Model name: model_name=Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Ni__MO_758825945924_004
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=3.52732940018177
cohesive_energy=4.194297203762934
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=[1.9900956406240796e-19, 2.7580509448329597e-19, 3.34467189760572e-19, 3.8233862540785794e-19, 4.2264778734266397e-19, 4.57299663582816e-19, 4.877330087456459e-19, 5.144044431718439e-19, 5.3788273956648e-19, 5.58610098680538e-19, 5.76916568900622e-19, 5.93048885428368e-19, 6.07218535579464e-19, 6.19606565313552e-19, 6.30483742481778e-19, 6.3988531497009e-19, 6.47894595963456e-19, 6.54604511706648e-19, 6.600983753846339e-19, 6.64457898005748e-19, 6.67806447170808e-19, 6.70137614173278e-19, 6.715026686654459e-19, 6.71948073769698e-19, 6.71467420779498e-19, 6.699133094445179e-19, 6.6713833951443e-19, 6.62889367081062e-19, 6.56865182937222e-19, 6.487277278131359e-19, 6.38070048843768e-19, 6.24449945278134e-19, 6.07255385642046e-19, 5.85706109914746e-19, 5.58874457825148e-19, 5.25860006104944e-19, 4.850926216528139e-19, 4.34644885978056e-19, 3.7214878201561796e-19, 2.9451050668524597e-19, 1.9781754464671198e-19, 7.67005213464918e-20, -7.62922867401486e-20, -2.71322204261364e-19, -5.22400906752138e-19, -8.503568506721339e-19, -1.285544874529116e-18, -1.87523559773262e-18, -2.69457270659388e-18, -3.87000959412798e-18, -5.6260432502909996e-18, -8.3936431678626e-18, -1.3095887392755539e-17, -2.2005735850326596e-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: 0.020808005788622838
Energy: 1.2237049026985731
Energy: 0.6442405895331561
Energy: 1.6957539505467203
Energy: 1.6870801228882122
Energy: 0.5912008333406428
Energy: 0.021323451455650153
Energy: 0.1336804195050607
Energy: 1.215885973672128
Energy: 0.13426898685121555
Energy: 0.3266940999020725
Energy: 1.2062532957866015
Energy: 0.023687789800816962
Energy: 0.13673422260788728
Energy: 0.021494581821250497
Energy: 1.2161574883305175
Energy: 0.328470297220455
Energy: 0.32579230626503747
Energy: 1.2085005005293008
Energy: 0.13392613588780358
Energy: 0.13640051016198132
Energy: 0.024863403946370734
Energy: 1.2236633220432531
Energy: 0.3262002829902238
Energy: 1.20870738142962
Energy: 1.2163763395129579
Energy: 0.13459557922060753
Energy: 0.022726728256221025
Energy: 0.13465389624275134
Energy: 1.2154114435466432
Energy: 0.13470819071663886
Energy: 0.3276702558574372
Energy: 1.206752342206869
Energy: 0.02257505496915351
Energy: 0.1372960161925061
Energy: 0.021308387396541267
Energy: 1.2130842382164337
Energy: 0.3259982930851748
Energy: 0.3256864742876291
Energy: 1.2114975144744824
Energy: 0.13372866763216057
Energy: 0.13649768788733152

minimum gb energy = 0.020808005788622838 eV
minimum distance =  2.46927882318202 Angstroms
sigma value = 5


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

Energy: 1.975541190814223
Energy: 1.923933021623947
Energy: 2.1225496919862197
Energy: 1.9857450782782315
Energy: 2.034583976220943
Energy: 2.087137357395897
Energy: 1.9915766667686992
Energy: 1.9206977181323033
Energy: 2.0852247003206816
Energy: 1.9682683055892594
Energy: 2.1676498461506797
Energy: 2.001935749311627
Energy: 1.9848108013047006
Energy: 2.084677457400227
Energy: 1.9441342769846672
Energy: 2.079340172946297
Energy: 2.0419408571665745
Energy: 2.007177429296635
Energy: 2.0259980975770704
Energy: 2.0823671386447438
Energy: 2.030932890318158
Energy: 1.946124032381599
Energy: 2.152160729972131
Energy: 1.9662715297914286
Energy: 2.0186015582700563
Energy: 1.9748026408013466
Energy: 1.9485527134505047
Energy: 2.0482977779741116
Energy: 1.9550811298043276
Energy: 1.989992355491061
Energy: 1.972339087237645
Energy: 1.9911796539464508
Energy: 2.0915496279834294
Energy: 1.9826658771050494
Energy: 2.016600774069944
Energy: 2.063653460387879
Energy: 2.0757216869639676
Energy: 1.9483798445050384
Energy: 2.0507009026484764
Energy: 2.0248458374773723
Energy: 2.1229223198500224
Energy: 2.1926919473419746
Energy: 1.9613709407387525
Energy: 2.0659444452434657
Energy: 1.9857182346985631
Energy: 1.9410826308889595
Energy: 1.957140706277798
Energy: 2.0647296145160423
Energy: 2.0254632612694197
Energy: 2.0302815595208776
Energy: 1.9911473472402839
Energy: 2.0579161939803257
Energy: 2.0822829217392784
Energy: 2.0209230734615633
Energy: 2.0382683997371136
Energy: 2.0932053481648256
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Energy: 2.0404067377743704
Energy: 1.9650630418060342
Energy: 1.96595121353744
Energy: 2.219997576629749
Energy: 2.004996418418596
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Energy: 2.006659525607029
Energy: 2.1356959250657126
Energy: 2.067799934006684
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Energy: 2.0028835159078606
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Energy: 2.1997738010604713
Energy: 1.957171357613516
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Energy: 1.9580319089624123
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Energy: 1.9789826285067726
Energy: 2.093223848925165
Energy: 2.1291168271221066
Energy: 1.985950412039119
Energy: 2.0238597744923252
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Energy: 2.1289407456383347
Energy: 2.045464968929604
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Energy: 2.008936405987654
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Energy: 2.0033924333469972
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Energy: 1.9242769051251638
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Energy: 1.9591095597538595
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Energy: 2.030789012338661
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Energy: 2.0797440863513916
Energy: 2.0277776935646963
Energy: 1.9200062885213216
Energy: 2.0774393109986447
Energy: 1.9430921023601055
Energy: 2.16262007430988
Energy: 2.0290823607030397
Energy: 1.9466846463167196
Energy: 2.054118179357922
Energy: 1.9557676952540728
Energy: 2.082962985348114
Energy: 2.0709822792382555
Energy: 2.0468603015418703
Energy: 2.044396062041417
Energy: 2.1226909969486467
Energy: 2.0782280565530575
Energy: 1.9405147426686022
Energy: 2.070833244399601
Energy: 1.9753444218364524
Energy: 2.0441173024733175
Energy: 1.9942617254655155
Energy: 2.001384336086382
Energy: 2.022990984763988
Energy: 2.0411538076614844
Energy: 2.0585429633970938
Energy: 1.9731384276312147
Energy: 1.989661511229096
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Energy: 1.979313338743284
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Energy: 2.073151521094659
Energy: 1.9735959621313643
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Energy: 1.9517185976961124
Energy: 1.9809373723739914
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Energy: 1.9501819408178118
Energy: 2.0108807992678766
Energy: 1.9998036636183696
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Energy: 2.057559949682916
Energy: 2.027241434130824
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Energy: 2.075170199922274
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Energy: 2.043466708625433
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Energy: 2.12031586923384
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Energy: 1.9941716284834772
Energy: 1.9284405764342873
Energy: 1.983938523037841
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Energy: 1.9595778283625511
Energy: 2.087585140144228
Energy: 2.0903981954357755
Energy: 2.0206275007744816
Energy: 2.1135992690774885
Energy: 1.9835896081101365
Energy: 2.0426157691417246
Energy: 2.0101396145509716
Energy: 1.975574611591298
Energy: 2.056246152551657
Energy: 1.9944272027875984
Energy: 1.9753154780632363
Energy: 2.060845244616687
Energy: 1.9245664249753736
Energy: 2.0604169021183507
Energy: 1.9850793773149509
Energy: 2.062351326400425
Energy: 2.0421356713980723
Energy: 1.965584889145938
Energy: 1.9357586121689574
Energy: 1.9910925804066397
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Energy: 2.0518162555704773
Energy: 1.9895625110377861
Energy: 2.0256955158704897
Energy: 2.1087910009905655
Energy: 1.9662295400021077
Energy: 2.0124492281558193
Energy: 1.921621891628892
Energy: 2.0663702072771284
Energy: 2.0681418294614904
Energy: 1.9634844739927724
Energy: 1.9709370319080903
Energy: 1.9713976196217837
Energy: 1.9488512196104149
Energy: 2.031067197129565
Energy: 2.03800923412594
Energy: 2.0869641454817054
Energy: 2.0364281248864198
Energy: 1.936700071553492
Energy: 1.95811709780473
Energy: 2.1436476494719883
Energy: 1.9261567614907549
Energy: 2.0668496604394964
Energy: 1.961020050429887
Energy: 1.9445085123447248
Energy: 2.0203811765479243
Energy: 1.9158692717189783
Energy: 2.070778321665457
Energy: 2.0150173824930038
Energy: 2.1102728970627576
Energy: 2.236205120513959
Energy: 1.9519184929070115
Energy: 2.0411101448695255
Energy: 2.004376984426464
Energy: 1.9822386560473026
Energy: 1.9796018268586282
Energy: 1.9887722044004141
Energy: 2.02135728779066
Energy: 1.9176256055800769
Energy: 2.0373457953163117
Energy: 1.9715405274256843
Energy: 1.9942940635024986
Energy: 1.9275916887591729
Energy: 1.9821526280151684
Energy: 2.1888589889144594
Energy: 2.089458996976592
Energy: 2.0301430785038876

minimum gb energy = 1.9114459574239437 eV
minimum distance =  2.2138895485271 Angstroms
sigma value = 401


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

Energy: 2.2207709429804394
Energy: 1.9929476265162356
Energy: 2.0167134072030737
Energy: 2.0309201221039377
Energy: 2.1912602189687536
Energy: 2.0552061203205443
Energy: 2.000290078586309
Energy: 1.986665838183095
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Energy: 2.1370214398182066
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Energy: 2.0134767316319833
Energy: 2.041184004982746
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Energy: 2.0137195433526895
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Energy: 1.9681602588899785
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Energy: 1.9674102119880716
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Energy: 1.9285198794207408
Energy: 2.1083096514552127
Energy: 2.0991417039783076
Energy: 2.0745466678471334
Energy: 2.0247892485365946
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Energy: 1.9663808660291793
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Energy: 2.0119621087386435
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Energy: 1.91065473120437
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Energy: 2.02609542374052
Energy: 2.013844053416411
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Energy: 2.0158609713337627
Energy: 2.0164531190124673
Energy: 2.001171886154682
Energy: 2.024711040122107
Energy: 2.0042382342669085
Energy: 2.0133034477082505
Energy: 1.9539930870133586
Energy: 2.045798520753273
Energy: 2.0340451653954967
Energy: 2.0090367737396306
Energy: 2.0912600365143073
Energy: 1.9926010000190415
Energy: 1.9972638689661948
Energy: 2.014291414325565
Energy: 2.0411690178882327
Energy: 2.0305560119301553
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Energy: 1.9851633488422127
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Energy: 2.0703289455066383
Energy: 1.963638000889873
Energy: 2.0711000961823425
Energy: 2.0159979646655732
Energy: 1.9624073415404801
Energy: 1.918341288538725
Energy: 2.038017196838039
Energy: 2.2806525058961755
Energy: 2.1740472389463052
Energy: 2.048110469000083
Energy: 2.0107558126677256
Energy: 1.9526640535128292
Energy: 1.9175003172644955
Energy: 2.0195510610554592
Energy: 2.0540093464592135
Energy: 2.050366413684335
Energy: 2.1455673296424327
Energy: 2.019853152862471
Energy: 1.964341421389449
Energy: 1.9242779990755883
Energy: 2.018866200139145
Energy: 2.074765471028016
Energy: 2.1582008477401877
Energy: 2.1683492933020654
Energy: 2.0228078536690046
Energy: 1.9694165815661069
Energy: 1.9177801332426077
Energy: 2.1275242580420834
Energy: 2.0817433228818443
Energy: 1.9742989867030643
Energy: 2.0370293202096112
Energy: 2.095015496860566
Energy: 2.050961411117259
Energy: 1.9828103094791152
Energy: 2.078423215617963
Energy: 2.05213090774921
Energy: 2.0149436432993095
Energy: 2.045906041251504
Energy: 2.037680880706223
Energy: 2.0101717857386103
Energy: 2.024381004776601
Energy: 1.983761033013338
Energy: 1.9716406107280882
Energy: 1.9652173843234408
Energy: 2.0054104265117316
Energy: 2.0973538846533257
Energy: 2.0603284953407295
Energy: 2.0500988022300817
Energy: 2.0472948666814803
Energy: 2.03321258671678
Energy: 1.9643272378230623
Energy: 2.028534199138183
Energy: 2.087675282234606
Energy: 1.9825451434490724
Energy: 2.0127231556585556
Energy: 2.014466503099175
Energy: 2.0335169958284682
Energy: 1.9907060751967314
Energy: 2.051111248243385
Energy: 2.0185413327899457
Energy: 2.036314900359052
Energy: 2.0979329288978286
Energy: 2.019822097991398
Energy: 2.0849627178555554
Energy: 2.0150889320950425
Energy: 2.0368540118438214
Energy: 1.9817485864990563
Energy: 2.015183030559815
Energy: 1.980675826722489
Energy: 1.9887417667438332
Energy: 2.1154220487917583
Energy: 1.9518381721756977
Energy: 2.0187143803960885
Energy: 1.9974901116879666
Energy: 2.020969350761442
Energy: 1.9663239848974667
Energy: 2.024412726394994
Energy: 2.372565745164536
Energy: 2.1025544978574664
Energy: 2.064840298637278
Energy: 2.025433563141851
Energy: 2.023002114709476
Energy: 1.9235878066336514
Energy: 2.115518714475236
Energy: 2.065437421372543
Energy: 1.9282765756605509
Energy: 2.155315421114162
Energy: 2.001547559817772
Energy: 2.017070294775375
Energy: 1.9193664414500344
Energy: 2.0126535506480234
Energy: 2.0991353825981416
Energy: 2.0295367103860373
Energy: 2.0848294681087296
Energy: 1.9821982944661758
Energy: 2.0188373451344486
Energy: 1.9205031812838473
Energy: 2.1020153033880056
Energy: 2.131059191459893
Energy: 1.9739567553469153
Energy: 2.0263408404636087
Energy: 2.0724120542890936
Energy: 1.9760248363999602
Energy: 2.0034980202146015
Energy: 2.080995633642624
Energy: 2.092006797246373
Energy: 1.9973074207179098
Energy: 2.010347207530555
Energy: 2.0348105178460325
Energy: 1.9608827090093388
Energy: 2.0306097825148623
Energy: 2.002874287031688
Energy: 2.0634463720040266
Energy: 1.9801551225823715
Energy: 1.984952995121791
Energy: 2.009134690854222
Energy: 2.1358507305710464
Energy: 1.9294080675624383
Energy: 1.9787818607728114
Energy: 2.040164799750232

minimum gb energy = 1.91065473120437 eV
minimum distance =  2.21764430757648 Angstroms
sigma value = 311


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

Energy: 2.0369526544667576
Energy: 2.1076190514738227
Energy: 2.0744978116240325
Energy: 2.064299615727873
Energy: 2.055048027280002
Energy: 2.1134962101047727
Energy: 2.0477490963801324
Energy: 2.0549506430017455
Energy: 2.0429775315967946
Energy: 2.140060466770859
Energy: 2.0199266447783293
Energy: 2.1023689064696445
Energy: 2.0210787111439297
Energy: 2.0544869637833307
Energy: 2.0738110883708982
Energy: 2.142920796543979
Energy: 2.052913086727359
Energy: 2.018670648641537
Energy: 2.076850517750586
Energy: 2.0754039549472947
Energy: 2.0656497581199176
Energy: 2.0528528565184416
Energy: 2.0462379646406172
Energy: 2.039005245503351
Energy: 2.19797735296896
Energy: 2.0641223474880057
Energy: 2.0901115766844915
Energy: 2.171548669224268
Energy: 2.0444938719784087
Energy: 2.1013535873254323
Energy: 2.0556810218735384
Energy: 2.0291503496520136
Energy: 2.011507565328548
Energy: 2.0139444784000644
Energy: 2.0360420482214505
Energy: 2.0522132973136356
Energy: 2.0630998008740784
Energy: 2.019839373482442
Energy: 1.9640161573996047
Energy: 2.0667865329654513
Energy: 2.083610935984004
Energy: 2.066948753854532
Energy: 2.0707358317420934
Energy: 2.0819467091054014
Energy: 2.0935820319090768
Energy: 2.030334696137654
Energy: 1.9945200502088052
Energy: 2.128684544699916
Energy: 2.11050844859858
Energy: 2.065549755589064
Energy: 2.072585487417154
Energy: 2.070150169551832
Energy: 2.031101083729638
Energy: 2.1243093039935945
Energy: 2.0685583726658616
Energy: 2.203606557738978
Energy: 2.1293744251422595
Energy: 2.1572928505571873
Energy: 2.029425267675285
Energy: 2.0705000256673527
Energy: 2.0192692117858115
Energy: 2.054884237287172
Energy: 2.1675514243429896
Energy: 2.05508364452469
Energy: 2.1885378112118334
Energy: 2.0345906561078855
Energy: 2.0876861949820085
Energy: 2.0401824377888134
Energy: 2.0957673695115244
Energy: 2.042969130393986
Energy: 2.0653363518049095
Energy: 2.086926168839719
Energy: 2.083211320142079
Energy: 1.9894859684909794
Energy: 2.0535015709774758
Energy: 2.085285496959884
Energy: 2.1000706386749717
Energy: 2.077291409424045
Energy: 2.1277598351446088
Energy: 2.0270877540631624
Energy: 1.9790865441676018
Energy: 1.9878085666731293
Energy: 1.99400703279849
Energy: 2.030068781100003
Energy: 2.0892103334233862
Energy: 2.1604921716430074
Energy: 2.1346451661487946
Energy: 2.049458390688365
Energy: 2.0358002859256015
Energy: 2.10926910847705
Energy: 2.122995227082167
Energy: 2.0819939080216843
Energy: 2.0855778320835987
Energy: 2.0624168040302835
Energy: 1.9865570726134854
Energy: 2.2487891130644933
Energy: 2.0471815355628737
Energy: 2.149471498302832
Energy: 2.0761160241207297
Energy: 2.1169968114763287
Energy: 2.096825370271153
Energy: 2.086670438650063
Energy: 2.0412072938159675
Energy: 2.0671285757616595
Energy: 2.079373530347173
Energy: 2.1066216658866996
Energy: 2.180178271751098
Energy: 2.0457687938762357
Energy: 2.0514869751317684
Energy: 2.0543849843066693
Energy: 2.0718759953183383
Energy: 2.0512264851822404
Energy: 2.035312367178574
Energy: 2.102786742956699
Energy: 2.0462678072057847
Energy: 2.0729800705520702
Energy: 2.0610824076983243
Energy: 1.9900733643695419
Energy: 2.0652730256037675
Energy: 1.9956175334050705
Energy: 2.049699440652025
Energy: 2.053450231886333
Energy: 2.0693620361300975
Energy: 2.0395758064789598
Energy: 1.989952018062281
Energy: 2.0067240433774156
Energy: 2.1147565909677097
Energy: 2.1226527709847076
Energy: 2.000201893095308
Energy: 2.165080114730897
Energy: 2.081609425854617
Energy: 2.0561797403319377
Energy: 2.0651299042163234
Energy: 2.070227607749587
Energy: 2.08223150796723
Energy: 2.062747729887382
Energy: 2.1115993718894015
Energy: 2.2400695085471583
Energy: 2.050413762019465
Energy: 2.1425629299640176
Energy: 2.106430040468641
Energy: 2.1320090532387193
Energy: 2.020277932817463
Energy: 2.063894391428519
Energy: 2.081318366884512
Energy: 2.0393268295389713
Energy: 2.0967324773168783
Energy: 2.117283055272587
Energy: 1.9766624561799124
Energy: 2.0837254705036394
Energy: 2.05571903393085
Energy: 2.0363983748636842
Energy: 2.00769364281943
Energy: 2.0345905098679746
Energy: 2.0831008177906933
Energy: 2.1177242710749393
Energy: 2.0695415657836422
Energy: 2.0929089198010202
Energy: 2.060083350342129
Energy: 2.016498828180269
Energy: 2.047656312296046
Energy: 2.0771875498459886
Energy: 1.9941714343372405
Energy: 2.0454937194404934
Energy: 2.028947368296963
Energy: 2.0670515707827946
Energy: 1.9784230513147125
Energy: 2.0443312416250805
Energy: 2.03526784317031
Energy: 2.096635344149789
Energy: 1.9950453747043881
Energy: 2.0957509411112203
Energy: 1.9892338982399562
Energy: 2.0595412257413774
Energy: 2.039541497761686
Energy: 2.0543802628269145
Energy: 1.9955756600295629
Energy: 2.0220744601232434
Energy: 2.0483744667874566
Energy: 2.195626313595042
Energy: 2.091616913120299
Energy: 2.17147995920742
Energy: 2.08404801742115
Energy: 2.018990048079163
Energy: 2.020295168242374
Energy: 2.1144453726567347
Energy: 2.0895823420786366
Energy: 2.0616135208831827
Energy: 2.098362943945486
Energy: 2.0478461475680647
Energy: 2.0042322693904278
Energy: 2.013155228160891
Energy: 2.055516358544911
Energy: 2.0804881605758108
Energy: 2.004265678055894
Energy: 2.047687604370971
Energy: 2.064960115333943
Energy: 2.0644257868418956
Energy: 2.01189554705745
Energy: 2.02652610627703
Energy: 2.0037698087848796
Energy: 2.0166039143695533
Energy: 1.9934010145982906
Energy: 2.0576398063449366
Energy: 2.043549853923591
Energy: 2.026984206139459
Energy: 2.0669005956056052
Energy: 1.9907507772945805
Energy: 2.059767877062527
Energy: 2.0629416571384853
Energy: 2.0599343715524023
Energy: 2.115247886243237
Energy: 2.0414143290764333
Energy: 2.0959680802026748
Energy: 2.071689896397615
Energy: 2.066654929675378
Energy: 2.086329605416824
Energy: 2.0190451533942886
Energy: 2.0379620390251234
Energy: 2.084307924539182
Energy: 2.105463149747772
Energy: 2.1801600988292815
Energy: 2.0828149569375216
Energy: 2.1930892088233573
Energy: 2.0784291262691155
Energy: 2.1059274927125564
Energy: 2.0455590764133746
Energy: 2.0971015625029454
Energy: 1.981346090661081
Energy: 2.0182751766225224
Energy: 2.059646907971883
Energy: 2.065610594003094
Energy: 2.062881122777189
Energy: 2.0195215504179456
Energy: 1.9928261837768562
Energy: 1.932960123955132
Energy: 2.080716427487935
Energy: 2.0164133132302346
Energy: 2.0673245312296764
Energy: 2.090602932756432
Energy: 2.021011296037233
Energy: 2.0260605860494665
Energy: 2.1155291583116536
Energy: 1.9964489025233494
Energy: 2.051075540395372
Energy: 2.1029687496807106
Energy: 2.0345779135984063
Energy: 2.0879850307498535
Energy: 2.0343203360243494
Energy: 2.0363629820475344
Energy: 2.112198335515552
Energy: 2.1235652369445623

minimum gb energy = 1.932960123955132 eV
minimum distance =  2.21254059634326 Angstroms
sigma value = 39


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

Energy: 1.9226520717690754
Energy: 2.123990454815386
Energy: 2.794232610758328
Energy: 2.372011762705136
Energy: 2.0072265726475718
Energy: 2.141164264272004
Energy: 1.8979877786108519
Energy: 2.0262596225726575
Energy: 2.0614093962093203
Energy: 1.945093107730526
Energy: 2.0419801537111306
Energy: 2.0589190924914345
Energy: 2.0206758209707973
Energy: 2.0189219506027767
Energy: 2.0191345449941607
Energy: 1.8528757049127327
Energy: 1.9450652780381505
Energy: 2.1950435671597344
Energy: 2.0491445146197687
Energy: 2.018706522799339
Energy: 2.0179313354642026
Energy: 2.019332834898826
Energy: 1.8531333741887526
Energy: 1.951700802443932
Energy: 1.850500860415653
Energy: 2.153453979595107
Energy: 1.94963693568608
Energy: 2.1177999031762114
Energy: 2.0582294354721475
Energy: 2.0546824186123476
Energy: 2.200756428538184
Energy: 1.94892841948971
Energy: 2.067727522949839
Energy: 1.9528419174877667
Energy: 2.018605475757669
Energy: 1.8966443553586516
Energy: 2.05308172662556
Energy: 1.9474333809901776
Energy: 1.8522703814357573
Energy: 2.042914870657751
Energy: 2.0178069575750373
Energy: 2.070795745716009
Energy: 2.021047474621209
Energy: 2.0048369045636525
Energy: 1.9456504419735108
Energy: 2.058169998304985
Energy: 1.8994261504657817
Energy: 1.8996286880467046
Energy: 2.017203798858774
Energy: 1.9004598049776782
Energy: 2.0524405875373133
Energy: 2.1588233334908398
Energy: 1.8535848789706146
Energy: 2.157426701601406
Energy: 1.94773643668323
Energy: 2.066605810387938
Energy: 1.8981465495044112
Energy: 2.054196527775587
Energy: 2.155175773178386
Energy: 1.850459721785882
Energy: 2.052511694252372
Energy: 1.9682357339892995
Energy: 2.0672140028072574
Energy: 2.0201080275412076
Energy: 1.995791850337195
Energy: 1.9474981604494832
Energy: 2.044006301649702
Energy: 2.0446119011036186
Energy: 2.0170111086819436
Energy: 2.0184633203833195
Energy: 2.0180932130083344
Energy: 1.9884697035085028
Energy: 1.957201349356478
Energy: 1.8525716311644873
Energy: 2.0625490615026676
Energy: 2.0249490302628637
Energy: 2.1203288875328323
Energy: 2.0634503254006034
Energy: 1.9107045829805194
Energy: 1.989597154994294
Energy: 1.8512589654952814
Energy: 2.0425481450164167
Energy: 1.954048856418463
Energy: 2.0254332210823276
Energy: 1.8990252669087702
Energy: 1.9128154624892657
Energy: 2.159526129575732
Energy: 1.961457741276953
Energy: 2.060967760515934
Energy: 1.8747794439026837
Energy: 2.018071984950227
Energy: 2.0193937762891574
Energy: 1.8521908060408974
Energy: 1.9454314476593726
Energy: 2.087691907070059
Energy: 1.8976746117424093
Energy: 1.8997134053612483
Energy: 2.0183117362576377
Energy: 1.8962428110943146
Energy: 1.9910175504359933
Energy: 1.9447109407720038
Energy: 2.062204041294806
Energy: 1.8976407786808678
Energy: 1.8970853263418244
Energy: 2.018505387547642
Energy: 1.8974065392484267
Energy: 2.1189666279791632
Energy: 2.0575463243210685
Energy: 1.954929904282249
Energy: 2.020974639757679
Energy: 2.14155107731198
Energy: 1.8976334664179968
Energy: 2.026346536262871
Energy: 2.0593793582257214
Energy: 1.9450477025081296
Energy: 2.041866047222883
Energy: 2.0543994359034117
Energy: 2.0202057938599243
Energy: 2.0187804354578693
Energy: 2.0197783119045725
Energy: 1.8559717382131125
Energy: 1.9454305940267285
Energy: 2.195625079878188
Energy: 2.0467037103265757
Energy: 2.0190441037177744
Energy: 2.111582595262603
Energy: 2.0193422480338765
Energy: 1.853163658994996
Energy: 1.9522988202792173
Energy: 1.8504004023640552
Energy: 2.157015243629772
Energy: 1.9499919766803078
Energy: 2.2352690100961476
Energy: 2.0589927650441417
Energy: 2.0543945179139556
Energy: 2.200955733419423
Energy: 1.9491737770733084
Energy: 2.169747177235219
Energy: 1.9476115535256164
Energy: 2.0186448227517584
Energy: 1.8963935002609822
Energy: 2.053332584135416
Energy: 1.9471468272198154
Energy: 1.8519450164429965
Energy: 2.042907915990598
Energy: 1.8973970998319576
Energy: 2.0708272134619476
Energy: 2.0207953775018406
Energy: 1.9946213287190822
Energy: 1.9458468589958113
Energy: 2.0572514096717964
Energy: 1.8995813022849004
Energy: 1.8996392057478217
Energy: 2.017269254983917
Energy: 1.8998962337556493
Energy: 2.053066026209466
Energy: 2.1587853005437307
Energy: 1.8527175733307168
Energy: 2.1568472887055377
Energy: 1.9465084975854803
Energy: 2.0689825401191797
Energy: 1.8969282306272903
Energy: 2.053575957277196
Energy: 2.154818745507977
Energy: 1.8503005988741095
Energy: 2.0522932051530542
Energy: 1.9461747210387692
Energy: 2.067329103830789
Energy: 2.020818988271788
Energy: 1.990702677645383
Energy: 1.9467891900789647
Energy: 2.0447419289502413
Energy: 2.0444197115377976
Energy: 2.016826308721415
Energy: 2.018136838267267
Energy: 2.019988706476666
Energy: 1.9889958092514841
Energy: 1.9534247452184463
Energy: 1.8539472289839196
Energy: 2.0611645985670837
Energy: 1.9462024784386753
Energy: 2.119338071014808
Energy: 2.062513644631639
Energy: 1.909671682678018
Energy: 1.9891580807533658
Energy: 1.8519849111202165
Energy: 2.0420214274315134
Energy: 1.9484484157243536
Energy: 2.0254850168389598
Energy: 1.8996867815016203
Energy: 1.9119431442436428
Energy: 2.1600042827102817
Energy: 1.9626323955013405
Energy: 2.0599779938602523
Energy: 1.9700380408716238
Energy: 2.0180982523407156
Energy: 2.0182682876829188
Energy: 1.8526753795403046
Energy: 1.9453253212949795
Energy: 2.086885885640978
Energy: 1.8982037522748614
Energy: 1.899224686516045
Energy: 2.0178218524326277
Energy: 1.8960748934642864
Energy: 1.9917680018037591
Energy: 1.9449403347394965
Energy: 1.8502850754586166
Energy: 1.8975385110953251
Energy: 1.8971950987559334
Energy: 2.018941262091195

minimum gb energy = 1.8502850754586166 eV
minimum distance =  2.25788465601837 Angstroms
sigma value = 21


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

Energy: 2.4459802659203906
Energy: 2.3054978904989163
Energy: 1.856907363050903
Energy: 2.4468103889612656
Energy: 1.975305951569929
Energy: 1.9756657740689176
Energy: 2.2727140188264765
Energy: 2.1578420717270763
Energy: 2.039936089914588
Energy: 2.160868517754045
Energy: 1.9139278711543677
Energy: 1.8380896172664407
Energy: 2.144121814561996
Energy: 1.975120720648608
Energy: 2.1187998473968754
Energy: 1.9630000858805579
Energy: 1.985893640424359
Energy: 1.9307886857312369
Energy: 1.9551221388931437
Energy: 1.9658406458920514
Energy: 1.9833817739307484
Energy: 2.3307805798231147
Energy: 1.9592803673602597
Energy: 2.0329531624329857
Energy: 2.035236456025176
Energy: 2.0435666342877283
Energy: 1.9750403670150172
Energy: 2.1562444324154963
Energy: 1.9331517533121394
Energy: 1.9198112358950272
Energy: 2.028435795318681
Energy: 1.8843535629110768
Energy: 1.7977946698134337
Energy: 1.988907404991319
Energy: 1.971471952399794
Energy: 1.8836176611359976
Energy: 1.8369731022389624
Energy: 2.080460466923664
Energy: 1.957451283290671
Energy: 1.790278142468871
Energy: 1.9666472871983571
Energy: 1.9410298920639908
Energy: 2.152478979544275
Energy: 1.876360242097109
Energy: 1.9789390309210884
Energy: 1.9838886369094262
Energy: 1.8828698214141941
Energy: 1.8829904489800984
Energy: 1.938863974939145
Energy: 1.976153209943177
Energy: 1.8873234829839933
Energy: 1.990757385733966
Energy: 2.0308915960397984
Energy: 1.9782209740265158
Energy: 1.9348727199910383
Energy: 1.9486407230427876
Energy: 2.0130422477916423
Energy: 1.908092269112837
Energy: 2.076837854580012
Energy: 2.07069858419703
Energy: 1.948460569280519
Energy: 2.1730563411245916
Energy: 1.968853807062218
Energy: 2.3829830272443244
Energy: 2.141181253397166
Energy: 1.8700539503044113
Energy: 1.995186826244313
Energy: 1.9755370623720037
Energy: 1.9786047290438609
Energy: 1.9327117220973469
Energy: 2.0597475008416235
Energy: 1.983312705093653
Energy: 2.0078935272736773
Energy: 2.0639330592875385
Energy: 1.8826589498680082
Energy: 1.8824463449987634
Energy: 1.9905075096911176
Energy: 1.9786008273606401
Energy: 2.043191571906038
Energy: 2.19711865752022
Energy: 2.0552766888138323
Energy: 2.0927868318183624
Energy: 2.271169154736246
Energy: 1.9685480090205152
Energy: 2.2706391301888167
Energy: 1.971716754549829
Energy: 1.937982872071162
Energy: 2.1987925131300528
Energy: 1.9068869405936395
Energy: 1.9745843645502115
Energy: 1.8828919507585185
Energy: 1.8819073998632236
Energy: 1.9611558306772396
Energy: 2.0169719407670015
Energy: 2.090063041211636
Energy: 2.0344147680495834
Energy: 1.9803441508683812
Energy: 1.9754554083359601
Energy: 1.976101206420944
Energy: 2.0377963313858474
Energy: 2.002036409154823
Energy: 1.904675191286954
Energy: 2.056997638259144
Energy: 2.1468662564203704
Energy: 1.936737136970909
Energy: 2.022006351776678
Energy: 1.8002208342894341
Energy: 1.980518159764952
Energy: 1.9750759397643933
Energy: 1.974240479911958
Energy: 1.9676147608053038
Energy: 1.9766058818060601
Energy: 1.9333289261207802
Energy: 2.03353627157746
Energy: 1.9889284270656815
Energy: 1.8835789390809534
Energy: 1.7379757158031464
Energy: 1.949038431375142
Energy: 2.0698409477341655
Energy: 1.8854384317162514
Energy: 1.8222228361876573
Energy: 2.009791311347616
Energy: 1.8767742877267002
Energy: 1.9644013442528043
Energy: 1.9429848258402451
Energy: 1.9243966017075989
Energy: 2.2704974474676654
Energy: 1.7911080183132786
Energy: 2.0319919837938847
Energy: 1.8728667269935653
Energy: 1.883355846010805
Energy: 1.8830271052858853
Energy: 1.943768438956528
Energy: 1.9763589269485708
Energy: 1.8842688952100943
Energy: 1.9679464407266525
Energy: 2.02971735702765
Energy: 1.9343908842385145
Energy: 1.9330336356120468
Energy: 1.9737831002589878
Energy: 1.975451153803992
Energy: 1.8222794671609401
Energy: 2.0758988940092222
Energy: 2.0420066879322443
Energy: 1.9623101962629055
Energy: 2.157066315112412
Energy: 2.007982173866804
Energy: 2.1289757465966224
Energy: 1.9012410993698723
Energy: 2.00337124995661
Energy: 2.0207317478522415
Energy: 1.8322128492777328
Energy: 1.9476173684999842
Energy: 2.0441358250662356
Energy: 2.0301136223741043
Energy: 1.8894434920897492
Energy: 1.9449624945902477
Energy: 1.9894940528608254
Energy: 1.995344625520882
Energy: 1.978225397887423
Energy: 1.9343808876262953
Energy: 1.976112173564345
Energy: 2.0386494380777815
Energy: 1.8556295941950194
Energy: 1.9838821188955862
Energy: 2.271486852257982
Energy: 2.2716721176520434
Energy: 1.965984401796315
Energy: 1.8816313891514151
Energy: 2.0389586335538215
Energy: 1.927940662177212
Energy: 2.0590287454763994
Energy: 2.0773430463820057
Energy: 1.9782373097415562
Energy: 1.9902600232870176

minimum gb energy = 1.7379757158031464 eV
minimum distance =  2.23502449505036 Angstroms
sigma value = 113


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

Energy: 1.8884457210211105
Energy: 2.0942638324008818
Energy: 2.0511455183927625
Energy: 1.9442771396638838
Energy: 1.96461204345336
Energy: 1.877097528380721
Energy: 1.9965526060858065
Energy: 2.068139493987665
Energy: 2.145180648733848
Energy: 1.8434752281423497
Energy: 2.0197625934570316
Energy: 1.8265906469723812
Energy: 1.8928072048700577
Energy: 1.8869371572338962
Energy: 2.0815429332983273
Energy: 2.050015400443017
Energy: 1.9893963738567246
Energy: 1.8954355409066186
Energy: 1.814501597599107
Energy: 2.0082728469556343
Energy: 1.9192087891109726
Energy: 1.891162399541531
Energy: 2.0389794767336054
Energy: 1.827726050319262
Energy: 2.032157429156391
Energy: 1.8728860502991596
Energy: 1.9296842291039493
Energy: 2.003761785380161
Energy: 1.8679899908053605
Energy: 1.9431313339003615
Energy: 1.8694146259037867
Energy: 2.0214004052312133
Energy: 1.9467362970349862
Energy: 1.9542238389802777
Energy: 2.010320307507096
Energy: 2.072671623029211
Energy: 1.9581601189097453
Energy: 2.000602508072177
Energy: 1.8306590659217996
Energy: 1.9125741359595851
Energy: 2.0051500571230156
Energy: 1.894797755246439
Energy: 2.0182309950791093
Energy: 1.8786731359309963
Energy: 1.8577396711581828
Energy: 1.8730304006832015
Energy: 1.901049853245087
Energy: 1.9395283098060188
Energy: 2.026196434858902
Energy: 1.8501358973340403
Energy: 1.9155124402540091
Energy: 1.8742999958718642
Energy: 1.8673734646946836
Energy: 1.8228512726763653
Energy: 1.8455960921268437
Energy: 1.855479927768559
Energy: 1.925475579348523
Energy: 1.910042097899953
Energy: 2.1172018887700625
Energy: 1.8439355436608842
Energy: 1.8522594252334124
Energy: 2.0482079045070365
Energy: 1.7856345882755649
Energy: 2.0820910772037458
Energy: 1.9332686127510754
Energy: 2.005593128531464
Energy: 1.8819881644780079
Energy: 1.8534904640111471
Energy: 1.9734851665933852
Energy: 1.8601128264095155
Energy: 2.0099187800597855
Energy: 1.83313005949854
Energy: 2.0089464907102434
Energy: 1.8231696799553871
Energy: 1.8878611486560994
Energy: 2.021881308249147
Energy: 1.8149404212569742
Energy: 1.9521318526221878
Energy: 1.8293518801594157
Energy: 2.2149333899387504
Energy: 1.8429370169578665
Energy: 1.9316665479902824
Energy: 2.1706742364918554
Energy: 1.8644873589730429
Energy: 1.8796891418824944
Energy: 1.8946825639504625
Energy: 2.047116712637747
Energy: 1.8670524853967259
Energy: 1.8832085844247124
Energy: 1.912892078949427
Energy: 1.8683906129838468
Energy: 2.0957376327734507
Energy: 1.8723748012258834
Energy: 1.8952943765447399
Energy: 1.9263590292828099
Energy: 1.880233859449969
Energy: 1.9543295336749908
Energy: 1.9054008050085571
Energy: 2.017135887643536
Energy: 1.8279881805781044
Energy: 2.092649026136426
Energy: 1.8438426403580688
Energy: 2.0623998964642953
Energy: 2.1769380899120554
Energy: 1.9861168157013935
Energy: 1.8401747440854124
Energy: 1.9266201519954207
Energy: 1.8657920723149397
Energy: 1.8911622292504724
Energy: 1.8566705994559984
Energy: 1.871111282882084
Energy: 2.087871956101131
Energy: 1.9190565153620296
Energy: 2.048375364837125
Energy: 1.856601113092885
Energy: 1.9218192921354835
Energy: 1.85176163628143
Energy: 1.9448903394986075
Energy: 2.0177606471442218
Energy: 1.9907347758148137
Energy: 2.0986742990869622
Energy: 1.9566183998619964
Energy: 1.8392379705158366
Energy: 1.8783459987221804
Energy: 1.9771333584790916
Energy: 1.934640474919042
Energy: 2.0560825500571367
Energy: 2.07475411671568
Energy: 2.0049381310838545
Energy: 1.8386610594140023
Energy: 1.8763437708686765
Energy: 1.9443901629781575
Energy: 1.8925914107626547
Energy: 1.932921053580772
Energy: 1.82634723430678
Energy: 1.9794739738630702
Energy: 1.8389311321326702
Energy: 2.1107994586312135
Energy: 1.9264355610914945
Energy: 1.865029183165702
Energy: 2.1246185469848125
Energy: 1.8996406279391647
Energy: 1.8402944351389734
Energy: 1.8248975653633106
Energy: 1.8287298127706038
Energy: 1.8197267287729393
Energy: 1.9987783213302537
Energy: 2.048586614969022
Energy: 1.8662077088290676
Energy: 1.926244051642557
Energy: 1.9043297651995559
Energy: 1.907655333162835
Energy: 1.833100589254242
Energy: 2.040413486676452
Energy: 1.8004792355401644
Energy: 1.8174695425394474
Energy: 1.9764732042038926
Energy: 2.251721684478409
Energy: 1.9842125273310898
Energy: 1.97867788809144
Energy: 1.9027811105403276
Energy: 2.048430274093844
Energy: 2.0187492117547814
Energy: 1.831330421500636
Energy: 2.017956425432044
Energy: 1.9310560322349617
Energy: 1.8382950807851992
Energy: 1.9678984981258867
Energy: 1.829866589783888
Energy: 2.118501117979694
Energy: 2.056173246826296
Energy: 1.827008321728424
Energy: 1.841373287637771
Energy: 1.9615168874910833
Energy: 1.951396806959242
Energy: 1.8153225863443792
Energy: 1.8500989667007126
Energy: 1.8360651738404237
Energy: 1.8558244979003218
Energy: 1.9049979568701174
Energy: 1.915089004739218
Energy: 1.966060240857161
Energy: 1.8165400249721901
Energy: 1.9435750447449183
Energy: 1.8478992617701784
Energy: 1.9304792670230106
Energy: 1.9165205027898244
Energy: 1.9538164856204887
Energy: 2.050498595487334
Energy: 2.072857645441826
Energy: 1.965458682029079
Energy: 2.0901073090375424
Energy: 1.8455013109696965
Energy: 1.82922463999638
Energy: 2.0847735811672843
Energy: 1.850294400733462
Energy: 2.127729051148135
Energy: 1.9267447324679234
Energy: 1.9080560089157348
Energy: 1.8965750471882663
Energy: 1.8882655196065803
Energy: 2.010538729681973
Energy: 1.99602445915916
Energy: 1.8181825354474108
Energy: 1.949217755994719
Energy: 1.9038476347440656
Energy: 1.899452206523362
Energy: 1.88477376567079
Energy: 1.859755442355439
Energy: 1.879003864075727
Energy: 1.9197119413774002
Energy: 1.9645384334056497
Energy: 2.138873851013623
Energy: 1.9096588452550463
Energy: 1.9943763597004183
Energy: 2.1208615220112152
Energy: 1.860267479479703
Energy: 2.098616188312099
Energy: 1.898701817334525
Energy: 2.0522959417074604
Energy: 1.838869050652991
Energy: 1.884826874948981
Energy: 2.0246750603469725
Energy: 1.8712414857721167
Energy: 2.0889365011869603
Energy: 1.8862417071869206
Energy: 2.006156365702134
Energy: 1.8299278175037241
Energy: 1.8744406387219865
Energy: 1.9517893905445136
Energy: 1.882402855750796
Energy: 1.8987137750416037
Energy: 1.8569341279284244
Energy: 2.214698390626104
Energy: 1.941509184864894
Energy: 1.8895046147892034
Energy: 2.2297338098406145
Energy: 1.9877672260092063
Energy: 1.8841525324283193
Energy: 1.9079695050611625
Energy: 1.9464678209878359
Energy: 1.9054203951042568
Energy: 1.9307775008182722
Energy: 1.8737102197961562
Energy: 1.8573837939259539
Energy: 2.1612902455598446
Energy: 1.9140787592039534
Energy: 1.9183997867005658
Energy: 1.9009748785554206
Energy: 1.8636230708737629
Energy: 1.9536490075581265
Energy: 1.9207346986141818
Energy: 2.013882550399514
Energy: 1.887796770891838
Energy: 2.013572701583414
Energy: 1.836432731178291
Energy: 1.8271269712021763
Energy: 2.0930936110825153
Energy: 1.8646944760318955
Energy: 1.827685257913103
Energy: 1.9442214526248176
Energy: 1.8673610593618328
Energy: 1.891010872770605
Energy: 1.880814977159258
Energy: 1.8754254992360768
Energy: 2.0716417782643433
Energy: 1.9270773821359657
Energy: 1.952205119783414
Energy: 1.907117962546457
Energy: 1.8925107293452175
Energy: 1.8464119842766378
Energy: 1.8792348273625785
Energy: 2.0336360294869036
Energy: 1.8986883643121277
Energy: 2.087375388582141
Energy: 2.142605361547591
Energy: 1.9126604886290426
Energy: 1.8481758334836251
Energy: 1.9580601830242332
Energy: 1.9816275695075627
Energy: 2.055631213452274
Energy: 2.0979365009737556
Energy: 1.9358062699897458
Energy: 2.102815287873299
Energy: 1.843690613612051
Energy: 1.8480376976252448
Energy: 1.869887936387404
Energy: 1.8978986780997285
Energy: 2.0056155941458615
Energy: 1.8805310607496781
Energy: 2.1297760437462148
Energy: 2.021229893021301
Energy: 1.942981072408021
Energy: 1.8604298715118284
Energy: 2.0734410447668314
Energy: 2.0321583213125103
Energy: 1.840296912811779
Energy: 1.9119400812705007
Energy: 1.8204025897347411
Energy: 1.811763928403146
Energy: 1.8764566164852523
Energy: 2.1925006001230543
Energy: 1.8859848287080405
Energy: 1.8506878308538768
Energy: 1.825357000448905
Energy: 1.8186676260621109
Energy: 1.8157548443167986
Energy: 1.8854730404998858
Energy: 1.8976168319055955
Energy: 1.8349055098806986
Energy: 2.019562262103877
Energy: 1.893046324528411
Energy: 2.0622182493692396
Energy: 1.8243270920895884
Energy: 2.0495921385489906

minimum gb energy = 1.7856345882755649 eV
minimum distance =  2.1972823365403 Angstroms
sigma value = 365


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

Energy: 1.9299039281230759
Energy: 2.4019252069787993
Energy: 1.6486054638984178
Energy: 1.6483623214095238
Energy: 1.6481843869714106
Energy: 1.6482999513398102
Energy: 1.6477372461854343
Energy: 1.6449387924727457
Energy: 1.9813524249117749
Energy: 1.6460465516260778
Energy: 1.6446892776065702
Energy: 1.6454568014879898
Energy: 1.6456280806542685
Energy: 1.9822441029437692
Energy: 1.9356136627837968
Energy: 1.982962417741897
Energy: 1.6454487815195145
Energy: 1.6496289148667942
Energy: 1.6452772570705143
Energy: 1.6468226086579543
Energy: 1.6484371641043245
Energy: 1.934442996666496
Energy: 1.9818033434562266
Energy: 1.6499368898049482
Energy: 1.6498400097987247
Energy: 1.6490609784634047
Energy: 1.6462901811854167
Energy: 1.6484514023059322
Energy: 1.8348770929863947
Energy: 1.9824843073729623
Energy: 1.6666191932066938
Energy: 1.9818844285873831
Energy: 1.6458588873025881
Energy: 1.6653537880465492
Energy: 1.9781224778290258
Energy: 1.9307688493857524
Energy: 1.982157910114035
Energy: 1.6487315002792906
Energy: 1.6480573278482782
Energy: 1.64836404143351
Energy: 1.6483323062205977
Energy: 1.6477566879477028
Energy: 1.645466319771152
Energy: 1.9805123941507827
Energy: 1.6455008705488652
Energy: 1.645212440879152
Energy: 1.6448526498636735
Energy: 1.646039429899445
Energy: 1.9807969419382967
Energy: 1.6461212014547748
Energy: 1.9814341836693192
Energy: 1.6459033188113403
Energy: 1.6508352788215688
Energy: 1.6449139714498735
Energy: 1.6451488460902437
Energy: 1.9801693140338226
Energy: 1.9320521207522217
Energy: 1.9819661117350056
Energy: 1.649036158543824
Energy: 1.64936645195562
Energy: 1.6482649846489348
Energy: 1.6492004662630977
Energy: 1.647632902360863
Energy: 2.1346158368238184
Energy: 1.983015844261411
Energy: 1.6704696341270813
Energy: 1.982870268973085
Energy: 1.97938427111109
Energy: 1.670081410175765
Energy: 1.982700813743617
Energy: 1.9333289080706264
Energy: 1.981660378410248
Energy: 1.6479600149031353
Energy: 1.6483488583576649
Energy: 1.6490423902235554
Energy: 1.6489446530466398
Energy: 1.6477139013523845
Energy: 1.9336706927710043
Energy: 1.9823518744199355
Energy: 1.645495633733362
Energy: 1.6453429279444876
Energy: 1.6502452278563908
Energy: 1.645368330785175
Energy: 1.9800932815190122
Energy: 1.644067939682113
Energy: 1.980596899081547
Energy: 1.6456007038733622
Energy: 1.6452010076617014
Energy: 1.6446202784069244
Energy: 1.6452977119012135
Energy: 1.9805886147429355
Energy: 1.9302516820209008
Energy: 1.982479347905984
Energy: 1.648718394617953
Energy: 1.6482551117911386
Energy: 1.6479253114935626
Energy: 1.6486732782580134
Energy: 1.6473190075171638
Energy: 1.8359090125319792
Energy: 1.9837206376770296
Energy: 1.6650126890889567
Energy: 1.6452507302859052
Energy: 1.6452418800026702
Energy: 1.646571730106609
Energy: 1.9825201797524648
Energy: 1.9355688223131966
Energy: 1.982756022524041
Energy: 1.6446543015081818
Energy: 1.6490930966707593
Energy: 1.6500159468309594
Energy: 1.6503682685647378
Energy: 1.6483191438038383
Energy: 1.9359340549946258
Energy: 1.9816022649881082
Energy: 1.6479040418927302
Energy: 1.646516345113312
Energy: 1.6495969649049722
Energy: 1.6460727670766229
Energy: 1.648760422741771
Energy: 1.8351519429588903
Energy: 1.9821105780542059
Energy: 1.6461480904307784
Energy: 1.6452303261114365
Energy: 1.6459153852175912
Energy: 1.645999980462133
Energy: 1.982920584221037
Energy: 1.9300284201495053
Energy: 1.9807364529887577
Energy: 1.6487637660255046
Energy: 1.6479386998991798
Energy: 1.648126893458446
Energy: 1.64836362392238
Energy: 1.64767322822857
Energy: 1.7705407463178058
Energy: 1.9806724729609375
Energy: 1.64600670005377
Energy: 1.6451622158933228
Energy: 1.6448658356262196
Energy: 1.6453961947935967
Energy: 1.9813346479493386

minimum gb energy = 1.644067939682113 eV
minimum distance =  2.33834324139233 Angstroms
sigma value = 23