427
Energy: 1.5144719831037259
Energy: 1.4636058052639307
Energy: 1.3951464536142388
Energy: 1.470969195336703
Energy: 1.5677599049454352
Energy: 1.5166275033687493
Energy: 1.692097182790625
Energy: 1.418682232733843
Energy: 1.3725404659263625
Energy: 1.3932626012149323
Energy: 1.5185178342235197
Energy: 1.6179484825903316
Energy: 1.5327276344497998
Energy: 1.4576792089352508
Energy: 1.5113474335352368
Energy: 1.7275380463274796
Energy: 1.5244824610549512
Energy: 1.4601667188868055
Energy: 1.578707589500191
Energy: 1.3662176229267424
Energy: 1.3645266709688804
Energy: 1.4611517029649035
Energy: 1.3689238376503732
Energy: 1.468088504244259
Energy: 1.5615384463356412
Energy: 1.4188973428367686
Energy: 1.5315121538617718
Energy: 1.5547675049680407
Energy: 1.4227206471640634
Energy: 1.372474343504537
Energy: 1.4680608410552327
Energy: 1.6460779891780088
Energy: 1.4200191942595997
Energy: 1.3973077917184054
Energy: 1.6535134825438604
Energy: 1.422985171124274
Energy: 1.7242383641303753
Energy: 1.5623663745932197
Energy: 1.4884392260941592
Energy: 1.3853404385149912
Energy: 1.394160195270533
Energy: 1.4200449228316132
Energy: 1.4183915728854422
Energy: 1.420390609593843
Energy: 1.4253151811808435
Energy: 1.4700860778075333
Energy: 1.4170601735035149
Energy: 1.3953783554370307
Energy: 1.4566447344504003
Energy: 1.4922589546896345
Energy: 1.4686079788335418
Energy: 1.3945834223170281
Energy: 1.4667758312619945
Energy: 1.4799552670540788
Energy: 1.4081188765847674
Energy: 1.4861612928802297
Energy: 1.4565092416798737
Energy: 1.3677077389510524
Energy: 1.39522856633076
Energy: 1.3867845193477568
Energy: 1.5009050355020688
Energy: 1.5307696133737034
Energy: 1.520223491606164
Energy: 1.4521959527868296
Energy: 1.729653146302214
Energy: 1.4187085375484823
Energy: 1.5159826669636889
Energy: 1.5885490580188293
Energy: 1.3640069494399334
Energy: 1.365305097623374
Energy: 1.5083757061099112
Energy: 1.369789330580433
Energy: 1.536593301289673
Energy: 1.4602370172083001
Energy: 1.5880610620234037
Energy: 1.3644028817012381
Energy: 1.3636371213322356
Energy: 1.6921853169953793
Energy: 1.3661019839745079
Energy: 1.5901332874750267
Energy: 1.6487235883341471
Energy: 1.4866646530375947
Energy: 1.5615290086701543
Energy: 1.6917116589371826
Energy: 1.364225021756353
Energy: 1.4817410017591346
Energy: 1.5359840246130145
Energy: 1.4904510654059293
Energy: 1.40810445354197
Energy: 1.3961640956784718
Energy: 1.421261156698757
Energy: 1.6905234029745506
Energy: 1.9525593202120184
Energy: 1.376198618883831
Energy: 1.4682678229220394
Energy: 1.3867307020522086
Energy: 1.3958646838893665
Energy: 1.46406243226171
Energy: 1.5701478719761552
Energy: 1.4248606045774825
Energy: 1.394086137754836
Energy: 1.4963362946571341
Energy: 1.4694661492982475
Energy: 1.4063927568099264
Energy: 1.5249118403367492
Energy: 1.5088297701718194
Energy: 1.4677690175728015
Energy: 1.3980598604273942
Energy: 1.4710152229706592
Energy: 1.5673715141774447
Energy: 1.5161589674031597
Energy: 1.6930923242111382
Energy: 1.4524255872629186
Energy: 1.369112455584494
Energy: 1.3932534908558347
Energy: 1.5185250579069431
Energy: 1.6180452734439612
Energy: 1.53324170659642
Energy: 1.3689657103039656
Energy: 1.5125054185023294
Energy: 1.7264956138203227
Energy: 1.5264772090229297
Energy: 1.4599229985306026
Energy: 1.600191138390423
Energy: 1.3667348953924476
Energy: 1.3654561082445353
Energy: 1.4713449360581428
Energy: 1.3693070637409
Energy: 1.4722423450563336
Energy: 1.5611908957317018
Energy: 1.6237573650691148
Energy: 1.5312425731644916
Energy: 1.554842588758857
Energy: 1.4221165785555798
Energy: 1.372768282130301
Energy: 1.4686608427153294
Energy: 1.6462959004983273
Energy: 1.4197649112017572
Energy: 1.393800275262212
Energy: 1.6529646276687793
Energy: 1.422736108812501
Energy: 1.7241637512843784
Energy: 1.6219672694363998
Energy: 1.488308689244665
Energy: 1.3869845923364272
Energy: 1.394666370299123
Energy: 1.4206927181072562
Energy: 1.4217144299494557
Energy: 1.3833782665565264
Energy: 1.4252779023704762
Energy: 1.4703673711742304
Energy: 1.470254863646574
Energy: 1.3949089826472865
Energy: 1.5237580177516235
Energy: 1.4930360974017836
Energy: 1.4687195087405698
Energy: 1.394358807222662
Energy: 1.4665530804108373
Energy: 1.480323717048918
Energy: 1.4074245334183737
Energy: 1.5113231783677743
Energy: 1.4561569893725057
Energy: 1.3694490206466876
Energy: 1.3960373961664507
Energy: 1.406501894284064
Energy: 1.5006368289502519
Energy: 1.5309306650545667
Energy: 1.519580696223457
Energy: 1.4525081182185553
Energy: 1.7303311164239896
Energy: 1.4197454593744832
Energy: 1.5165235487127093
Energy: 1.5885231125745858
Energy: 1.3641773711931473
Energy: 1.3653421212043428
Energy: 1.5087630535013687
Energy: 1.3689561507038588
Energy: 1.5366030244084314
Energy: 1.4607127886469868
Energy: 1.6243703841396975
Energy: 1.3643550795461816
Energy: 1.3636215269487701
Energy: 1.6926847967391145

minimum gb energy = 1.3636215269487701 eV
minimum distance =  2.21364417309821 Angstroms
sigma value = 21


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

Energy: 1.8107826937994915
Energy: 1.6926000237143812
Energy: 1.5116262088212125
Energy: 1.8353879866644218
Energy: 1.5581704194146568
Energy: 1.6026792784164163
Energy: 1.7719026926012755
Energy: 1.4460214568321004
Energy: 1.7464962883086943
Energy: 1.6251337330668267
Energy: 1.5571441775003774
Energy: 1.56133292915957
Energy: 1.6877514222012377
Energy: 1.7755015685102715
Energy: 1.583874964862726
Energy: 1.6524256493888518
Energy: 1.4647584424078028
Energy: 1.6259090261660183
Energy: 1.5929405867145292
Energy: 1.3307190378175828
Energy: 1.7394029577152266
Energy: 1.6299751960172382
Energy: 1.4919477656250901
Energy: 1.4479458513173973
Energy: 1.5684170065197167
Energy: 1.5502461606784717
Energy: 1.4915848442691932
Energy: 1.6393662572614502
Energy: 1.3293289930526948
Energy: 1.489735014433478
Energy: 1.4133381853663494
Energy: 1.5667987165355768
Energy: 1.5070090550559985
Energy: 1.5046537978888588
Energy: 1.4035970728696583
Energy: 1.311860444901081
Energy: 1.3526794098794066
Energy: 1.395191272545745
Energy: 1.5783812949117046
Energy: 1.8167495117688028
Energy: 1.4434609098606168
Energy: 1.4147565489095106
Energy: 1.4431598941274786
Energy: 1.8250346928608059
Energy: 1.3941766636451551
Energy: 1.4898736665228252
Energy: 1.3658788465726974
Energy: 1.3133968146580683
Energy: 1.4133602212820644
Energy: 1.3921116674581113
Energy: 1.5038740979482386
Energy: 1.4640633838662298
Energy: 1.5210418917589346
Energy: 1.4910099826176688
Energy: 1.3297642980318378
Energy: 1.526460977931441
Energy: 1.4317099029011966
Energy: 1.6469801028686073
Energy: 1.6442508292586262
Energy: 1.6750047895444902
Energy: 1.6653449078631384
Energy: 1.8351320630107835
Energy: 1.7721734884005311
Energy: 1.329655912783488
Energy: 1.6225480077879633
Energy: 1.5167998774269724
Energy: 1.7794729251057073
Energy: 1.449926542139684
Energy: 1.601454776662539
Energy: 1.6843729986836888
Energy: 1.5239708127104157
Energy: 1.6447627881653142
Energy: 1.4043133423337668
Energy: 1.5341473331761992
Energy: 1.5538197064961508
Energy: 1.5462202898119863
Energy: 1.8658485201024053
Energy: 1.3803129969365406
Energy: 1.4911846773500497
Energy: 1.6539327499437355
Energy: 1.739908441523529
Energy: 1.3128537901015191
Energy: 1.550302143158746
Energy: 1.6719702965040033
Energy: 1.5441899955173983
Energy: 1.637763996685512
Energy: 1.7279613677417147
Energy: 1.5887065220423586
Energy: 1.6057933334811856
Energy: 1.512425085138717
Energy: 1.313523114235989
Energy: 1.5458727461065274
Energy: 1.6636485218958654
Energy: 1.4636896240852206
Energy: 1.4871474527765696
Energy: 1.6364578793919433
Energy: 1.739480562902344
Energy: 1.8664623744998072
Energy: 1.6023911435642606
Energy: 1.6505964601750707
Energy: 1.4061974324058832
Energy: 1.6974289571341348
Energy: 1.6663690446262396
Energy: 1.6436472286215844
Energy: 1.745003788075039
Energy: 1.3288263088396675
Energy: 1.6671614644669708
Energy: 1.551000553029889
Energy: 1.6012090221684194
Energy: 1.557879290351897
Energy: 1.5874471279308202
Energy: 1.7751837144501017
Energy: 1.3302796637511023
Energy: 1.5610105269702303
Energy: 1.4668291178670825
Energy: 1.4748498273649686
Energy: 1.4966618107860947
Energy: 1.3633023746985737
Energy: 1.4414014293453945
Energy: 1.312612281460252
Energy: 1.3913089795574192
Energy: 1.4185425869011543
Energy: 1.5966197432667137
Energy: 1.824623925178769
Energy: 1.5780634689597035
Energy: 1.6169236895204728
Energy: 1.544615856946871
Energy: 1.4427475246321637
Energy: 1.3936634266386503
Energy: 1.4913067272712441
Energy: 1.4003904063832875
Energy: 1.312375567080883
Energy: 1.4145518667340116
Energy: 1.392734657200913
Energy: 1.51075828226507
Energy: 1.4634842018729592
Energy: 1.487670370472673
Energy: 1.4914063796248451
Energy: 1.37405972805658
Energy: 1.4040211952377348
Energy: 1.4330499678137287
Energy: 1.5520694602025167
Energy: 1.6441832460897063
Energy: 1.6632997364128823
Energy: 1.5284563042216692
Energy: 1.4285222355893668
Energy: 1.7742268432562773
Energy: 1.3295216799190215
Energy: 1.4914829347928797
Energy: 1.4044334387440638
Energy: 1.5173405743792907
Energy: 1.5340844644660536
Energy: 1.487873575772585
Energy: 1.6412837109297596
Energy: 1.6619003115984197
Energy: 1.645335831915621
Energy: 1.6677736377314107
Energy: 1.6908726101609954
Energy: 1.5141095020857738
Energy: 1.724334947320018
Energy: 1.7998958065010968
Energy: 1.5239542639632364
Energy: 1.5103369996541505
Energy: 1.5275847304764811
Energy: 1.7001268298896264
Energy: 1.7710757756926314
Energy: 1.3128128979894194
Energy: 1.8490853217444352
Energy: 1.5462589519519092
Energy: 1.5290161563968585
Energy: 1.5352875487379467
Energy: 1.6572235023191049
Energy: 1.6970789908590684
Energy: 1.7201885580948395
Energy: 1.7989549290651257

minimum gb energy = 1.311860444901081 eV
minimum distance =  2.19791266094589 Angstroms
sigma value = 113


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

Energy: 1.6338824025008065
Energy: 1.8908467486017078
Energy: 1.7783535973150935
Energy: 1.7663180521752058
Energy: 1.743525609403069
Energy: 1.7733231165228849
Energy: 1.8908156662621556
Energy: 1.7894403247757362
Energy: 1.8890828775215216
Energy: 1.7595700265388776
Energy: 1.8671421793889704
Energy: 1.7858444096060937
Energy: 1.7408818928557166
Energy: 1.971996515745075
Energy: 1.815896183429756
Energy: 1.839679879769056
Energy: 1.7485230989560645
Energy: 1.7764572715044957
Energy: 1.7598019240174045
Energy: 1.7669453134124746
Energy: 1.8578075609056182
Energy: 1.7013779328224696
Energy: 1.9230077099682743
Energy: 1.690737619715985
Energy: 1.777603253211237
Energy: 1.7827373367357757
Energy: 1.7176955103810614
Energy: 1.92374940628823
Energy: 1.624722359208916
Energy: 1.7826934829858738
Energy: 1.629204121002666
Energy: 1.7885580774308905
Energy: 1.7268496511553
Energy: 1.6369837318698146
Energy: 1.6839984943255555
Energy: 1.540278637572575
Energy: 1.7714103635484182
Energy: 1.749547628416697
Energy: 1.697487589431985
Energy: 1.580000385951263
Energy: 1.581457022786396
Energy: 1.7194097983025558
Energy: 1.7083626052114083
Energy: 1.8107200406024797
Energy: 1.5976369999980928
Energy: 1.7019517863310158
Energy: 1.6626716079761938
Energy: 1.6299166306927826
Energy: 1.7721447810764397
Energy: 1.7746155665094625
Energy: 1.4963388191336755
Energy: 1.7506679507118066
Energy: 1.7677333579392123
Energy: 1.7530413602280204
Energy: 1.7136285864879737
Energy: 1.5635043561018538
Energy: 1.5742293391965414
Energy: 1.681416915997622
Energy: 1.6912214950226334
Energy: 1.7782239134302176
Energy: 1.7186059936171278
Energy: 1.7321560842912795
Energy: 1.8348573093635323
Energy: 1.6528740962937634
Energy: 1.7076274683673704
Energy: 1.7415888800324393
Energy: 1.718117286544157
Energy: 1.5522044015961791
Energy: 1.7097079502145058
Energy: 1.5852597840101406
Energy: 1.6287823589781594
Energy: 1.5703792886512786
Energy: 1.659285165502325
Energy: 1.6333459066668616
Energy: 1.6782476031723055
Energy: 1.6121198127689715
Energy: 1.6293206662960538
Energy: 1.6818915903847065
Energy: 1.7890268284617241
Energy: 1.7505297700430331
Energy: 1.7490772734696625
Energy: 1.636200253573178
Energy: 1.645149572933423
Energy: 1.761047444281658
Energy: 1.7100350009541843
Energy: 1.4771300486544119
Energy: 1.7131024634627179
Energy: 1.6801504822163633
Energy: 1.7543162547569682
Energy: 1.6438624906213837
Energy: 1.544957535819648
Energy: 1.6653910287545006
Energy: 1.6823651640209383
Energy: 1.785403618363019
Energy: 1.6816353954900702
Energy: 1.5521374675317212
Energy: 1.753812635024426
Energy: 1.6893720148135096
Energy: 1.5567668575522027
Energy: 1.744394521794611
Energy: 1.6671178731462934
Energy: 1.6680618497809092
Energy: 1.8088262125688221
Energy: 1.8206532833290747
Energy: 1.6295996676492486
Energy: 1.6265485428765258
Energy: 1.677619445674438
Energy: 1.7085372685935294
Energy: 1.7547490354791664
Energy: 1.7674517232354905
Energy: 1.7322691616618877
Energy: 1.7754048818289856
Energy: 1.6530626196653748
Energy: 1.9245698682518466
Energy: 1.8001477528907393
Energy: 1.7236593159175022
Energy: 1.6996172434632153
Energy: 1.6819632436801752
Energy: 1.835060861108319
Energy: 1.6185750334860123
Energy: 1.8018545083274762
Energy: 1.7044057427999495
Energy: 1.6945193181783573
Energy: 1.675903558995733
Energy: 1.7062584757609074
Energy: 1.710663838729978
Energy: 1.6460728278229577
Energy: 1.8126262192973956
Energy: 1.745523591066531
Energy: 1.8321813506439204
Energy: 1.917049139155124
Energy: 1.6858571079648375
Energy: 1.8507566953640786
Energy: 1.67249856783829
Energy: 1.858079069185361
Energy: 1.6870809723058904
Energy: 1.8127447300104635
Energy: 1.7640189840236076
Energy: 1.7681640051977554
Energy: 1.9428609457146786
Energy: 1.80920539019126
Energy: 1.754651432836279
Energy: 1.7863110667659037
Energy: 1.821694888736782
Energy: 1.8189258992318593
Energy: 1.6537336062971468
Energy: 1.7802880441614852
Energy: 1.7418279054749473
Energy: 1.7499269150650758
Energy: 1.6843547170407633
Energy: 1.8998745521066158
Energy: 1.734203581738154
Energy: 1.7039657084660287
Energy: 1.852609950835567
Energy: 1.647982518523299
Energy: 1.7411968279867476
Energy: 1.7649971879845923
Energy: 1.765250907564953
Energy: 1.7461536367144648
Energy: 1.805699454582534
Energy: 1.89057834218049
Energy: 1.8259392444658988
Energy: 1.8710180779090304
Energy: 1.7945131405963213
Energy: 1.832674718476485
Energy: 1.8167571682414903
Energy: 1.73929749816773
Energy: 1.9738439465513824
Energy: 1.686308328353575
Energy: 1.8437278772042087
Energy: 1.7334803922524633
Energy: 1.7806090265601584
Energy: 1.6650806851522084
Energy: 1.7635130329176951
Energy: 1.8586516776665252
Energy: 1.7014336002078552
Energy: 1.8265496287482323
Energy: 1.6969101181461015
Energy: 1.7797109711246204
Energy: 1.7678029604511625
Energy: 1.7415958686302953
Energy: 1.925466625461948
Energy: 1.6934387455900268
Energy: 1.7839170392676915
Energy: 1.6188965128701056
Energy: 1.784836479001619
Energy: 1.7757219617377118
Energy: 1.729166691565185
Energy: 1.6855946165721705
Energy: 1.544472793603096
Energy: 1.7734999202394923
Energy: 1.7658685836066268
Energy: 1.7866460708774523
Energy: 1.7313596319409534
Energy: 1.7489243633128173
Energy: 1.719056524042449
Energy: 1.742052083294484
Energy: 1.6579523615458736
Energy: 1.5882290376858643
Energy: 1.6872225582847817
Energy: 1.6627526051013661
Energy: 1.5893381471256267
Energy: 1.7779715595997114
Energy: 1.7746937674184096
Energy: 1.4981627473509176
Energy: 1.6813604843688024
Energy: 1.766384126366807
Energy: 1.7493552159161538
Energy: 1.6714615378111048
Energy: 1.5686186600091239
Energy: 1.5749105233744103
Energy: 1.612769023633627
Energy: 1.7462260410624986
Energy: 1.7899890707390365
Energy: 1.7107916590976442
Energy: 1.7304742708987302
Energy: 1.6982665743871475
Energy: 1.664528557801948
Energy: 1.7198942593107713
Energy: 1.6915847656270706
Energy: 1.663414085919302
Energy: 1.6529997727278924
Energy: 1.663659893723848
Energy: 1.587034748383635
Energy: 1.6276292090869238
Energy: 1.5736762291180442
Energy: 1.7051677716334037
Energy: 1.6316247837875433
Energy: 1.6187949315014956
Energy: 1.6129707119548764
Energy: 1.7532322074604678
Energy: 1.6418720763470787
Energy: 1.7823631365272476
Energy: 1.736170275104437
Energy: 1.7486875484613793
Energy: 1.6552299585581194
Energy: 1.659195996407766
Energy: 1.737485335946597
Energy: 1.7100159343234351
Energy: 1.4754391711618824
Energy: 1.7135838201182627
Energy: 1.6876724240488863
Energy: 1.7406279715363704
Energy: 1.7355173907372596
Energy: 1.5460821871024
Energy: 1.6855318802552113
Energy: 1.6860328391584458
Energy: 1.709955894026483
Energy: 1.6949259442980849
Energy: 1.616060083568566
Energy: 1.6499240261802584
Energy: 1.6966593207381202
Energy: 1.5542732337595158
Energy: 1.744069760153506
Energy: 1.664691099695737
Energy: 1.682557794249533
Energy: 1.4601431382959573
Energy: 1.6572854127688526
Energy: 1.6345856068460582
Energy: 1.62499908574543
Energy: 1.674600396717763
Energy: 1.5559803164077355
Energy: 1.6640607580338067
Energy: 1.7071594206550718
Energy: 1.6480785950142514
Energy: 1.7750863617357202
Energy: 1.698508205589179
Energy: 1.9259137485296238
Energy: 1.6216402483016734
Energy: 1.7272690856707797
Energy: 1.6986251026999413
Energy: 1.6329224177495223
Energy: 1.8352351416816584
Energy: 1.6649992760669439
Energy: 1.7967980054090482
Energy: 1.709771751922025
Energy: 1.6907960513577065
Energy: 1.760379558956941
Energy: 1.6818428170190978
Energy: 1.7087893605513607
Energy: 1.762431516366124
Energy: 1.812733371475158
Energy: 1.6760329222076502
Energy: 1.832970803832651
Energy: 1.8952842376865613
Energy: 1.8120776561240257
Energy: 1.841313814668645
Energy: 1.6839971521237385
Energy: 1.8492866549269695
Energy: 1.6951173567888904
Energy: 1.8100957922258347
Energy: 1.7554594697954138
Energy: 1.7799226102342864
Energy: 1.940620691577224
Energy: 1.8431689615886386
Energy: 1.764391025439192
Energy: 1.7907002325228343
Energy: 1.9015455582611462
Energy: 1.7182973773457486
Energy: 1.6553399974102545
Energy: 1.7869337265922616
Energy: 1.8064237409003114
Energy: 1.7491953936235785
Energy: 1.7349841715786127
Energy: 1.8220604201438806
Energy: 1.7315802537525165
Energy: 1.6939557451031682
Energy: 1.8494164562078692
Energy: 1.647679554018925
Energy: 1.805665609018333
Energy: 1.7664108895997832
Energy: 1.7632469685361045
Energy: 1.7566158860079117
Energy: 1.709499555083093
Energy: 1.891059898678168

minimum gb energy = 1.4601431382959573 eV
minimum distance =  2.15834372538939 Angstroms
sigma value = 365


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

Energy: 1.5787461619916017
Energy: 1.5357970665728518
Energy: 1.5505810593827718
Energy: 1.5399923782091132
Energy: 1.5354560092391525
Energy: 1.5499105508330435
Energy: 1.5358264149272922
Energy: 1.4043009713439543
Energy: 1.7304608102777381
Energy: 1.5488264021919471
Energy: 1.5512038127657803
Energy: 1.5525033354031703
Energy: 1.548900563466905
Energy: 1.9131369983138962
Energy: 1.5503527999070166
Energy: 1.7338606175237556
Energy: 1.55372916732625
Energy: 1.550939587246725
Energy: 1.5496973540345234
Energy: 1.552533088831951
Energy: 1.5367679826832583
Energy: 1.550342371405327
Energy: 1.73165121760324
Energy: 1.552831583586951
Energy: 1.55102883306958
Energy: 1.5520716470642746
Energy: 1.553764752947051
Energy: 1.5401468614309852
Energy: 1.403910981029515
Energy: 1.7311321379441669
Energy: 1.3734738328697615
Energy: 1.9134651296139005
Energy: 1.568284044455906
Energy: 1.3735292641453956
Energy: 1.7314486654851835
Energy: 1.5806325249946656
Energy: 1.7324353105325732
Energy: 1.549912149629059
Energy: 1.5378683824996178
Energy: 1.5615848883660843
Energy: 1.5499571981656504
Energy: 1.5364880714781535
Energy: 1.5505193006622244
Energy: 1.7299825393928245
Energy: 1.548670303128126
Energy: 1.55065450751004
Energy: 1.550273213446687
Energy: 1.5528071054276886
Energy: 1.7310315029543215
Energy: 1.550091203427808
Energy: 1.7304080786848766
Energy: 1.5530415741200563
Energy: 1.5498478515347718
Energy: 1.5498158077223163
Energy: 1.5521238859106241
Energy: 1.7311407780461785
Energy: 1.5509060751083599
Energy: 1.7322340452839575
Energy: 1.550589940233898
Energy: 1.537045485632652
Energy: 1.5520888153645316
Energy: 1.5501067716704804
Energy: 1.537842426760238
Energy: 1.4040073029865126
Energy: 1.7323086189491317
Energy: 1.3734356310897016
Energy: 1.9130713545691023
Energy: 1.9131315022822617
Energy: 1.3733042338113925
Energy: 1.7299750847502795
Energy: 1.550186863899515
Energy: 1.7311034677227937
Energy: 1.5499891575524032
Energy: 1.55066492018703
Energy: 1.5508146269104264
Energy: 1.55201915518892
Energy: 1.5380699086199279
Energy: 1.5499433664638442
Energy: 1.7401888832987678
Energy: 1.5530637029569425
Energy: 1.5504314564303165
Energy: 1.5496885355062948
Energy: 1.55231149348076
Energy: 1.7303983923140782
Energy: 1.5504697246248054
Energy: 1.7302650596583258
Energy: 1.548891215516258
Energy: 1.5511528617276216
Energy: 1.5507202004040306
Energy: 1.5506329400777612
Energy: 1.913381554073614
Energy: 1.5802319286834192
Energy: 1.7322084977145713
Energy: 1.5502112442171907
Energy: 1.538025700125786
Energy: 1.536242600891985
Energy: 1.5495058100815526
Energy: 1.5361136079255897
Energy: 1.4041626109567564
Energy: 1.730460514956285
Energy: 1.373589853348476
Energy: 1.5694423102956645
Energy: 1.5499451742552235
Energy: 1.5488660942919035
Energy: 1.7310823315782335
Energy: 1.5499404462214958
Energy: 1.7312816094626298
Energy: 1.5493459017976685
Energy: 1.5514167953726756
Energy: 1.5505010959070247
Energy: 1.5527128079197063
Energy: 1.5372405821572606
Energy: 1.5500079238028173
Energy: 1.7346704408523783
Energy: 1.5523155013044616
Energy: 1.5519622023223085
Energy: 1.5501824279430916
Energy: 1.5529460343312707
Energy: 1.5361971829017051
Energy: 1.403962437232599
Energy: 1.7302893483798367
Energy: 1.5490970551673198
Energy: 1.5502185912918993
Energy: 1.5516496984959944
Energy: 1.5485659154647222
Energy: 1.73125926510559
Energy: 1.5794941471912374
Energy: 1.7316778330760545
Energy: 1.5503980364301981
Energy: 1.5401807651509796
Energy: 1.5358365745326226
Energy: 1.5496655744528571
Energy: 1.5359899762532763
Energy: 1.5505897237986066
Energy: 1.7305029475240057
Energy: 1.548667688582926
Energy: 1.5515031797129213
Energy: 1.5513542551280308
Energy: 1.550569282379287
Energy: 1.9136255102697008

minimum gb energy = 1.3733042338113925 eV
minimum distance =  2.19916027490389 Angstroms
sigma value = 23