Model name: model_name=MEAM_LAMMPS_KimSeolJi_2017_PtCu__MO_070797404269_001
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.917371600866318
cohesive_energy=5.770453839330309
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[3.11370211404828e-19, 4.1219358480581393e-19, 4.877778696913979e-19, 5.491364282436959e-19, 6.0086750740228795e-19, 6.454272439470959e-19, 6.84310468677642e-19, 7.185185419901759e-19, 7.48759625956926e-19, 7.755592345138439e-19, 7.993211161726979e-19, 8.20365706260288e-19, 8.389509552146879e-19, 8.5528995252822e-19, 8.69562141983892e-19, 8.819165260086658e-19, 8.9248448308653e-19, 9.01381369935132e-19, 9.08703317152512e-19, 9.145384444535399e-19, 9.18965258493282e-19, 9.22052652867e-19, 9.2386311246342e-19, 9.24455917818e-19, 9.23816649341034e-19, 9.21738626246736e-19, 9.17955887213862e-19, 9.121447925623439e-19, 9.0391601337012e-19, 8.9280491841333e-19, 8.7824113281027e-19, 8.595325162550519e-19, 8.358283129550219e-19, 8.060774950382759e-19, 7.68971084194836e-19, 7.228716559047539e-19, 6.657108001335359e-19, 5.94843323258448e-19, 5.06871008638776e-19, 3.97360633528242e-19, 2.60475468449184e-19, 8.840153773992059e-20, -1.2944786114403e-19, -4.07710694583882e-19, -7.66979578638774e-19, -1.236923620217118e-18, -1.86137676984852e-18, -2.7071017278717598e-18, -3.8795265233339396e-18, -5.552391190426019e-18, -8.027609894058959e-18, -1.1865816282002038e-17, -1.82013674328936e-17, -2.9612389855568397e-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: 0.018953245543980125
Energy: 0.9813763925418691
Energy: 0.9813299757062026
Energy: 0.019254652281711807
Energy: 0.9882543835629146
Energy: 0.019346535123985445
Energy: 0.9813763925421363
Energy: 0.971626713704805
Energy: 0.5665135415407669
Energy: 1.5267686366566933
Energy: 0.9821324098091087
Energy: 0.566459584206379
Energy: 0.9813299757069739
Energy: 0.5665135415407669
Energy: 0.14547125211958703
Energy: 0.9817147651050655
Energy: 0.5672086718212241
Energy: 0.14491896682886182
Energy: 0.019254652281711807
Energy: 1.5267686363737545
Energy: 0.9817147651050655
Energy: 0.01938765130035063
Energy: 0.5667373968081112
Energy: 0.019403802149499366
Energy: 0.9882543835634191
Energy: 0.9821324102692888
Energy: 0.5672086718212241
Energy: 0.5667373968091498
Energy: 0.9748701736012058
Energy: 0.5687433979693783
Energy: 0.01934653512425251
Energy: 0.5664595842066461
Energy: 0.1449189668291289
Energy: 0.019403802148994915
Energy: 0.5687433979693783
Energy: 0.019722388930404237

minimum gb energy = 0.018953245543980125 eV
minimum distance =  2.7655965396992 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.871609194177925
Energy: 1.9738856466177785
Energy: 1.6840559238364534
Energy: 1.875303708588796
Energy: 2.1724756522682798
Energy: 1.737313712626712
Energy: 1.8863474476004942
Energy: 1.2012970410219925
Energy: 1.201113007998336
Energy: 1.8818619353685424
Energy: 1.2460101590728057
Energy: 1.2003449922484526
Energy: 1.8622227067554278
Energy: 1.2962256382449828
Energy: 1.2957348116173963
Energy: 1.8649619141378264
Energy: 1.295966556488369
Energy: 1.2783079809495703
Energy: 1.9578091677027647
Energy: 1.9081824641524363
Energy: 1.707518381973932
Energy: 1.9603423466756507
Energy: 1.931540498814852
Energy: 1.6096372389958227
Energy: 1.8436199648473286
Energy: 1.3341053321825647
Energy: 1.3200791105385026
Energy: 1.6821520759867268
Energy: 1.3357735677510596
Energy: 1.3572597316684805
Energy: 1.7242810747962285
Energy: 1.3274791205985828
Energy: 1.3269399618813353
Energy: 1.7205232982545948
Energy: 1.4253301385106425
Energy: 1.2929287757811734
Energy: 1.7528823852751299
Energy: 1.7089781253131382
Energy: 1.6136380510315784
Energy: 1.7552802356333492
Energy: 1.7123922429940097
Energy: 1.4799783355757767
Energy: 1.764481904181946
Energy: 1.5016900750587119
Energy: 1.4033905887387388
Energy: 1.7645515303100867
Energy: 1.5236787848017483
Energy: 1.4999311041149155
Energy: 1.448110242286124
Energy: 1.4156830793282016
Energy: 1.3877915571396178
Energy: 1.3654548624223726
Energy: 1.6922788960407045
Energy: 1.3073763852193925
Energy: 1.4204698759242844
Energy: 1.5046974935379323
Energy: 1.4401447577160527
Energy: 1.4229053907326088
Energy: 1.548962318493671
Energy: 1.410768108434316
Energy: 1.932738380133496
Energy: 1.7480141568925176
Energy: 1.6131824151520697
Energy: 1.929388750262554
Energy: 1.7840046955515043
Energy: 1.6965372375166345
Energy: 1.3435754527412558
Energy: 1.489704435585043
Energy: 1.2169470419960018
Energy: 1.2959573435608351
Energy: 1.929235964641754
Energy: 1.2710305895616287
Energy: 1.3149907950412547
Energy: 1.4093807288643119
Energy: 1.1844035184590085
Energy: 1.3146296701977156
Energy: 1.9816612886414666
Energy: 1.2219291776347876
Energy: 2.167600384473076
Energy: 1.9189905771501874
Energy: 1.6357406868940663
Energy: 2.161116636782023
Energy: 1.9590117144285883
Energy: 1.8700921964852448
Energy: 1.330882611211729
Energy: 1.3802668689767386
Energy: 1.259190931928159
Energy: 1.3311605729474878
Energy: 1.5985693996309547
Energy: 1.2594203012920124
Energy: 1.36353628371696
Energy: 1.484378078719454
Energy: 1.364642773178966
Energy: 1.3637123164217917
Energy: 1.8431904849247367
Energy: 1.2968384359854903
Energy: 1.7870577736970843
Energy: 1.6219343152291879
Energy: 1.4622482251002045
Energy: 1.8140658946847585
Energy: 1.7021165438029453
Energy: 1.6367174969772562
Energy: 1.4614304052654365
Energy: 1.6465823571705607
Energy: 1.478379125686742
Energy: 1.4576486814194938
Energy: 1.7618234227001475
Energy: 1.395372269738464
Energy: 1.5888488958923508
Energy: 1.4456389614773708
Energy: 1.3743299484186895
Energy: 1.5910652167935628
Energy: 1.5010561707042926
Energy: 1.372299214932357
Energy: 1.8037252624406044
Energy: 1.4996612229476656
Energy: 1.5321227265027808
Energy: 1.6519973942655914
Energy: 1.5125325890269234
Energy: 1.4797696671777758
Energy: 1.779891324438283
Energy: 1.7104295686752709
Energy: 1.6322573722088136
Energy: 1.7824927222610638
Energy: 1.78932485505022
Energy: 1.5216709795515257
Energy: 1.738699780048306
Energy: 1.3144858495184333
Energy: 1.3179922243998163
Energy: 1.7428411729880224
Energy: 1.3147765167173686
Energy: 1.3756674972088687
Energy: 1.8939490987724996
Energy: 1.3004633788428823
Energy: 1.292756342705109
Energy: 1.893938975130587
Energy: 1.2999897612849123
Energy: 1.2918618029282845

minimum gb energy = 1.1844035184590085 eV
minimum distance =  2.52474944369647 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 2.179053311494211
Energy: 1.7887286239988536
Energy: 1.5747014466164821
Energy: 1.9562512648461308
Energy: 1.7446638013336901
Energy: 1.7745368470772447
Energy: 2.023650888080275
Energy: 1.2136577092037293
Energy: 1.2357846047882324
Energy: 1.8621099010781756
Energy: 1.2138538611844925
Energy: 1.4398172665237592
Energy: 1.8784830287862229
Energy: 1.4187332411720734
Energy: 1.3161554323872076
Energy: 1.888970542137621
Energy: 1.3097624023151897
Energy: 1.5352853660686776
Energy: 1.7855147034755252
Energy: 2.1442507324820865
Energy: 2.138734114694698
Energy: 1.7833957976001338
Energy: 2.150031608261403
Energy: 1.677084634604116
Energy: 1.9506851533798941
Energy: 1.5233393698638478
Energy: 1.520412766530594
Energy: 1.957976971494226
Energy: 1.525711529639565
Energy: 1.5636922982530754
Energy: 1.9556512223732738
Energy: 1.6275436136151866
Energy: 1.522851184582131
Energy: 1.9110106795398478
Energy: 1.6273994588221516
Energy: 1.5332013245945986
Energy: 1.9441170337371823
Energy: 1.8788022640052275
Energy: 1.835417841862346
Energy: 1.9250735920515167
Energy: 1.9101758998751144
Energy: 1.799475795279499
Energy: 1.993490800280706
Energy: 1.4756614569877327
Energy: 1.4579138561260059
Energy: 1.6754754475914981
Energy: 1.4756768570466854
Energy: 1.5368253132027931
Energy: 1.5826834997193207
Energy: 1.6906468865190367
Energy: 1.61215241727477
Energy: 1.581503302882524
Energy: 1.673848046743684
Energy: 1.541793477909501
Energy: 1.441307411707134
Energy: 1.7141189969595678
Energy: 1.6747119623129214
Energy: 1.437891483275646
Energy: 1.8629914277831898
Energy: 1.465761881016637
Energy: 1.85235843116413
Energy: 1.7226523692109486
Energy: 1.7351359937590842
Energy: 1.8523364831939269
Energy: 1.9708179409400455
Energy: 1.618669262241605
Energy: 1.4553975378646204
Energy: 1.7408347709006302
Energy: 1.5786311148956091
Energy: 1.4752466653479515
Energy: 1.8732042339019466
Energy: 1.3679537685795113
Energy: 1.4234648405074988
Energy: 1.55311505395549
Energy: 1.553333287683057
Energy: 1.3931611727978008
Energy: 1.4011964615720516
Energy: 1.4342784445207621
Energy: 2.357656952176879
Energy: 1.7839214948542066
Energy: 1.7007956926467054
Energy: 2.246158785973048
Energy: 1.783519841835053
Energy: 1.5945335918901073
Energy: 1.5418167725163323
Energy: 1.5898657090618498
Energy: 1.553268232760411
Energy: 1.5272253589393316
Energy: 1.9816249774952952
Energy: 1.5436285425812921
Energy: 1.6473794069481575
Energy: 1.8030239869864582
Energy: 1.490612766636737
Energy: 1.5907813504438044
Energy: 1.8463253343305168
Energy: 1.5024378778144047
Energy: 1.9635167477879512
Energy: 1.8417855051043062
Energy: 1.7007107963779489
Energy: 1.8963026712034923
Energy: 1.9268058570832396
Energy: 1.7114782010209189
Energy: 1.475972530785639
Energy: 1.695712841948383
Energy: 1.6703034498548839
Energy: 1.4760623434340066
Energy: 1.7024606632236823
Energy: 1.4588578894422792
Energy: 1.6275486391869292
Energy: 1.5378116826715447
Energy: 1.5960400607451133
Energy: 1.5857816121568034
Energy: 1.6088773345404752
Energy: 1.544458405928642
Energy: 1.92188657000496
Energy: 1.4288436609692086
Energy: 1.5054574099960352
Energy: 2.014379683073108
Energy: 1.4283501570029136
Energy: 1.434963386817723
Energy: 1.9688336147702528
Energy: 1.85246622007135
Energy: 1.8154438554328869
Energy: 2.115131052729536
Energy: 1.865346703312318
Energy: 1.6147573086401787
Energy: 1.8698478897684605
Energy: 1.4574425654709795
Energy: 1.3607772291796612
Energy: 1.9864090551953073
Energy: 1.4671000229351423
Energy: 1.3912713823627236
Energy: 1.9020986402435176
Energy: 1.3464014201675016
Energy: 1.4162594588923831
Energy: 1.9884208237633134
Energy: 1.4232849577043187
Energy: 1.4550257366788653
Energy: 1.7816110058106682
Energy: 2.248957026263002
Energy: 2.2515104382004263
Energy: 1.7838976123149
Energy: 2.2607804030068017
Energy: 1.699913336890755
Energy: 1.9414920544346355
Energy: 1.5134813828279767
Energy: 1.5337581911483384
Energy: 1.9647632331759988
Energy: 1.5299211215751718
Energy: 1.5312910492834115
Energy: 1.8925301678849402
Energy: 1.592472936812751
Energy: 1.4908526290598387
Energy: 1.850254313406883
Energy: 1.590785261851007
Energy: 1.5027314487136452
Energy: 1.8718670019684196
Energy: 1.8779047176787735
Energy: 1.7949080528934194
Energy: 1.8903105275716319
Energy: 1.8574370497385115
Energy: 1.6964948972964644
Energy: 1.8939774200870312
Energy: 1.4757911844376819
Energy: 1.4573086994592694
Energy: 1.8687838179726726
Energy: 1.4754586035891293
Energy: 1.6888628553090606
Energy: 1.5648232270932623
Energy: 1.5634656352869398
Energy: 1.513237298341587
Energy: 1.6112286048116211
Energy: 1.5627495831498
Energy: 1.6385159984952324
Energy: 1.4629983347974287
Energy: 1.5348766439978991
Energy: 1.6057163348623633
Energy: 1.4902024523314168
Energy: 1.8077082329067695
Energy: 1.512745497000577
Energy: 1.8621810626148951
Energy: 1.6203855041025919
Energy: 1.6144905393891822
Energy: 1.862325903170358
Energy: 2.1067407983547075
Energy: 1.7211669600142374
Energy: 1.5067982467746668
Energy: 1.8546423905040563
Energy: 1.4928678776749331
Energy: 1.5066633357314299
Energy: 2.0140387477746597
Energy: 1.3739427924807468
Energy: 1.424166536641716
Energy: 1.4373894009136716
Energy: 1.45478535713598
Energy: 1.4258438355343672
Energy: 1.9865004475850392
Energy: 1.4451323846060828
Energy: 2.2363813617504116
Energy: 1.784001578241131
Energy: 1.7007216420929223
Energy: 1.9947281384904627
Energy: 1.7856250502280449
Energy: 1.5894039974411207
Energy: 1.5601506167152264
Energy: 1.6013640206102642
Energy: 1.546204961092234
Energy: 1.5319723548831388
Energy: 1.56635094199955
Energy: 1.4849286794300287
Energy: 1.6301018475758429
Energy: 1.782943019759881
Energy: 1.542350714304707
Energy: 1.5922090091855574
Energy: 1.8858788575991754
Energy: 1.4938460141715402
Energy: 1.9112744000900426
Energy: 1.8051243750684727
Energy: 1.6845957252303874
Energy: 1.8073221342065375
Energy: 1.8557545198293288
Energy: 1.7045092317780892
Energy: 1.6131932413916765
Energy: 1.6800947430256072
Energy: 1.6680655519453198
Energy: 1.5975694127443618
Energy: 1.8306050788709889
Energy: 1.6793113925579957
Energy: 1.5645780653444659
Energy: 1.5766802765227497
Energy: 1.46377668673303
Energy: 1.5633190412869593
Energy: 1.5350011025143289
Energy: 1.4808658675691377
Energy: 2.0269788997434515
Energy: 1.4989012868424485
Energy: 1.3695289390790164
Energy: 1.6997385395097224
Energy: 1.456537595762848
Energy: 1.6767802471809385
Energy: 2.218673493422381
Energy: 1.7404936552520491
Energy: 1.7324366793402224
Energy: 2.0039157120850057
Energy: 1.8245445521905121
Energy: 1.7750009423793291

minimum gb energy = 1.2136577092037293 eV
minimum distance =  2.49094318633282 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.8171726747345638
Energy: 1.911003558472347
Energy: 1.968672202127347
Energy: 1.819777246115504
Energy: 2.211674744866294
Energy: 1.5747476803683025
Energy: 1.861500991702946
Energy: 1.4337468493343253
Energy: 1.287757550604479
Energy: 1.8202551253846597
Energy: 1.4342203399436226
Energy: 1.3844762955484864
Energy: 1.7664792214805531
Energy: 1.345556271357527
Energy: 1.254884478220348
Energy: 1.8585667992996524
Energy: 1.345728097462591
Energy: 1.254536691587982
Energy: 1.6395115658360275
Energy: 1.8532356113010442
Energy: 1.891156517475825
Energy: 1.6402473442691816
Energy: 1.797351569037024
Energy: 1.5631051396742732
Energy: 1.77650159486399
Energy: 1.494252722080627
Energy: 1.4923324564141047
Energy: 1.7766482485656212
Energy: 1.5014064455176104
Energy: 1.5006905372753672
Energy: 1.54331039349947
Energy: 1.5175407309353113
Energy: 1.4664220101813359
Energy: 1.5447517625159723
Energy: 1.5156685998074653
Energy: 1.3867018468022727
Energy: 1.5057013508416233
Energy: 1.5999210901320742
Energy: 1.414116145005702
Energy: 1.5051723571219204
Energy: 1.601872760213071
Energy: 1.5258389357149702
Energy: 1.8618523295458014
Energy: 1.7625492611181104
Energy: 1.5731894305294472
Energy: 1.6906631577615525
Energy: 1.7626839317935687
Energy: 1.6567116861277211
Energy: 1.359157959382356
Energy: 1.8421889412789485
Energy: 1.401256118285875
Energy: 1.3593131592312377
Energy: 1.8640187132963317
Energy: 1.2546561743366649
Energy: 1.3416026522268174
Energy: 1.4678470350366934
Energy: 1.282207057067833
Energy: 1.34198071503407
Energy: 1.8285560148053666
Energy: 1.3417520704567163
Energy: 2.1599731165138065
Energy: 1.875846639341536
Energy: 1.771883921515967
Energy: 2.1612607081174184
Energy: 1.874992693205727
Energy: 1.7957915932791608
Energy: 1.412138799929237
Energy: 1.3941449715733352
Energy: 1.424622695661409
Energy: 1.4122476772408803
Energy: 1.70808436619792
Energy: 1.4116328481947973
Energy: 1.335882930111974
Energy: 1.7236935947993957
Energy: 1.2856049536502643
Energy: 1.336606087374543
Energy: 1.7301917897449304
Energy: 1.2783186250781593
Energy: 1.8212704924604277
Energy: 1.6055600665802268
Energy: 1.490701537001698
Energy: 1.5003968879844025
Energy: 1.6059683470763733
Energy: 1.517867254374318
Energy: 1.6976772777856075
Energy: 1.7162895045111195
Energy: 1.6355414060340585
Energy: 1.6505147299711853
Energy: 1.768669597767629
Energy: 1.6038345536749476
Energy: 1.5134467477116629
Energy: 1.4358970409555825
Energy: 1.4331846513897268
Energy: 1.5099721961091839
Energy: 1.4357473095034476
Energy: 1.4582626429348622
Energy: 1.817925990421137
Energy: 1.3381526310836451
Energy: 1.3112948271588625
Energy: 1.798341403912759
Energy: 1.337925606430697
Energy: 1.398825126157175
Energy: 1.8172029175542344
Energy: 1.4660128823829983
Energy: 1.4579999533206158
Energy: 1.8177211733356824
Energy: 1.4655433266818751
Energy: 1.7246706625902477

minimum gb energy = 1.254536691587982 eV
minimum distance =  2.52432233167748 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 1.491376570942215
Energy: 1.2521192709249407
Energy: 1.3715814151562782
Energy: 1.4952797378544767
Energy: 1.9766218368867055
Energy: 1.3724093891909663
Energy: 1.6767791548600612
Energy: 1.1538667801541649
Energy: 1.1538331829089825
Energy: 1.5662584721735264
Energy: 1.153671041255888
Energy: 1.4325828110151004
Energy: 1.7073872783560549
Energy: 1.4015299395849314
Energy: 1.1896317771154477
Energy: 1.7081205929505132
Energy: 1.4016019745383796
Energy: 1.1889686482832946
Energy: 1.3114674769113435
Energy: 1.814366548136023
Energy: 1.8918038300233257
Energy: 1.3105647647047591
Energy: 1.8149926675792916
Energy: 1.891689389759204
Energy: 1.8086354981796315
Energy: 1.3901348812500394
Energy: 1.4628346998752322
Energy: 1.8076131202487127
Energy: 1.3897176775301037
Energy: 1.4145829388216389
Energy: 1.31426364626246
Energy: 1.1861100899561767
Energy: 1.398028947683373
Energy: 1.3146369656054675
Energy: 1.18637553605011
Energy: 1.455417051663589
Energy: 1.3141701065623208
Energy: 1.751672312993715
Energy: 1.5421508464106632
Energy: 1.3145496496704985
Energy: 1.687595036752617
Energy: 1.2711564099305492
Energy: 1.5414013650026097
Energy: 1.3725988136956144
Energy: 1.3720674764780403
Energy: 1.5410026651108932
Energy: 1.4940225909247749
Energy: 1.3214506416199545
Energy: 1.2682283620966
Energy: 1.5755527060570722
Energy: 1.4612088200461157
Energy: 1.2681502038709835
Energy: 1.6243525928957103
Energy: 1.2788239951859033
Energy: 1.4004473133272806
Energy: 1.4757617137231283
Energy: 1.4752307863111938
Energy: 1.401320936078717
Energy: 1.6667129997578072
Energy: 1.1891723416914624
Energy: 1.8103765435565662
Energy: 1.3093312649388247
Energy: 1.3095120152862647
Energy: 1.8107119588151828
Energy: 1.3114545588907138
Energy: 1.8906707364392206
Energy: 1.7897945129319175
Energy: 1.4641566276885911
Energy: 1.6751251472026478
Energy: 1.6591346831575176
Energy: 1.6688541663394847
Energy: 1.4623768143048086
Energy: 1.1874141092560693
Energy: 1.439509955253174
Energy: 1.2703625229164455
Energy: 1.122277380857781
Energy: 1.4391032959167824
Energy: 1.2716484856959431
Energy: 1.7029393666315704
Energy: 1.2707090624646307
Energy: 1.2711394337986128
Energy: 1.7054270460712209
Energy: 1.3158030415090143
Energy: 1.5403713752339823
Energy: 1.6245753578905735
Energy: 1.541394386518736
Energy: 1.4126025719434059
Energy: 1.6284516702352245
Energy: 1.5409681790176968
Energy: 1.341965103603163
Energy: 1.493200483421313
Energy: 1.2684450134602985
Energy: 1.3216307654179842
Energy: 1.493721493033332
Energy: 1.2683519122101246
Energy: 1.3720530089845935
Energy: 1.6657341501085883
Energy: 1.1535801331344409
Energy: 1.1536719408631073
Energy: 1.6358136338049059
Energy: 1.1533217401755544
Energy: 1.4324498150286735
Energy: 1.3703429756255576
Energy: 1.1896668549880562
Energy: 1.190050996653886
Energy: 1.3713395474302903
Energy: 1.189796427561221
Energy: 1.625998079927065
Energy: 1.3605738476263496
Energy: 1.6381845040509846
Energy: 1.6385887439668463
Energy: 1.3602157631579634
Energy: 1.7913434760979192
Energy: 1.6387019789177206
Energy: 1.4391593049099642
Energy: 1.1221528777530494
Energy: 1.2708103042943713
Energy: 1.4392804493875613
Energy: 1.122248545403439
Energy: 1.2708865355898684
Energy: 1.3131262688493315
Energy: 1.3971492100484808
Energy: 1.2439226291851726
Energy: 1.3145186904321198
Energy: 1.3966710320449387
Energy: 1.2704789752241992
Energy: 1.3909173440823694
Energy: 1.5684889373475899
Energy: 1.6593803972273542
Energy: 1.391082039017083
Energy: 1.5685418398277617
Energy: 1.34956275724746
Energy: 1.540659993473303
Energy: 1.3714269147416356
Energy: 1.3712451733678805
Energy: 1.3263713969905662
Energy: 1.4942893892533
Energy: 1.3709830813721697
Energy: 1.1537692423643788
Energy: 1.5668357275082911
Energy: 1.4324818365382617
Energy: 1.1537155744997707
Energy: 1.624844631962165
Energy: 1.1531141072913669
Energy: 1.4016331715129149
Energy: 1.6255958233372299
Energy: 1.4016835248837576
Energy: 1.401655812168862
Energy: 1.4136723554117623
Energy: 1.189386813183184
Energy: 1.8159920256057172
Energy: 1.3093082884175877
Energy: 1.383699649381622
Energy: 1.8152871990675554
Energy: 1.3105187887545724
Energy: 1.8903903191245353
Energy: 1.4341951812324005
Energy: 1.4148956563864254
Energy: 1.4146593156134077
Energy: 1.43257140013727
Energy: 1.6938515731767418
Energy: 1.4627769551210879
Energy: 1.186204061843323
Energy: 1.3340757754457493
Energy: 1.3341092304782722
Energy: 1.187195007142614
Energy: 1.3781781753110278
Energy: 1.3979802357756055
Energy: 1.70579404042472
Energy: 1.2710473822003965
Energy: 1.2708350354104454
Energy: 1.6651468592242382
Energy: 1.3146422478202657
Energy: 1.5422074460962574
Energy: 1.4930243176338454
Energy: 1.3744721395087502
Energy: 1.3215256781890836
Energy: 1.493530648048462
Energy: 1.5410760235059926
Energy: 1.3721009897439485

minimum gb energy = 1.1221528777530494 eV
minimum distance =  2.5087128893317 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 1.2657979143014662
Energy: 1.7060204498392717
Energy: 1.7077173781817836
Energy: 1.2689754187859386
Energy: 2.133212903967914
Energy: 1.8513773247289291
Energy: 1.7072697604854454
Energy: 1.3050900536243129
Energy: 1.305215929031697
Energy: 1.7094163317847129
Energy: 1.3073764196842808
Energy: 1.301952260028228
Energy: 1.8049810634031722
Energy: 1.2264546164219579
Energy: 1.2269158036393917
Energy: 1.6585365914413248
Energy: 1.2258149341251654
Energy: 1.2998740411649612
Energy: 1.598858685016086
Energy: 1.5021595796368197
Energy: 1.6102258421984625
Energy: 1.73832424216232
Energy: 1.4085196364680121
Energy: 1.5495385429529425
Energy: 1.7207149533920256
Energy: 1.377560755486811
Energy: 1.352558498708932
Energy: 1.7234549614705108
Energy: 1.4283163473331386
Energy: 1.5055423412281164
Energy: 1.2636065828343734
Energy: 1.2235854404562192
Energy: 1.2235988566305853
Energy: 1.2637840098842743
Energy: 1.268667407190605
Energy: 1.3581581499115603
Energy: 1.2537763822817372
Energy: 1.3097149213321757
Energy: 1.310060613098801
Energy: 1.2544174111395912
Energy: 1.5989203427912613
Energy: 1.2934853585959785
Energy: 1.491430166544806
Energy: 1.6085587584031775
Energy: 1.6085944023606902
Energy: 1.4914425575060737
Energy: 1.7080079315154764
Energy: 1.5715426161974584
Energy: 1.6356688522623597
Energy: 1.6940498307684728
Energy: 1.8278099021901502
Energy: 1.4737294902359932
Energy: 1.7873983437687329
Energy: 1.812681720318493
Energy: 1.1600741813586466
Energy: 1.329333262660807
Energy: 1.236180847189168
Energy: 1.1606715956599558
Energy: 1.274340051623518
Energy: 1.1444032670751147
Energy: 1.354480134285328
Energy: 1.1424118403047205
Energy: 1.1437998635384294
Energy: 1.2750212770915037
Energy: 1.1594253083033954
Energy: 1.1446719790299653
Energy: 1.8790354939540606
Energy: 1.4766738431821667
Energy: 1.4588412956096957
Energy: 1.7252340251049951
Energy: 1.4767900786591606
Energy: 1.4591736941436617

minimum gb energy = 1.1424118403047205 eV
minimum distance =  2.52220431451415 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 2.036431286991622
Energy: 2.0385337984714194
Energy: 1.6260550514240963
Energy: 2.0391141501318066
Energy: 2.306856344226487
Energy: 1.8185464201419714
Energy: 1.41971418492794
Energy: 1.0858696620904826
Energy: 1.0861466225268508
Energy: 1.2956828210379099
Energy: 1.0864122198839055
Energy: 1.1952581491495453
Energy: 1.3360687063340264
Energy: 0.9945610388392695
Energy: 0.9942615290142727
Energy: 1.3379758880646615
Energy: 0.9941074132103314
Energy: 1.1064056109620353
Energy: 1.2744438552557673
Energy: 1.1686428850942767
Energy: 1.2986662420702144
Energy: 1.2762705684351257
Energy: 1.0919288202498456
Energy: 1.2361501854091683
Energy: 1.6301994462044191
Energy: 1.4438751170339001
Energy: 1.394177899561796
Energy: 1.6615439595558108
Energy: 1.7291413902061603
Energy: 1.3449263947584402
Energy: 1.0807983379212047
Energy: 1.4479881498045233
Energy: 1.6166735850501393
Energy: 1.1518263361907868
Energy: 1.5152022850078648
Energy: 1.535087953370206
Energy: 1.1545518288766632
Energy: 1.5398292963147269
Energy: 1.4138441526603671
Energy: 1.1571960977170708
Energy: 1.6333170841722178
Energy: 1.1546843783257748
Energy: 1.2591838860118074
Energy: 1.232640500397689
Energy: 1.474211347698052
Energy: 1.2594475719597058
Energy: 1.2663490613751112
Energy: 1.3259012233432816
Energy: 1.7365195702272505
Energy: 1.3776256185434743
Energy: 1.345784443651385
Energy: 1.7389923806687144
Energy: 1.4774059298727469
Energy: 1.347340138707099
Energy: 1.5148263361917862
Energy: 1.3729542370187413
Energy: 1.526970289783322
Energy: 1.517235017781552
Energy: 1.373974108973315
Energy: 1.3753055159022447
Energy: 1.5846816922099973
Energy: 1.0981349301471734
Energy: 1.0770381757926415
Energy: 1.5373250039915662
Energy: 1.0988829757195577
Energy: 1.1575966180767774
Energy: 1.6366462582640453
Energy: 1.077168195260161
Energy: 1.0770803812298388
Energy: 1.593134243355893
Energy: 1.0777354519209577
Energy: 1.1386826253848077
Energy: 1.7818594873061275
Energy: 1.8360655854659333
Energy: 1.5019159032234384
Energy: 1.7734277999405337
Energy: 1.8359436965692126
Energy: 1.5607764115593679
Energy: 1.4046212739200998
Energy: 1.2801051850930576
Energy: 1.3271728668434322
Energy: 1.5528775939186474
Energy: 1.4066788761068227
Energy: 1.3029791990757749
Energy: 1.181137549962178
Energy: 1.0105455843402462
Energy: 1.0152969347023453
Energy: 1.181176427593296
Energy: 1.029988722343102
Energy: 1.2631698163450367
Energy: 1.0135038363856435
Energy: 1.190595906812662
Energy: 1.1478607128068496
Energy: 1.0134814201406785
Energy: 1.3093125318745658
Energy: 1.1382844111806125
Energy: 1.0874804106816744
Energy: 1.5810982721821056
Energy: 1.5341255036433685
Energy: 1.0878840048333576
Energy: 1.772341963119791
Energy: 1.0872014201471027
Energy: 1.5656871723437815
Energy: 1.6966015664820169
Energy: 1.8240240942659176
Energy: 1.2772571758180338
Energy: 1.7715634193279297
Energy: 1.7152063412114804
Energy: 1.1092343258252617
Energy: 1.060291493636275
Energy: 1.0856968956534923
Energy: 1.1094348055372716
Energy: 1.1889029046907937
Energy: 1.1681367075103386
Energy: 0.9821336320822628
Energy: 1.0279393666513124
Energy: 1.1119269621793568
Energy: 0.9832845204913179
Energy: 0.983609218570888
Energy: 1.1448577726863212
Energy: 1.0768179359426477
Energy: 1.2154590436123025
Energy: 1.0572579003011402
Energy: 1.2258032701738066
Energy: 1.2205606372781632
Energy: 1.0537527152363415
Energy: 2.042273598621096
Energy: 1.4049148157938443
Energy: 1.5340855624610659
Energy: 2.0364983665312697
Energy: 1.3818008845609167
Energy: 1.746609341448651
Energy: 2.140517747455655
Energy: 1.2571334859237446
Energy: 1.2553003424273275
Energy: 2.0130996705850275
Energy: 1.0863613405217005
Energy: 1.5433443404487808
Energy: 1.3937975657343504
Energy: 0.994228408524864
Energy: 1.035965265895772
Energy: 1.3940705448537676
Energy: 1.024816947080274
Energy: 1.106126604745562
Energy: 1.2779512387290823
Energy: 1.1448531812913338
Energy: 1.2336333182178656
Energy: 1.2685017072841578
Energy: 1.091236939349769
Energy: 1.2347623189841592
Energy: 1.5194250574324983
Energy: 1.4709705507278656
Energy: 1.405662331934243
Energy: 1.5209112182786482
Energy: 1.4809243054264396
Energy: 1.4107572579948153
Energy: 1.8365390384270077
Energy: 1.4409927868387467
Energy: 1.3711093772914569
Energy: 1.8364486738414094
Energy: 1.5105318098776666
Energy: 1.8190807284003592
Energy: 1.0786424063403806
Energy: 1.4362742491323495
Energy: 1.2568816842485666
Energy: 1.0790569583461898
Energy: 1.454785564774155
Energy: 1.0764736802339887
Energy: 1.096429901858701
Energy: 1.3709832990257333
Energy: 1.3165613028994623
Energy: 1.0976579892701768
Energy: 1.618405536035948
Energy: 1.1575451714712635
Energy: 1.5452373604327698
Energy: 1.2326782289285332
Energy: 1.45020757589863
Energy: 1.548499853420076
Energy: 1.26600429524562
Energy: 1.4119820668340377
Energy: 1.682842933183728
Energy: 1.501621136977362
Energy: 1.253758614001686
Energy: 1.5146609824798116
Energy: 1.4936161987771523
Energy: 1.3387928350547509
Energy: 1.5352751481737732
Energy: 1.1827464648102815
Energy: 1.2339704036790347
Energy: 1.5113272045055823
Energy: 1.1828484213693895
Energy: 1.4315521798495465
Energy: 1.6714635722906783
Energy: 1.2194313639497691
Energy: 1.1372607866822901
Energy: 1.6725848337926603
Energy: 1.219519217806977
Energy: 1.3750915358783586
Energy: 1.7777153453945007
Energy: 1.0805348094867724
Energy: 1.2468812579097783
Energy: 1.7804179384705612
Energy: 1.079190914093852
Energy: 1.5901748855662738
Energy: 1.8962473256722607
Energy: 1.5644026879777524
Energy: 1.4839141052289648
Energy: 1.7871104021875952
Energy: 1.5792102542380027
Energy: 1.522454948709332
Energy: 1.2462257608112393
Energy: 1.020155275256524
Energy: 1.1575442220657322
Energy: 1.246815789283002
Energy: 1.0249146997610517
Energy: 1.1990646582424667
Energy: 1.011018094368402
Energy: 1.1596032986059426
Energy: 1.228196443741566
Energy: 1.0120896867040396
Energy: 1.2142910315665032
Energy: 1.074438874397386
Energy: 1.0866155243519766
Energy: 1.258484345591117
Energy: 1.2073719227644661
Energy: 1.0873519820199573
Energy: 1.187157388556744
Energy: 1.0883406905361144
Energy: 2.256825011044135
Energy: 1.6903323464381632
Energy: 1.5968448995710638
Energy: 2.3068064819686898
Energy: 1.7644526184564782
Energy: 1.9883996780058653
Energy: 1.234391886649232
Energy: 1.2868848990680386
Energy: 1.4555276477227435
Energy: 1.235512603033994
Energy: 1.187054756125606
Energy: 1.1973312773876505
Energy: 0.9849621667735409
Energy: 1.0292805312029327
Energy: 1.1098305304754033
Energy: 0.9830641657690221
Energy: 0.983215709296144
Energy: 1.078114680392817
Energy: 1.0785759272435522
Energy: 0.9585133237954092
Energy: 0.9584264563460901
Energy: 1.0782762222562008
Energy: 0.962787530367133
Energy: 1.0500137397896054
Energy: 2.137436153208146
Energy: 1.539700707581213
Energy: 1.40196429805589
Energy: 1.9360206385973118
Energy: 1.5653571589939863
Energy: 1.5395887181890557

minimum gb energy = 0.9584264563460901 eV
minimum distance =  2.55434933661212 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.4113213711633141
Energy: 0.4258737122974967
Energy: 0.4235711941628167
Energy: 0.4150483646966503
Energy: 1.8141016979474156
Energy: 0.41247495559387987
Energy: 0.41265762186526006
Energy: 0.46794975022807755
Energy: 0.4683590464439025
Energy: 0.6521158348693015
Energy: 0.4668525942762133
Energy: 0.6163884913099421
Energy: 0.5235800157448526
Energy: 0.4696331473854902
Energy: 0.6358121135636681
Energy: 0.5242866468366013
Energy: 0.46978189382155233
Energy: 0.6359768326875901
Energy: 0.526498698795489
Energy: 0.6569302819894971
Energy: 0.6570700283777143
Energy: 0.5269575856177745
Energy: 0.5247708301421479
Energy: 0.6570142651925326
Energy: 0.5182655546692191
Energy: 0.413115791329647
Energy: 0.4134582662279145
Energy: 0.519362729584922
Energy: 0.41273370803713266
Energy: 0.5310362223597408
Energy: 0.46992710305959523
Energy: 0.4125682869935105
Energy: 0.4128211174609949
Energy: 0.4700612744002139
Energy: 0.41249290200553995
Energy: 0.45312157666548003
Energy: 0.46325240352414204
Energy: 0.6351641796908472
Energy: 0.6333563581097573
Energy: 0.4638782819377015
Energy: 0.519368029539477
Energy: 0.6325177504483175
Energy: 1.3473388916280487
Energy: 1.518841292391153
Energy: 1.5185523031032164
Energy: 1.3470175085532963
Energy: 1.6522280295957665
Energy: 1.520511103555503
Energy: 0.5179567641156673
Energy: 0.531852217140316
Energy: 0.6561702125040457
Energy: 0.5191569664458454
Energy: 0.5236645272645927
Energy: 0.6559531814465784
Energy: 0.41235684998294625
Energy: 0.523147507886153
Energy: 0.4237446015153325
Energy: 0.41247773531671517
Energy: 0.5227367286855249
Energy: 0.41284781285946276
Energy: 0.41241537037621834
Energy: 0.4693675774134569
Energy: 0.4693735801998012
Energy: 0.4125988030983752
Energy: 0.4695493707064786
Energy: 0.4537748892776606
Energy: 0.5209401593855394
Energy: 0.4680306459608251
Energy: 0.6342531384194778
Energy: 0.5221105894744501
Energy: 0.46740154696986713
Energy: 0.6342207082110807
Energy: 1.6382256731521478
Energy: 1.5200849098600968
Energy: 1.5186330162779542
Energy: 1.638850619961053
Energy: 1.34566010758327
Energy: 1.5172711774918777
Energy: 0.5193066548771705
Energy: 0.4680928070695822
Energy: 0.6340198498523232
Energy: 0.5199387106016068
Energy: 0.46659864936505807
Energy: 0.6346108667667327
Energy: 0.5234741000455999
Energy: 0.41228447446102773
Energy: 0.4123277646284062
Energy: 0.5240956546935119
Energy: 0.4124117718477732
Energy: 0.5975719086268776
Energy: 0.4671349665209451
Energy: 0.4667344141624196
Energy: 0.6169246197275793
Energy: 0.4673568872298474
Energy: 0.41295769121718995
Energy: 0.6159070633740286
Energy: 0.4693949485062168
Energy: 0.63559112759712
Energy: 0.6356439331989335
Energy: 0.4693951549712625
Energy: 0.5244502383584473
Energy: 0.6358992137779294
Energy: 1.3658843236533205
Energy: 1.3925660761155956
Energy: 1.5264503101542133
Energy: 1.3658691553976319
Energy: 1.7315606483268213
Energy: 1.5277651656325564
Energy: 0.41245745620753893
Energy: 0.5225367818091663
Energy: 0.530701702611389
Energy: 0.41276880414700484
Energy: 0.5195188291791798
Energy: 0.6329376355034975

minimum gb energy = 0.4113213711633141 eV
minimum distance =  2.62479082175433 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 1.6867903995538747
Energy: 2.072375369937721
Energy: 1.6728601386160464
Energy: 1.690028076435836
Energy: 2.267708520715182
Energy: 1.8183686314287533
Energy: 1.7411067099459447
Energy: 0.906882804961263
Energy: 0.9071123213577089
Energy: 1.3151186748349057
Energy: 0.8783119142398256
Energy: 0.9326950152785899
Energy: 0.8052922161956791
Energy: 0.8998406551172554
Energy: 0.925584731008118
Energy: 0.8067828611670261
Energy: 0.8645901242990067
Energy: 1.0108629964763478
Energy: 0.9109980377286782
Energy: 0.9168561644985387
Energy: 1.0033502889702937
Energy: 0.9141012325846851
Energy: 0.7685249980182666
Energy: 0.9413672282718739
Energy: 0.9763729657237877
Energy: 1.4937613628687625
Energy: 1.1302308760130535
Energy: 0.9463884214974597
Energy: 1.9093648733392035
Energy: 1.0328148274108107
Energy: 1.182703434847505
Energy: 1.7851506116588336
Energy: 1.6733458664329097
Energy: 1.1775815894587824
Energy: 1.9116600520044758
Energy: 1.9147947654509991
Energy: 1.1303652439045677
Energy: 1.1581622788631505
Energy: 1.0872897268598578
Energy: 1.1313092693411482
Energy: 1.0738547224441046
Energy: 1.0911900384032784
Energy: 0.8720208229996452
Energy: 0.9166102539152735
Energy: 1.0545410347160993
Energy: 0.8752469324549346
Energy: 0.9165573635566476
Energy: 1.1333539170552636
Energy: 1.7139134660658772
Energy: 1.021801396195133
Energy: 0.9929912261645506
Energy: 1.4811977685183262
Energy: 1.0264425149332022
Energy: 1.0289153309633945
Energy: 1.4865967526426538
Energy: 1.7420412358143735
Energy: 1.1327752523845451
Energy: 1.487462769852292
Energy: 1.7419236405711636
Energy: 1.6581118046046186
Energy: 1.8985087181211977
Energy: 1.7343410938604045
Energy: 1.2579758414730904
Energy: 1.9009476393566542
Energy: 1.5286404922361034
Energy: 1.3569945607424359
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Energy: 1.2823964809536346
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Energy: 1.48150663321055
Energy: 1.2558778848158576
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Energy: 1.2190458867352871
Energy: 1.2489666461010778
Energy: 1.2418880897424147
Energy: 1.2212392348743273
Energy: 1.2816489350927944
Energy: 1.2285221453127453
Energy: 1.0718457621356354
Energy: 1.1177271186649826
Energy: 1.0996147202905964
Energy: 1.0778488948696587
Energy: 1.4894619282718184
Energy: 1.1710354784940726
Energy: 1.5666350129539788
Energy: 1.4371538946215607
Energy: 1.4175024984309723
Energy: 1.56924307679686
Energy: 1.4844141624740859
Energy: 1.623449966073127
Energy: 1.5495014606367707
Energy: 1.3068850815631736
Energy: 1.3085035871873538
Energy: 1.5348159397057832
Energy: 1.5473913483361206
Energy: 1.3067172171779466
Energy: 1.2741872701405288
Energy: 1.5458545004647133
Energy: 1.4628932281134106
Energy: 1.2768047131512426
Energy: 1.5502936514370242
Energy: 1.5186294573844918
Energy: 1.787400974278299
Energy: 1.1656839234552383
Energy: 1.2539876837022983
Energy: 1.7472535047936315
Energy: 1.2555953613038706
Energy: 1.2220722055258968
Energy: 1.591484304407104
Energy: 1.1254552392288777
Energy: 1.145779602151891
Energy: 1.6054997826067634
Energy: 1.1304121028271192
Energy: 1.2022403577796212
Energy: 1.0699582637391
Energy: 1.2631495283735654
Energy: 1.3269052230389085
Energy: 1.0713112397579265
Energy: 1.2139447153037703
Energy: 1.3785845346949934
Energy: 1.5263222943036265
Energy: 1.3244973489151057
Energy: 1.2684175544213947
Energy: 1.529306485941018
Energy: 1.7599376278964058
Energy: 1.2743570468175327
Energy: 1.8923405678584604
Energy: 1.5988706155698131
Energy: 1.5506090975636568
Energy: 1.894308006407358
Energy: 1.693253815976199
Energy: 1.7643220765220275
Energy: 1.009677854539998
Energy: 1.1999227804673254
Energy: 1.0478621200973066
Energy: 1.009804924317153
Energy: 1.4339129250019023
Energy: 1.121263976246143
Energy: 0.9662443243045806
Energy: 1.0658319238868772
Energy: 1.1381518760227438
Energy: 0.9685825159174714
Energy: 1.0735318897156358
Energy: 1.0099729045934556
Energy: 1.058512489219925
Energy: 1.0836412057784026
Energy: 1.052060094720816
Energy: 1.060964764272648
Energy: 1.039092555910872
Energy: 1.1368328937371257
Energy: 2.1437839902803595
Energy: 1.3177134027089532
Energy: 1.0917758070952241
Energy: 2.103624114208356
Energy: 1.225956610152888
Energy: 1.348054746030218

minimum gb energy = 0.7685249980182666 eV
minimum distance =  2.52004503631626 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 1.6469192520354876
Energy: 1.7919133069984927
Energy: 1.7925725296429382
Energy: 1.6524780124981726
Energy: 2.1574796210272553
Energy: 1.5747070486513979
Energy: 1.7918534619014597
Energy: 1.0030028576503742
Energy: 0.9690174069362504
Energy: 1.2810072466282423
Energy: 1.003162418647392
Energy: 1.0550547247425435
Energy: 0.9199273803186749
Energy: 1.033730226833663
Energy: 1.1138225779596376
Energy: 0.9127002694484316
Energy: 0.9810160641370341
Energy: 1.0526290866392047
Energy: 1.0478485495193883
Energy: 1.0169782276004142
Energy: 1.0894613130143553
Energy: 1.0487813300178244
Energy: 0.8574817902273207
Energy: 1.0220602534919894
Energy: 1.0902773892647046
Energy: 1.6728859252568065
Energy: 1.6047008194972943
Energy: 1.1907271220553728
Energy: 1.9991312204734273
Energy: 1.1704504284779396
Energy: 1.5102663286205917
Energy: 1.8204332088045454
Energy: 1.6910309287599827
Energy: 1.5281910976397575
Energy: 1.791880388233288
Energy: 1.6404377026060142
Energy: 1.3968031056950316
Energy: 1.3875450691981013
Energy: 1.247730001647515
Energy: 1.046587618182305
Energy: 1.2004928003654702
Energy: 1.2473405588167468
Energy: 1.0067345382240023
Energy: 1.07684619014359
Energy: 1.1964774598883003
Energy: 1.0091720297442583
Energy: 1.0765925972382437
Energy: 1.1858763733562963
Energy: 1.8089064554970278
Energy: 1.091251135659246
Energy: 1.08526271896072
Energy: 1.4727542213418592
Energy: 1.1516498253608498
Energy: 1.126348109868563
Energy: 1.333636412940146
Energy: 1.5351760757118682
Energy: 1.5974616206053842
Energy: 1.32990303587321
Energy: 1.535453207859356
Energy: 1.6014996069083434
Energy: 1.3210437382850042
Energy: 1.5519368902931177
Energy: 1.3312860728620473
Energy: 1.3211429029744586
Energy: 1.7958287796074446
Energy: 1.3650141196286356
Energy: 1.7752652904805022
Energy: 1.563689275483951
Energy: 1.4995025890986808
Energy: 1.776818153572348
Energy: 1.6268876918868629
Energy: 1.6322880398707906
Energy: 1.415408064328273
Energy: 1.6347333586974773
Energy: 1.4992436570759737
Energy: 1.4146808240847315
Energy: 1.6449638023088196
Energy: 1.4944375170838826
Energy: 1.1496297509078124
Energy: 1.1146896904672998
Energy: 1.1523286311201868
Energy: 1.1508931833607274
Energy: 1.4238532152431087
Energy: 1.1253683844899942
Energy: 1.0768227528513887
Energy: 1.3717787740585101
Energy: 1.3914542003360881
Energy: 1.0773920378830877
Energy: 1.330836281486077
Energy: 1.2314413599988698
Energy: 1.243339990507219
Energy: 1.213790877241574
Energy: 1.2481218514778887
Energy: 1.2430918063610912
Energy: 1.3239107101283578
Energy: 1.2917830037417857
Energy: 1.6560566113460042
Energy: 1.9946320295146844
Energy: 1.7989947829941113
Energy: 1.6587412434806161
Energy: 1.4076715666954414
Energy: 1.5041203597539778
Energy: 2.2793504140556013
Energy: 1.2114864415323077
Energy: 1.3030493282573123
Energy: 1.6387792358594306
Energy: 1.191307406922147
Energy: 1.6070869016658196
Energy: 1.2244513888133322
Energy: 0.9759592102534603
Energy: 1.062255237474141
Energy: 0.8995322682987698
Energy: 0.9693010013076317
Energy: 1.0586725007576125
Energy: 0.9200803970076231
Energy: 0.9580339869497924
Energy: 1.0177766805626718
Energy: 0.9216773662906019
Energy: 0.864199466174497
Energy: 0.9730142378474923
Energy: 1.0416004765372466
Energy: 0.9520004604360977
Energy: 1.0138218350238422
Energy: 1.0032853643761404
Energy: 1.2811005211561362
Energy: 1.0447191364322175
Energy: 2.1540569990164076
Energy: 1.9602406962418086
Energy: 1.8365145952197002
Energy: 2.154926279029689
Energy: 1.9612392488942036
Energy: 1.599371190816368
Energy: 1.4153539530372534
Energy: 1.1640673167989941
Energy: 1.2461140820913947
Energy: 1.366963774421468
Energy: 1.3041230444028196
Energy: 1.2448942054010617
Energy: 1.0074841684268023
Energy: 1.0775514672660476
Energy: 1.1857351504601916
Energy: 1.0085902225886172
Energy: 1.0600095386299566
Energy: 1.1632953524202096
Energy: 1.7811762885110256
Energy: 1.0565961770539078
Energy: 1.1325043828837815
Energy: 1.4017742994063824
Energy: 1.0567082339057534
Energy: 1.1319665293158858
Energy: 1.3169343886249918
Energy: 1.429639205136998
Energy: 1.51311708571431
Energy: 1.321087323984319
Energy: 1.3714811420003363
Energy: 1.3145741992673636
Energy: 1.334637509650384
Energy: 1.6219481641198026
Energy: 1.7565636321724847
Energy: 1.3283445181907552
Energy: 1.5532017758900498
Energy: 1.608580503096142
Energy: 1.757086244145626
Energy: 1.3169092811196395
Energy: 1.3565129577575588
Energy: 1.7162722030962836
Energy: 1.7367164350939068
Energy: 1.5561521065884922
Energy: 1.58462515397493
Energy: 1.638473068018087
Energy: 1.543970112880953
Energy: 1.5855844645513446
Energy: 1.6377405481912541
Energy: 1.4248161579613912
Energy: 1.1330441608902906
Energy: 1.1516869986855895
Energy: 1.1336585211458683
Energy: 1.1327871027076284
Energy: 1.7589510909490036
Energy: 1.133370408574173
Energy: 1.0789604579507825
Energy: 1.2775662981945912
Energy: 1.2726679993772385
Energy: 1.0762576693390133
Energy: 1.378612389744327
Energy: 1.2531268012184966
Energy: 1.282543544744709
Energy: 0.9766818384048934
Energy: 1.2547336183929234
Energy: 1.2818261939038165
Energy: 1.2871487960383001
Energy: 1.28035408949072
Energy: 1.650663853645504
Energy: 1.282467365705061
Energy: 1.6038371441064145
Energy: 1.6492188523394995
Energy: 1.4002349202213398
Energy: 1.7468919778638166

minimum gb energy = 0.8574817902273207 eV
minimum distance =  2.51656344881166 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 1.2676964497598544
Energy: 1.6138523244086185
Energy: 1.592895040372989
Energy: 1.2145770744730606
Energy: 1.9601136358486235
Energy: 1.8783366223956457
Energy: 2.019993483595403
Energy: 1.0717125598067156
Energy: 1.1068945726098551
Energy: 1.6117236407759716
Energy: 1.0736668303794903
Energy: 1.2303105446655302
Energy: 1.1153076243478361
Energy: 1.1680710561006162
Energy: 1.1154409249665793
Energy: 1.1329989398721743
Energy: 1.2113625306945102
Energy: 1.2199825485317066
Energy: 1.2319997181540987
Energy: 1.1408495583857998
Energy: 1.1601280341448779
Energy: 1.233769521256311
Energy: 1.1031366079991414
Energy: 1.1687947276465052
Energy: 1.172046883648433
Energy: 1.5945496825148322
Energy: 1.316596882611842
Energy: 1.1921014817319135
Energy: 1.640206693981352
Energy: 1.2465671779459548
Energy: 2.0808893431407873
Energy: 1.6425253199660856
Energy: 1.4547711648649708
Energy: 1.4162336273663447
Energy: 1.6591197532879405
Energy: 1.3741152677616477
Energy: 1.6305076398729341
Energy: 1.2983053715047277
Energy: 1.33079226863597
Energy: 1.270123920889653
Energy: 1.192615588563134
Energy: 1.3395923627118207
Energy: 1.2157923658304628
Energy: 1.3557894184784085
Energy: 1.16018146586787
Energy: 1.2142460941690354
Energy: 1.379238081947393
Energy: 1.2617391944915777
Energy: 1.6603655081318403
Energy: 1.2356273996841258
Energy: 1.2247920278800266
Energy: 1.7106349537596306
Energy: 1.2286001690961692
Energy: 1.2583655994007945
Energy: 1.7050719954828397
Energy: 1.3534706402805383
Energy: 1.410637982042183
Energy: 1.7058359528175948
Energy: 1.359211845852836
Energy: 1.4199770111846906
Energy: 1.634478128037307
Energy: 1.4339652056470373
Energy: 1.6071009769394526
Energy: 1.6148764627772711
Energy: 1.377152524048617
Energy: 1.59233484816115
Energy: 1.6186747764932894
Energy: 1.8956414022385024
Energy: 1.7296149910247725
Energy: 1.5356932421165121
Energy: 2.0481102301301197
Energy: 1.7488874808149306
Energy: 1.631549208845015
Energy: 1.8953714617471056
Energy: 1.8230571991305506
Energy: 1.5158568390335887
Energy: 1.964423979965854
Energy: 1.6937229263095714
Energy: 1.1826979335592103
Energy: 1.2367313342627209
Energy: 1.2541101164859552
Energy: 1.1615948596218326
Energy: 1.177475711041003
Energy: 1.2156634781628812
Energy: 1.0064986460988472
Energy: 1.166629593470643
Energy: 1.2695876409435318
Energy: 1.1520049178764642
Energy: 1.1654914473788454
Energy: 1.2707107158885274
Energy: 1.6529557880643955
Energy: 1.1909230281834455
Energy: 1.2358757119942454
Energy: 1.1434566928648304
Energy: 1.2454719444504618
Energy: 1.227679636097408
Energy: 1.6633802697950697
Energy: 2.03183098231801
Energy: 1.3900081553661106
Energy: 1.656953920807799
Energy: 2.0312245921882326
Energy: 1.6020704893367144
Energy: 1.8464731914745438
Energy: 1.2851129798453216
Energy: 1.303649198160183
Energy: 1.5884613775584124
Energy: 1.2624576875920523
Energy: 1.2881228210494506
Energy: 1.0849068134896194
Energy: 1.2133736399260882
Energy: 1.1993670694794911
Energy: 1.1436080114413452
Energy: 1.2017199928002278
Energy: 1.3303464441262702
Energy: 1.2858941544355593
Energy: 1.2231998298497702
Energy: 1.1811151345017836
Energy: 1.279630854100038
Energy: 1.2020956942627674
Energy: 1.2899891117017246
Energy: 1.2361981271193903
Energy: 1.504084309227234
Energy: 1.2151719405629835
Energy: 1.2308086913375518
Energy: 1.6488714269343112
Energy: 1.2116554009564802
Energy: 1.366025530316005
Energy: 1.703412668047121
Energy: 1.6404407722230698
Energy: 1.3727265741424644
Energy: 1.6839628123844945
Energy: 1.428713643964209
Energy: 1.7466604294794843
Energy: 1.3801428178100386
Energy: 1.4607728727100564
Energy: 1.7238335917166274
Energy: 1.6743113114875177
Energy: 1.5203346727598144
Energy: 1.1408787894104089
Energy: 1.7538590181693712
Energy: 1.5929899120509396
Energy: 2.091103314714893
Energy: 1.6739243862734812
Energy: 1.8395179707427398
Energy: 1.9497510036897139
Energy: 1.2411924665567327
Energy: 1.2608027752531628
Energy: 1.9522044566881627
Energy: 1.2402372702395497
Energy: 1.2089590899135254
Energy: 1.1202096280886542
Energy: 1.1785781415620238
Energy: 1.1819502747002382
Energy: 1.138484555939746
Energy: 1.173477435843618
Energy: 1.2490551245528618
Energy: 1.128761622654371
Energy: 1.1519748537015133
Energy: 1.188813169661317
Energy: 1.1213100329348578
Energy: 1.0815910726931104
Energy: 1.183515023583274
Energy: 1.2037056971542373
Energy: 1.3459183110903468
Energy: 1.252528753610238
Energy: 1.2007991797920188
Energy: 1.6605846450735509
Energy: 1.2781920305511114
Energy: 2.1193598493221226
Energy: 1.6417390459830599
Energy: 1.6566018977070978
Energy: 2.119585936482825
Energy: 1.6664049662624307
Energy: 1.3763019920512343
Energy: 1.5817228270928936
Energy: 1.311698036147742
Energy: 1.3278701102762784
Energy: 1.2619710304848395
Energy: 1.164539521699408
Energy: 1.355645445464003
Energy: 1.2171441645459082
Energy: 1.368092001799392
Energy: 1.2093965908624063
Energy: 1.2128680943500407
Energy: 1.3629036841900817
Energy: 1.3077896560605216
Energy: 2.026387605854979
Energy: 1.2368739910162974
Energy: 1.2393890217474421
Energy: 1.3753969949368492
Energy: 1.241143958026954
Energy: 1.30384685868904
Energy: 1.733856134868783
Energy: 1.3418615586033698
Energy: 1.396184848816642
Energy: 1.6232064738693313
Energy: 1.3487241090009985
Energy: 1.3967003047021558
Energy: 1.651997388217307
Energy: 1.4260615969729091
Energy: 1.605222752079022
Energy: 1.6793937006828477
Energy: 1.3593834911074667
Energy: 1.6159993943133149
Energy: 1.787369095629054
Energy: 1.1256989348811126
Energy: 1.4144701172013883
Energy: 1.7572814669692063
Energy: 1.4646089704592602
Energy: 1.5434271169505125
Energy: 1.6578303728210555
Energy: 1.9648918824851156
Energy: 1.8824386557379393
Energy: 1.6402458322644407
Energy: 1.9647458998418197
Energy: 1.680393034078328
Energy: 1.154522336004659
Energy: 1.304119153780948
Energy: 1.2565850328441401
Energy: 1.1628050199233553
Energy: 1.7087985551201277
Energy: 1.1888309993695092
Energy: 1.0402473826991099
Energy: 1.2874659774900614
Energy: 1.2727475094951246
Energy: 1.0226210082398095
Energy: 1.161211041643
Energy: 1.3101126028215329
Energy: 1.5451269109724968
Energy: 1.2438823778198427
Energy: 1.2340255832391838
Energy: 1.1366557417464167
Energy: 1.2442556210019253
Energy: 1.234439232443072
Energy: 1.653856509131879
Energy: 1.3129814435556149
Energy: 1.31659263037557
Energy: 1.6566375793141885
Energy: 1.3352841742032076
Energy: 1.5881298263655685
Energy: 1.8423018406289344
Energy: 1.3059102801661897
Energy: 1.2731211120940316
Energy: 1.8445952584192784
Energy: 1.2538739918058333
Energy: 1.25633968043494
Energy: 1.0673189815553947
Energy: 1.2229101402477782
Energy: 1.2233530060269542
Energy: 1.1558055912790925
Energy: 1.2025172573041758
Energy: 1.3126361116700345
Energy: 1.3495015023885333
Energy: 1.3260466244934563
Energy: 1.3021330283423111
Energy: 1.3537038401618624
Energy: 1.2008310027725198
Energy: 1.182879503268284
Energy: 1.215283783383255
Energy: 1.2544244751587543
Energy: 1.2572155643241165
Energy: 1.22245136247955
Energy: 1.6522613009923124
Energy: 1.205274406911701
Energy: 1.355747948571637
Energy: 1.7046264058840193
Energy: 1.6757992019947199
Energy: 1.3699380028972687
Energy: 1.6654295290821008
Energy: 1.4151488776821963
Energy: 1.6087743470706775
Energy: 1.1819110949997758
Energy: 1.3867835193578615
Energy: 1.5696500074541122
Energy: 1.5540910397533534
Energy: 1.4120047128704538
Energy: 2.137562599184214
Energy: 1.4567250774512892
Energy: 1.6049882978858157
Energy: 2.079666726284239
Energy: 1.517726204319013
Energy: 1.7614475622958563

minimum gb energy = 1.0064986460988472 eV
minimum distance =  2.54299918668032 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 1.4052339828753178
Energy: 1.0967111292812393
Energy: 0.9975727351362833
Energy: 1.4091730874013304
Energy: 1.6751434746268528
Energy: 1.4512551816792272
Energy: 1.5013890732902029
Energy: 1.0769488039699113
Energy: 1.0770084929038737
Energy: 1.2915164565645052
Energy: 1.2165394998604362
Energy: 0.9984625439124113
Energy: 1.1753500427302557
Energy: 0.9808792475274521
Energy: 1.1419818998356341
Energy: 1.1748400770543799
Energy: 0.9806595816163315
Energy: 1.366643133322256
Energy: 1.1641100331276435
Energy: 1.1564988994066452
Energy: 1.2963815398297167
Energy: 1.1735034216349538
Energy: 1.1487657583961415
Energy: 1.1381907399680984
Energy: 1.0666518149287425
Energy: 1.1293247901992165
Energy: 1.3008950170457647
Energy: 1.0665843948714646
Energy: 1.1433915984708076
Energy: 1.1550589815367203
Energy: 1.0752310080254524
Energy: 1.2003819367996238
Energy: 1.2119570196400045
Energy: 1.0739669643193623
Energy: 1.2005967210299047
Energy: 1.7578788424440959
Energy: 1.500837943820133
Energy: 1.3840864409368874
Energy: 1.2465151250283812
Energy: 1.5021262628351917
Energy: 1.084207034135897
Energy: 1.1284811228282083

minimum gb energy = 0.9806595816163315 eV
minimum distance =  2.5575018196447 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 1.9289109050700377
Energy: 1.6851666877627096
Energy: 1.627959808159694
Energy: 1.9314340487017558
Energy: 1.955945373726552
Energy: 1.7999515785614264
Energy: 1.836250511390181
Energy: 1.6280435243318918
Energy: 1.606748528586932
Energy: 1.679347474135966
Energy: 1.6455750592350111
Energy: 1.4403796337222656
Energy: 1.5349059234735423
Energy: 1.549012990605457
Energy: 1.5556961613383704
Energy: 1.4173585957319994
Energy: 1.6591181802530548
Energy: 1.5630596414547957
Energy: 1.1558902008900576
Energy: 1.5204193854808166
Energy: 1.2945130583312123
Energy: 1.1579327774065376
Energy: 1.7092817402589715
Energy: 1.1764737245110193
Energy: 1.2408935512573398
Energy: 1.4671797474554416
Energy: 1.3963971051062203
Energy: 1.2194079354510823
Energy: 1.567291900081653
Energy: 1.240420481206393
Energy: 1.4038014780062238
Energy: 1.4556844066188792
Energy: 1.4557728439872264
Energy: 1.3647969871156587
Energy: 1.547281568923344
Energy: 1.5155995332490033
Energy: 1.8020938633175239
Energy: 1.4479034338090293
Energy: 1.3957027917681
Energy: 1.6277918750684377
Energy: 1.3928620998857362
Energy: 1.4791386966731277
Energy: 1.7718413875957835
Energy: 1.8182969751632256
Energy: 1.5856391643173304
Energy: 1.774736085951681
Energy: 1.8139846040053826
Energy: 1.6916776554897557
Energy: 1.697468706563746
Energy: 1.4227418775073728
Energy: 1.4768640895157912
Energy: 1.7157869596749367
Energy: 1.6583990050549402
Energy: 1.4876368502291306
Energy: 1.8075423409754603
Energy: 1.7753626375274667
Energy: 1.6482333376081435
Energy: 1.809764047170258
Energy: 1.9377627377867495
Energy: 1.8638009230782977
Energy: 1.377628741594067
Energy: 1.6102438019093663
Energy: 1.3892312423976345
Energy: 1.3796160399711352
Energy: 1.6865445705090207
Energy: 1.3502768428138887
Energy: 1.5711884704088304
Energy: 1.4726194697180754
Energy: 1.458901583756856
Energy: 1.5739132870330867
Energy: 1.5394557802045252
Energy: 1.4763545977675407
Energy: 1.5567083413047085
Energy: 1.2852714433626928
Energy: 1.2761900742183578
Energy: 1.4745388228384524
Energy: 1.2765038911637558
Energy: 1.4498617023591496
Energy: 1.8054601432670037
Energy: 1.1361984123860747
Energy: 1.133931764213163
Energy: 1.8217015752256351
Energy: 1.1439213688555814
Energy: 1.155569956168537
Energy: 1.5567546225127744
Energy: 1.271870668615284
Energy: 1.4996017611498575
Energy: 1.558799429026703
Energy: 1.2865784946443628
Energy: 1.5886444877108283
Energy: 1.7626404698887386
Energy: 1.2478155020474895
Energy: 1.271109549751937
Energy: 1.7022551644057085
Energy: 1.6433010642628763
Energy: 1.6884519256265442
Energy: 1.8881943349244308
Energy: 2.042729104785346
Energy: 1.7374549228459941
Energy: 1.8845642133839338
Energy: 2.1417124126117932
Energy: 1.8046379277882474
Energy: 1.7554022423107214
Energy: 1.4842920292342492
Energy: 1.4295500990604544
Energy: 1.7573693372864254
Energy: 1.69899736768783
Energy: 1.515732158387471
Energy: 1.9884785869638992
Energy: 1.5596372036078587
Energy: 1.6187379901059176
Energy: 1.8410183876394561
Energy: 1.6556355949706942
Energy: 1.60446106729367
Energy: 1.833184187132901
Energy: 1.3152558334336073
Energy: 1.3149956630976223
Energy: 1.971306408700641
Energy: 1.325803853044903
Energy: 1.4128301844212867
Energy: 1.6310338319245996
Energy: 1.2370670528272887
Energy: 1.306799292805963
Energy: 1.4322886176869534
Energy: 1.2533034716526152
Energy: 1.297748719982502
Energy: 1.396520547704845
Energy: 1.450214815634203
Energy: 1.523863123789091
Energy: 1.3991677318342224
Energy: 1.3805860012275277
Energy: 1.483926328512867
Energy: 1.2961256800972525
Energy: 1.3817617261209838
Energy: 1.3048875731620946
Energy: 1.2509949696365772
Energy: 1.6837600592745983
Energy: 1.3191124518076147
Energy: 1.4592977111986891
Energy: 1.7663207034388142
Energy: 1.595989898441918
Energy: 1.4604414141161672
Energy: 1.7764050647169616
Energy: 1.6623261740351483
Energy: 1.589109152747084
Energy: 1.651299960573146
Energy: 1.549849469721622
Energy: 1.5752671661189268
Energy: 1.7307713955906694
Energy: 1.5037019000662224
Energy: 2.0201169259078493
Energy: 1.6133998145582504
Energy: 1.613379592213132
Energy: 1.9797904853506387
Energy: 1.7176813389723993
Energy: 1.5053419634358007
Energy: 1.8851621186543621
Energy: 1.5413481945658531
Energy: 1.5162102303596996
Energy: 1.8669287946648467
Energy: 1.5828163446610535
Energy: 1.4680632610194317
Energy: 1.623953634662374
Energy: 1.6373720178076108
Energy: 1.5738373992375405
Energy: 1.6349893870510548
Energy: 1.5930243178509942
Energy: 1.5911231314794037
Energy: 1.3421772695963228
Energy: 1.6592839703773172
Energy: 1.5915710242125185
Energy: 1.3444877074223571
Energy: 1.6629777091109617
Energy: 1.519706072372787
Energy: 1.1895392162391665
Energy: 1.4212576674693813
Energy: 1.1902490261989698
Energy: 1.1921500028148844
Energy: 1.6117219301425163
Energy: 1.186200009124035
Energy: 1.2945805008436462
Energy: 1.5609798125272647
Energy: 1.5404651156941842
Energy: 1.2964419479381117
Energy: 1.5362832071636232
Energy: 1.4783686648120622
Energy: 1.5911868836626446
Energy: 1.4928728713457813
Energy: 1.4275794530725805
Energy: 1.6283918296471136
Energy: 1.4494393751590737
Energy: 1.480268357543807
Energy: 1.9703183819329022
Energy: 1.5259463012612449
Energy: 1.4175578502787771
Energy: 1.951786495945099
Energy: 1.519492001304992
Energy: 1.4720811440740829
Energy: 1.8598093385561207
Energy: 1.5181944446561866
Energy: 1.5199836529659814
Energy: 1.8602792566950053
Energy: 1.681520847289046
Energy: 1.5221060851710935
Energy: 1.7205201510349306
Energy: 1.5611711033721556
Energy: 1.6499968271495569
Energy: 1.7225187093815415
Energy: 1.6865889498798834
Energy: 1.6053288319440684
Energy: 1.6260965591606655
Energy: 1.7757389750933206
Energy: 1.639278550338556
Energy: 1.6277907107716187
Energy: 1.937075865058792
Energy: 1.5186953666193206
Energy: 1.5012863899762658
Energy: 1.323671168948
Energy: 1.419477244878791
Energy: 1.4249209199566752
Energy: 1.5666201615591604
Energy: 1.4603296430665604
Energy: 1.4591911503132875
Energy: 1.2809920119888094
Energy: 1.4243769844833287
Energy: 1.461979453444579
Energy: 1.2871415051057185
Energy: 1.5417640335624059
Energy: 1.742544063730794
Energy: 1.1458602889719314
Energy: 1.134933194774151
Energy: 1.7025609254641891
Energy: 1.151236082046992
Energy: 1.1334476563551295
Energy: 1.64677635847162
Energy: 1.2628139676583692
Energy: 1.2625082175043598
Energy: 1.5766430062058552
Energy: 1.2698575706270747
Energy: 1.4962249122360254
Energy: 1.7938037705576007
Energy: 1.5168156537332707
Energy: 1.499468106521875
Energy: 1.79633567203232
Energy: 1.6304563231312588
Energy: 1.57030268596566
Energy: 1.55122392039926
Energy: 1.5462083297968445
Energy: 1.4998142987100462
Energy: 1.5469369782375837
Energy: 2.176977254238821
Energy: 1.5343096763087876
Energy: 1.607297343264991
Energy: 1.8684432951611558
Energy: 1.7545703467366767
Energy: 1.697667212740472
Energy: 2.065191161832453
Energy: 1.5825176342427425
Energy: 1.8865696368104334
Energy: 1.4800563358933008
Energy: 1.4430788666510048
Energy: 1.7859921225542004
Energy: 1.7117073935075129
Energy: 1.4823634566036372
Energy: 1.6604943439244624
Energy: 1.406465431765997
Energy: 1.4372245830041506
Energy: 1.6632909392027009
Energy: 1.4190857675159412
Energy: 1.5956228377058987
Energy: 1.6942245048816644
Energy: 1.2608602189476759
Energy: 1.237264085244663
Energy: 1.668271453284167
Energy: 1.2039262427263844
Energy: 1.2149608186376728
Energy: 1.4248946721372961
Energy: 1.3530954401702395
Energy: 1.4105192766232282
Energy: 1.413542238785406
Energy: 1.3614563928655363
Energy: 1.4998368882056443
Energy: 1.4501511360937527
Energy: 1.4687399621124806
Energy: 1.4119263231395867
Energy: 1.3489940018597146
Energy: 1.4858111415005344
Energy: 1.34793101773344
Energy: 1.2644208475984993
Energy: 1.6541193219753425
Energy: 1.3651190486253404
Energy: 1.2587702096429103
Energy: 1.8818110845443503
Energy: 1.2485702294676357
Energy: 1.6948750761782867
Energy: 1.6495113826821952
Energy: 1.550867422592302
Energy: 1.6184926619890754
Energy: 1.8632278893224512
Energy: 1.7257149616497935
Energy: 1.822236438101713
Energy: 1.646433503215809
Energy: 1.6180343290271673
Energy: 1.6342808667622966
Energy: 1.7336398982659407
Energy: 1.4173424779782118

minimum gb energy = 1.1334476563551295 eV
minimum distance =  2.56784520588005 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 2.059801442615682
Energy: 1.524269406645395
Energy: 1.5168723697967932
Energy: 2.0620277012592756
Energy: 1.8537764557307783
Energy: 1.8196935707026816
Energy: 1.9047130576631228
Energy: 1.4848040038995007
Energy: 1.4511133942009138
Energy: 1.894918198351232
Energy: 1.4851508198795076
Energy: 1.292964571219348
Energy: 1.503419167308361
Energy: 1.4291382862156217
Energy: 1.4405371662211746
Energy: 1.5049935816280042
Energy: 1.4326807687515528
Energy: 1.5444534305096445
Energy: 1.2207773521910956
Energy: 1.2814383692736424
Energy: 1.3078469971147295
Energy: 1.21899192262072
Energy: 1.444179266372949
Energy: 1.199457517717008
Energy: 1.32087229395892
Energy: 1.7203074705357722
Energy: 1.2994464508899581
Energy: 1.3223076261255466
Energy: 1.7602578479868367
Energy: 1.2452409380709013
Energy: 1.58447915324407
Energy: 1.5473026568508539
Energy: 1.5453851998056682
Energy: 1.5862843128569961
Energy: 1.5475241908241517
Energy: 1.5663703474582844
Energy: 1.6190387594655347
Energy: 1.172915489394577
Energy: 1.173293641504707
Energy: 1.6156672344939111
Energy: 1.1734606223743231
Energy: 1.2451225747724983
Energy: 1.7492429747581335
Energy: 1.4496324499406565
Energy: 1.5000187582387554
Energy: 1.7514445690034972
Energy: 1.4497085869836246
Energy: 1.347689855277118
Energy: 1.5820537648695456
Energy: 1.348618802469061
Energy: 1.3162459925654997
Energy: 1.564419244073519
Energy: 1.335735642490292
Energy: 1.3624040122422727
Energy: 1.616213224038248
Energy: 1.6962966701861586
Energy: 1.6963942486132968
Energy: 1.477077981744208
Energy: 2.014322531936812
Energy: 1.6135119940039162
Energy: 1.3424589982620638
Energy: 1.6369595175200253
Energy: 1.2596689682293503
Energy: 1.3454551619215112
Energy: 1.9255149124619853
Energy: 1.3017033415280042
Energy: 1.56988455991509
Energy: 1.3874725926402796
Energy: 1.4132258458693492
Energy: 1.5529861851254352
Energy: 1.4338344910727046
Energy: 1.4038794214388688
Energy: 1.4461737441171583
Energy: 1.3737018240962553
Energy: 1.3151462310495161
Energy: 1.431836364485993
Energy: 1.3176566067974198
Energy: 1.35190678748079
Energy: 1.774291268165934
Energy: 1.2301305581857096
Energy: 1.2217248432472756
Energy: 1.7768576721776455
Energy: 1.2349190580893779
Energy: 1.2600813404628108
Energy: 1.6890814551354683
Energy: 1.7106973344693461
Energy: 1.6151284035470326
Energy: 1.690466610358821
Energy: 1.4178304294659816
Energy: 1.5788834296545808
Energy: 1.6508146713816796
Energy: 1.2196873610277836
Energy: 1.2630694820979427
Energy: 1.6504961289676272
Energy: 1.5954627064739002
Energy: 1.2353705140440543
Energy: 1.5269271553429373
Energy: 1.7506384285095444
Energy: 1.3619460197548348
Energy: 1.527186802458902
Energy: 1.7535055661304353
Energy: 1.3493579409409673
Energy: 1.0755773007311475
Energy: 1.133942056865944
Energy: 1.1209880413176958
Energy: 1.0433193260308338
Energy: 1.1328179417670872
Energy: 1.2091675440026537
Energy: 1.8357045123978113
Energy: 1.4820207753858552
Energy: 1.4495851348933522
Energy: 1.8294981777471113
Energy: 1.4819229347744487
Energy: 1.4486793970123932
Energy: 2.016284439796519
Energy: 1.3628659043324878
Energy: 1.3628410518349279
Energy: 1.8297712935497412
Energy: 1.3536547805897843
Energy: 1.3630504187757622
Energy: 1.259998541265588
Energy: 1.1227575611877632
Energy: 1.1226284428972944
Energy: 1.0416076617664611
Energy: 1.2403179105295357
Energy: 1.2447246470879478
Energy: 1.4890434829993056
Energy: 1.4572357380990177
Energy: 1.4316510883594702
Energy: 1.482655244197746
Energy: 1.457125566243368
Energy: 1.4301245845230928
Energy: 1.295444656865958
Energy: 1.2766357950862472
Energy: 1.2078191494144788
Energy: 1.2241981909347197
Energy: 1.2218412110614596
Energy: 1.222028963901467
Energy: 1.4199771872544034
Energy: 1.6103622591193578
Energy: 1.60771909508075
Energy: 1.4169757880287472
Energy: 1.692070038643192
Energy: 1.4127899638321435
Energy: 1.6355624797041322
Energy: 1.5908931338231993
Energy: 1.5130517030273714
Energy: 1.6083513397606612
Energy: 1.623204820120477
Energy: 1.5050587640049848
Energy: 1.777877381236221
Energy: 1.4592545842309244
Energy: 1.4719675577004672
Energy: 1.7791819733597904
Energy: 1.5192892152442983
Energy: 1.4927480998773228
Energy: 1.9246022508442104
Energy: 1.221319357423853
Energy: 1.258264202311204
Energy: 1.9262570951914562
Energy: 1.328598157060726
Energy: 1.2612683193512377
Energy: 1.542874257170092
Energy: 1.8746451598200133
Energy: 1.6367066779534827
Energy: 1.541924362965148
Energy: 1.9255411454413107
Energy: 1.5529148720181372
Energy: 1.4779023031976504
Energy: 1.6969442385950702
Energy: 1.6974335229738466
Energy: 1.471969595123041
Energy: 1.9911962386300452
Energy: 1.4876840387331487
Energy: 1.3945835037196408
Energy: 1.4416973017296604
Energy: 1.3611407022294144
Energy: 1.3826217335449444
Energy: 1.3247580578554146
Energy: 1.3387612106513493
Energy: 1.4562738459377256
Energy: 1.45376602591568
Energy: 1.5368012796084167
Energy: 1.4584226386394434
Energy: 1.5028723497142353
Energy: 1.4604480847245291
Energy: 1.7055903514326085
Energy: 1.2101848508368003
Energy: 1.210294453414929
Energy: 1.311105896004564
Energy: 1.2104046288700308
Energy: 1.2103148566387583
Energy: 1.8224095116516208
Energy: 1.3761640489590172
Energy: 1.3731760787731606
Energy: 1.8028034741514964
Energy: 1.3774451928043598
Energy: 1.5674159818207742
Energy: 1.680232350695951
Energy: 1.5468895835108187
Energy: 1.5441987747253134
Energy: 1.6821996880644239
Energy: 1.5835574754224873
Energy: 1.5202034496459573
Energy: 1.1693952392345868
Energy: 1.2222699140836877
Energy: 1.2404595247093606
Energy: 1.1704182715904943
Energy: 1.8343862004276716
Energy: 1.1644382006014184
Energy: 1.6263830609714447
Energy: 1.6236811788554637
Energy: 1.469569086945583
Energy: 1.3421829387804383
Energy: 1.7544089726141936
Energy: 1.675420838754403
Energy: 1.8948326919291414
Energy: 1.4966211672686824
Energy: 1.6989554078951616
Energy: 1.8954205279363388
Energy: 1.6894624339957192
Energy: 1.4698059940814872
Energy: 2.060310796188875
Energy: 1.5732472428384314
Energy: 1.5161782431573538
Energy: 2.0594828432483743
Energy: 1.590976300726514
Energy: 1.8038170209803115

minimum gb energy = 1.0416076617664611 eV
minimum distance =  2.51965474019314 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 1.9704453353992095
Energy: 1.893053771345348
Energy: 1.6042197476550195
Energy: 1.9727813698962342
Energy: 1.8449024896377797
Energy: 1.449761001231604
Energy: 1.5913074565899217
Energy: 1.2515480235213603
Energy: 1.2513621076431853
Energy: 1.5969208797954213
Energy: 1.2641114828090683
Energy: 1.2944322649695168
Energy: 1.6199574689847422
Energy: 1.551153967359558
Energy: 1.5182743933460001
Energy: 1.4766663794055424
Energy: 1.746705205723945
Energy: 1.588430999573571
Energy: 1.1881202604130239
Energy: 1.5357211622211224
Energy: 1.1676744960471543
Energy: 1.166133115555045
Energy: 1.611520143585385
Energy: 1.1667655946816766
Energy: 1.3549353419118324
Energy: 1.394271764612494
Energy: 1.3836979777161078
Energy: 1.2099050057549283
Energy: 1.3714462559231546
Energy: 1.2719761898187398
Energy: 1.471815645122426
Energy: 1.3709010463881794
Energy: 1.2737306454833786
Energy: 1.4298477625732076
Energy: 1.3684610745136536
Energy: 1.3889255405226104
Energy: 1.697394447750413
Energy: 1.152118491429355
Energy: 1.151794268527049
Energy: 1.556880469373856
Energy: 1.1523070044416999
Energy: 1.150519147617493
Energy: 1.669936954638602
Energy: 1.2973658281628022
Energy: 1.5160009608391765
Energy: 1.6717926081466772
Energy: 1.4140773594169633
Energy: 1.616338875401128
Energy: 1.5491446611088926
Energy: 1.256961480402627
Energy: 1.2286452312169729
Energy: 1.5497630798277524
Energy: 1.5221008881079894
Energy: 1.2774957889507386
Energy: 1.7724003129265762
Energy: 1.8028519769753655
Energy: 1.68790900073383
Energy: 1.7722747224027802
Energy: 2.012633606883555
Energy: 1.560628693225322
Energy: 1.5382002378736521
Energy: 1.5199141589631866
Energy: 1.51349203555066
Energy: 1.5361823408368713
Energy: 1.9239910348360094
Energy: 1.5105878072092203
Energy: 1.6538635664937997
Energy: 1.5589048421208411
Energy: 1.3266320754365801
Energy: 1.6817286807630172
Energy: 1.5587004634920825
Energy: 1.2773221927238818
Energy: 1.898070801354702
Energy: 1.344844847857915
Energy: 1.311929969944119
Energy: 1.7918305100169807
Energy: 1.345663444468701
Energy: 1.3456362971729243
Energy: 1.653111919235791
Energy: 1.305665918900806
Energy: 1.2969775266900236
Energy: 1.5558632439942714
Energy: 1.2394860554730978
Energy: 1.3139839090463878
Energy: 1.2896860622191444
Energy: 1.510458656925989
Energy: 1.4999540072698625
Energy: 1.289737012408404
Energy: 1.4374450082610206
Energy: 1.5108195048385848
Energy: 1.118131777539303
Energy: 1.3486090738778118
Energy: 1.1183487167136172
Energy: 1.1203826347847388
Energy: 1.4877094590138342
Energy: 1.1188351503301677
Energy: 1.3166518200861694
Energy: 1.4605691732175143
Energy: 1.4611978350642416
Energy: 1.3135691990288927
Energy: 1.5335638116294799
Energy: 1.272889175766436
Energy: 1.5317161107522321
Energy: 1.4979221866993584
Energy: 1.525116939642229
Energy: 1.4747275520281227
Energy: 1.4727125135108894
Energy: 1.3403961736571819
Energy: 1.9349497748720708
Energy: 1.419688509743139
Energy: 1.4199902849558845
Energy: 1.8990250276624165
Energy: 1.4197025966583268
Energy: 1.3920778580316178
Energy: 1.9219695039896338
Energy: 1.6089456141440115
Energy: 1.5293996786637645
Energy: 1.8417119858846314
Energy: 1.596506610876805
Energy: 1.506447514030022
Energy: 1.5257028620518343
Energy: 1.3860652869537917
Energy: 1.5192862928185396
Energy: 1.5302712992512402
Energy: 1.5929388226437087
Energy: 1.352595972538849
Energy: 1.5866957747031925
Energy: 1.6674377903820754
Energy: 1.5937675429680822
Energy: 1.5867058179422697
Energy: 1.7997501657659796
Energy: 1.485607894003293
Energy: 1.4030648670765242
Energy: 1.3796391924436295
Energy: 1.3525657472168404
Energy: 1.354358860734938
Energy: 1.5355370651826896
Energy: 1.369092657928332
Energy: 1.5967597647019753
Energy: 1.4481774060441361
Energy: 1.5255751485512001
Energy: 1.57056323357764
Energy: 1.4494048193310316
Energy: 1.5108908786190167
Energy: 1.6780222204119375
Energy: 1.1196669518188216
Energy: 1.1186884691592287
Energy: 1.6439051351717815
Energy: 1.1196642041862175
Energy: 1.1176956731188297
Energy: 1.5954250627450515
Energy: 1.211054562240829
Energy: 1.2394109772573276
Energy: 1.5649811587826756
Energy: 1.2098211736996132
Energy: 1.3299569369576987
Energy: 1.5353437278240596
Energy: 1.3667594254515767
Energy: 1.4264990115671028
Energy: 1.4231978686548314
Energy: 1.3487550013338645
Energy: 1.4134995426417674
Energy: 1.2247258251348134
Energy: 1.36731126892652
Energy: 1.3540776183785463
Energy: 1.2228678766819139
Energy: 1.586351747072163
Energy: 1.2205026237761603
Energy: 1.6371408657156397
Energy: 1.614518640043465
Energy: 1.58440930890109
Energy: 1.592550121910636
Energy: 1.726977222376536
Energy: 1.5639582377161092
Energy: 1.5972416998362198
Energy: 1.2642363156825884
Energy: 1.2510469965317375
Energy: 1.5961404978110167
Energy: 1.3026252942257022
Energy: 1.2900005287664733
Energy: 1.971552882156382
Energy: 1.946773848464375
Energy: 1.6931091730506087
Energy: 1.97564886156062
Energy: 1.9254939894094745
Energy: 1.5773703868235749

minimum gb energy = 1.1176956731188297 eV
minimum distance =  2.57178601175851 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.5622164185810683
Energy: 1.3175664863792789
Energy: 1.3141147439734226
Energy: 1.5641038495218271
Energy: 1.7576208769527049
Energy: 1.6888519869472471
Energy: 1.7038122680088783
Energy: 1.1392491778194747
Energy: 1.1398154058222316
Energy: 1.4355864064741766
Energy: 1.1437841300194298
Energy: 1.230359426966888
Energy: 1.452907431400378
Energy: 1.3570569903795993
Energy: 1.357697900071329
Energy: 1.4546446731001994
Energy: 1.4764532748955004
Energy: 1.4344438296683164
Energy: 1.1358642991596897
Energy: 1.4281098651375994
Energy: 1.411877037012837
Energy: 1.1173600838115294
Energy: 1.4838840160114135
Energy: 1.1259918192258547
Energy: 1.2869426384613056
Energy: 1.36342101957824
Energy: 1.3401056102713045
Energy: 1.28906563944895
Energy: 1.44736777971592
Energy: 1.239881869581087
Energy: 1.3523893716774829
Energy: 1.271180101418068
Energy: 1.271330558003788
Energy: 1.4315211090314293
Energy: 1.3243756839252145
Energy: 1.2923975668401602
Energy: 1.565031095604385
Energy: 1.1155216552469063
Energy: 1.1156958317031234
Energy: 1.567198935493737
Energy: 1.1198274034221392
Energy: 1.1161780271504544
Energy: 1.4455227666688615
Energy: 1.5577027056285222
Energy: 1.533001795009619
Energy: 1.4461735195188974
Energy: 1.2807310833825312
Energy: 1.4528008338887388
Energy: 1.4693303891726537
Energy: 1.2213695273057994
Energy: 1.2218993803756486
Energy: 1.5677334359868933
Energy: 1.3297480127335588
Energy: 1.2206741668208976
Energy: 1.61783703372109
Energy: 1.5061193750956383
Energy: 1.3412811941805542
Energy: 1.6187569635569758
Energy: 1.7953191420930097
Energy: 1.491010503220175
Energy: 1.444181134791623
Energy: 1.2751385013257088
Energy: 1.2299083947818432
Energy: 1.4448029619479625
Energy: 1.4692743806167208
Energy: 1.2580333168642905
Energy: 1.736071073265934
Energy: 1.4403323717256509
Energy: 1.2269704457933515
Energy: 1.7374230476696444
Energy: 1.3321360254252739
Energy: 1.2374330059240686
Energy: 1.884367033900851
Energy: 1.2871664737084172
Energy: 1.418644641664432
Energy: 1.4141638652460018
Energy: 1.2045159962710048
Energy: 1.449866793257886
Energy: 1.6648656184012436
Energy: 1.139502058188791
Energy: 1.2319788786288177
Energy: 1.622020613348549
Energy: 1.1403872023580413
Energy: 1.3182168894805633
Energy: 1.4365296733777884
Energy: 1.5634300765137272
Energy: 1.415842078853386
Energy: 1.4374814104336333
Energy: 1.5680132189639302
Energy: 1.386063187473974
Energy: 1.1153053403646318
Energy: 1.1360478053999499
Energy: 1.1400688975889681
Energy: 1.1169969377187783
Energy: 1.3549086727358295
Energy: 1.1506900814982246
Energy: 1.4656414307614356
Energy: 1.4380645962967102
Energy: 1.364098672163211
Energy: 1.3646827036411202
Energy: 1.471230147459707
Energy: 1.3433373175116061
Energy: 1.3356050316174395
Energy: 1.1265635952110218
Energy: 1.2438684919391756
Energy: 1.3312296602533589
Energy: 1.1266307140530976
Energy: 1.2662822983648834
Energy: 1.5821086338858086
Energy: 1.1281976001480332
Energy: 1.1187581374585465
Energy: 1.568141991720531
Energy: 1.1281360618245537
Energy: 1.2274639207510327
Energy: 1.746739112894978
Energy: 1.4325868297168134
Energy: 1.2996421494956598
Energy: 1.2358519649362834
Energy: 1.4570628854466772
Energy: 1.294986621231406
Energy: 1.265783912455675
Energy: 1.2103554316370833
Energy: 1.2208405868217052
Energy: 1.2653914196372082
Energy: 1.33120131681785
Energy: 1.1792063808180548
Energy: 1.8065389786783053
Energy: 1.5886263723579037
Energy: 1.3702952278464315
Energy: 1.8066395987895327
Energy: 1.7920797328648443
Energy: 1.3553502365280914
Energy: 1.657051452787862
Energy: 1.1394914156675235
Energy: 1.2313126351817392
Energy: 1.6588358430273842
Energy: 1.32899438222663
Energy: 1.1397860268597806
Energy: 1.884363462629103
Energy: 1.4884290919864092
Energy: 1.4186748953486483
Energy: 1.4823998625399826
Energy: 1.4406687065633756
Energy: 1.449819264415917

minimum gb energy = 1.1153053403646318 eV
minimum distance =  2.5081777934086 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.6884180119858616
Energy: 1.2896650249798682
Energy: 1.2855365124877103
Energy: 1.6912690818748695
Energy: 1.5700958988342901
Energy: 1.2803130973990944
Energy: 1.4349667995672652
Energy: 1.3601976652817553
Energy: 1.3094799517716489
Energy: 1.4688478422999705
Energy: 1.3459146198460334
Energy: 1.2399534993675474
Energy: 1.5337565509733708
Energy: 1.2523678059047068
Energy: 1.1600412119828176
Energy: 1.4197429574471299
Energy: 1.3388333679786606
Energy: 1.2641797488017386
Energy: 1.148181127126971
Energy: 1.2772201094160773
Energy: 1.1598026123800105
Energy: 1.1490430138615593
Energy: 1.3880018678182935
Energy: 1.204303991786768
Energy: 1.2181506149821133
Energy: 1.2494667870287006
Energy: 1.2273179946764767
Energy: 1.213329888355311
Energy: 1.4642740864703325
Energy: 1.228166149262731
Energy: 1.5256962445329738
Energy: 1.0511054705494791
Energy: 1.2043343718901633
Energy: 1.4620720572826211
Energy: 1.0504145099490232
Energy: 1.2300411830607922
Energy: 1.2993765113227989
Energy: 0.9761221803260776
Energy: 0.9761109929225162
Energy: 1.2992413674498038
Energy: 0.9775864402300483
Energy: 0.9768321063280285
Energy: 1.4013480235482731
Energy: 1.401149581893913
Energy: 1.275893766612688
Energy: 1.4033985402050235
Energy: 1.4004446036777976
Energy: 1.1969334157352431
Energy: 0.9795221083345318
Energy: 1.2864506313285897
Energy: 1.1166429764045482
Energy: 0.9813392089516573
Energy: 1.373371207679872
Energy: 0.9771546571842921
Energy: 1.0511835075652818
Energy: 1.2547263596821108
Energy: 1.24484110379941
Energy: 1.0502705212579941
Energy: 1.3382052196494936
Energy: 1.2253322301086487
Energy: 1.4844868721336724
Energy: 1.3165197024604705
Energy: 1.2157459724276116
Energy: 1.3696871971299494
Energy: 1.2921457214768486
Energy: 1.2156865090635038
Energy: 1.4711681346638776
Energy: 1.120182099329064
Energy: 1.119924903063485
Energy: 1.446707948957042
Energy: 1.1203310591867108
Energy: 1.1456910484345826
Energy: 1.6775119457970071
Energy: 1.4321119215568023
Energy: 1.349452227863295
Energy: 1.6795180389178772
Energy: 1.4220091835582152
Energy: 1.463294717870023
Energy: 1.3634003561129684
Energy: 1.3119114234294391
Energy: 1.2238772249894245
Energy: 1.4281479435406037
Energy: 1.4472473494182039
Energy: 1.4113854286878769
Energy: 1.5482082580473537
Energy: 1.2649932329107185
Energy: 1.3503919409108223
Energy: 1.5483778357875528
Energy: 1.2688489557031581
Energy: 1.284196150083707
Energy: 1.4769096122986283
Energy: 1.3997188170700317
Energy: 1.2394392191771768
Energy: 1.4785057933419585
Energy: 1.6479754402486109
Energy: 1.3255033166974204
Energy: 1.7661108410819422
Energy: 1.4091054512482992
Energy: 1.3363505430555882
Energy: 1.6046521240834852
Energy: 1.481140945047934
Energy: 1.3344154390522456

minimum gb energy = 0.9761109929225162 eV
minimum distance =  2.5432336787495 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.7506268683346433
Energy: 1.2235058615254795
Energy: 1.198772783970564
Energy: 1.7544749413262046
Energy: 1.5422761238921192
Energy: 1.2009369774819614
Energy: 1.4682254370797014
Energy: 1.2409666801335877
Energy: 1.2374933859258852
Energy: 1.2717040604049197
Energy: 1.2870793569690704
Energy: 1.1752288213340545
Energy: 1.4043442529482086
Energy: 1.1752935493955652
Energy: 1.0898276526564925
Energy: 1.3181317158897583
Energy: 1.5408441121934189
Energy: 1.006201740015898
Energy: 1.0928087503551358
Energy: 1.0864925238164078
Energy: 1.089946769239362
Energy: 1.0944760419814685
Energy: 1.3833913548312013
Energy: 1.1293723917018992
Energy: 1.3181980913328468
Energy: 1.3261902597782524
Energy: 1.1568018881486768
Energy: 1.31888091989339
Energy: 1.3828076267798937
Energy: 1.1593025635082106
Energy: 1.582119987021328
Energy: 0.9842102594340998
Energy: 1.1778937025077334
Energy: 1.5370552057820082
Energy: 0.984558723770623
Energy: 1.1058288028486076
Energy: 1.3602408923513947
Energy: 0.9372006170082128
Energy: 0.9375043731825337
Energy: 1.3190541449450317
Energy: 0.9406043093109966
Energy: 1.0004805336578941
Energy: 1.326060833268663
Energy: 1.2592798132017857
Energy: 1.143064069231222
Energy: 1.325731071253772
Energy: 1.4507486360362545
Energy: 1.2073556795690463
Energy: 0.8838918627200191
Energy: 1.1469852161094864
Energy: 0.9037705846041653
Energy: 0.8850510763298969
Energy: 1.3192927131513845
Energy: 0.9012974653380357
Energy: 0.9453577113372615
Energy: 1.1928205532676885
Energy: 1.0977549136103062
Energy: 0.9390715481327921
Energy: 1.3818747518297088
Energy: 1.0800182419661564
Energy: 1.4318087980705505
Energy: 0.9380662133982085
Energy: 1.0806202825959574
Energy: 1.3954043188894087
Energy: 0.9396517630658899
Energy: 1.0798910658440117
Energy: 1.3804617305604943
Energy: 0.9000245853569016
Energy: 0.9001937045287333
Energy: 1.27802693566846
Energy: 0.9044317827824183
Energy: 1.0191079393747606
Energy: 1.5244310086840895
Energy: 1.2959724616979205
Energy: 1.1131691854472174
Energy: 1.1512211241931454
Energy: 1.2979250568385108
Energy: 1.100067892682433
Energy: 0.9370958508597189
Energy: 1.1843606905724917
Energy: 1.1831637475433152
Energy: 0.9384054298421326
Energy: 1.3125524506091575
Energy: 0.9376709692699927
Energy: 0.9843981022100367
Energy: 1.379551450366338
Energy: 1.1220311399151144
Energy: 0.9832225212913905
Energy: 1.4602289949620395
Energy: 1.1538124220660952
Energy: 1.3972299494642952
Energy: 1.140417632623477
Energy: 1.1266420568123618
Energy: 1.3984020342423376
Energy: 1.1193544553609647
Energy: 1.123695131874876
Energy: 1.6167426209314242
Energy: 1.0917933057688474
Energy: 1.0916917840838267
Energy: 1.5209899244592033
Energy: 1.0973945572292867
Energy: 1.2265898687379895
Energy: 1.6110034638565163
Energy: 1.3241193542389778
Energy: 1.1751887916779564
Energy: 1.5120888771792451
Energy: 1.3161847023515583
Energy: 1.2081725410992186
Energy: 1.2727435982438227
Energy: 1.2155318933514514
Energy: 1.1660057225915577
Energy: 1.2812252206343306
Energy: 1.508444517154856
Energy: 1.3262180519258098
Energy: 1.3636538316824087
Energy: 1.1623867573000057
Energy: 1.1676895155904088
Energy: 1.3890918053068253
Energy: 1.6452113742517263
Energy: 1.182173492271482
Energy: 1.3875817924756588
Energy: 1.3315030925670648
Energy: 1.1686759697705666
Energy: 1.3824237443723384
Energy: 1.5240006104729908
Energy: 1.2723849454700686
Energy: 1.8092257325684378
Energy: 1.2945731096531556
Energy: 1.257193597371378
Energy: 1.3251030484906976
Energy: 1.3220105812931295
Energy: 1.0973563757755471
Energy: 1.6086691616980042
Energy: 1.2393652647274465
Energy: 1.2377264337879323
Energy: 1.3599234532426416
Energy: 1.2926014886870218
Energy: 1.173747225849502
Energy: 1.4175270871195131
Energy: 1.2910291902020419
Energy: 1.2540113921556695
Energy: 1.419794132825814
Energy: 1.3688892972165931
Energy: 1.0917022528377025
Energy: 1.0998091729520585
Energy: 1.1716974930304649
Energy: 1.172615024107785
Energy: 1.0998456780079549
Energy: 1.5725344325711543
Energy: 1.1726867504682608
Energy: 1.0725570664312316
Energy: 1.2074362488423773
Energy: 1.1856804543137405
Energy: 1.1222457763111893
Energy: 1.4228894464479114
Energy: 1.091610919939119
Energy: 1.5836555098444458
Energy: 1.2656290031037092
Energy: 1.1968603152864243
Energy: 1.5863201468057608
Energy: 1.2811951794787344
Energy: 1.1062529980845635
Energy: 1.29862814274714
Energy: 0.9373272719127399
Energy: 0.9686814583229063
Energy: 1.3007747091879818
Energy: 0.9399244754485959
Energy: 0.9684517551693331
Energy: 1.350425947279825
Energy: 1.101429122497429
Energy: 1.0962002685647063
Energy: 1.3021543609811126
Energy: 1.0468960722281209
Energy: 1.1086016654327888
Energy: 0.9344121363877983
Energy: 1.1443238750712603
Energy: 1.1332053705230398
Energy: 0.9355544614193468
Energy: 1.4178611249556032
Energy: 1.009377407013419
Energy: 0.907285647380168
Energy: 1.1328901238094478
Energy: 1.136429933442197
Energy: 0.9081825756708267
Energy: 1.33516077374869
Energy: 1.0254735105967223
Energy: 1.3524581776519757
Energy: 1.1284563102958467
Energy: 1.1254374475728763
Energy: 1.3556065659159604
Energy: 1.0645805150444319
Energy: 1.1493864949932469
Energy: 1.311659569785442
Energy: 0.8893095329067494
Energy: 0.8828503806251776
Energy: 1.2923890247339276
Energy: 0.8838506588401552
Energy: 0.8831850546176577
Energy: 1.457504329937956
Energy: 1.0121580652169573
Energy: 1.0959546300238885
Energy: 1.4608914100584862
Energy: 0.9332795768847897
Energy: 1.1121735075364239
Energy: 0.945451283380517
Energy: 1.1689853586342926
Energy: 1.141540295348851
Energy: 0.9374225551655594
Energy: 1.4432989035774586
Energy: 1.1595783847042762
Energy: 0.9752534710820834
Energy: 1.1703045453952665
Energy: 1.087454414576561
Energy: 0.9765650303824577
Energy: 1.279740594623927
Energy: 0.9682829290227314
Energy: 1.3921424843946841
Energy: 1.1318520318298475
Energy: 1.1278472984426187
Energy: 1.388721948488311
Energy: 1.2335209360644779
Energy: 1.1313577056407185
Energy: 1.3349283946629853
Energy: 1.0775849574981387
Energy: 1.077461424399172
Energy: 1.3223794899264796
Energy: 1.079634766322234
Energy: 1.0909503633235718
Energy: 1.689273722502441
Energy: 1.2970337303368622
Energy: 1.2079933563658438
Energy: 1.64637308183098
Energy: 1.301292436654834
Energy: 1.139538589806799
Energy: 1.332168456303387
Energy: 1.2716575260155216
Energy: 1.1662864380055546
Energy: 1.3983614897262793
Energy: 1.474016660446523
Energy: 1.1650469977999711
Energy: 1.2822655714957765
Energy: 1.2191190058333683
Energy: 1.166751153908338
Energy: 1.3036031627119462
Energy: 1.7361152936803643
Energy: 1.262633943465729
Energy: 1.3632480805464007
Energy: 1.2748144130855243
Energy: 1.170565599599005
Energy: 1.36454919826654
Energy: 1.342022637571491
Energy: 1.2635424180168122
Energy: 1.4880764231706436
Energy: 1.322163291379336
Energy: 1.2382411730554146
Energy: 1.367838944812576
Energy: 1.3667535128285746
Energy: 1.1737716765936894

minimum gb energy = 0.8828503806251776 eV
minimum distance =  2.5677648444755 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 1.5785546446687302
Energy: 1.1542869236672042
Energy: 1.12835688684549
Energy: 1.5803443536965884
Energy: 1.4488593484786427
Energy: 1.130851842916578
Energy: 1.4239223563744425
Energy: 1.171402512398388
Energy: 1.1744471377949812
Energy: 1.2078649841190818
Energy: 1.2069844804065901
Energy: 1.1605646651954127
Energy: 1.2986229508286264
Energy: 1.1090787482961662
Energy: 1.1066275105695151
Energy: 1.2292713679950678
Energy: 1.2582982705138785
Energy: 1.1428433384346508
Energy: 1.0417580946776666
Energy: 1.1080657445220623
Energy: 1.0255979650582636
Energy: 1.0421126438675083
Energy: 1.1685566827898295
Energy: 1.053822929222675
Energy: 1.1948185612683586
Energy: 1.230269404616409
Energy: 1.0717880868651515
Energy: 1.196285199287963
Energy: 1.273682537295492
Energy: 1.111379801397807
Energy: 1.4881347274156467
Energy: 0.9360834106769752
Energy: 1.043246860686546
Energy: 1.4512366633511755
Energy: 0.9356544903763101
Energy: 1.0464671336307156
Energy: 1.2779885655695868
Energy: 0.9091953826043965
Energy: 0.9018462690140923
Energy: 1.236579262794645
Energy: 0.908044785386982
Energy: 1.0447966054202067
Energy: 1.2124427911339222
Energy: 1.0381627333235244
Energy: 1.0672200518784074
Energy: 1.2144626541411834
Energy: 1.2882781010328035
Energy: 1.1092642274834845
Energy: 0.8624550693230764
Energy: 1.0765075289901656
Energy: 0.8621810182850718
Energy: 0.864641047699808
Energy: 1.169833977941655
Energy: 0.8613535580410788
Energy: 0.8973566664845681
Energy: 1.0548057844347432
Energy: 0.9985940330076584
Energy: 0.9395740423089968
Energy: 1.239736973728833
Energy: 1.009957612185555
Energy: 1.3742717597719427
Energy: 0.8493901750645437
Energy: 0.9903295715875633
Energy: 1.376706647765557
Energy: 0.8599794264018086
Energy: 1.0174809500185225
Energy: 1.2582541912624436
Energy: 0.8322868079211445
Energy: 0.8235630657736488
Energy: 1.190656105902668
Energy: 0.8310069390274181
Energy: 0.9353693339584624
Energy: 1.3218615358743055
Energy: 1.0668223980792462
Energy: 1.026880613176962
Energy: 1.2949443260421443
Energy: 1.2598798757045375
Energy: 1.0759779790062094
Energy: 0.8103282745971718
Energy: 1.0523054341434852
Energy: 0.8093430804240966
Energy: 0.812334743918556
Energy: 1.1664996625956552
Energy: 0.8095015037170115
Energy: 0.8480355645676265
Energy: 0.9814586656755593
Energy: 1.0255541906008154
Energy: 0.8490802690158565
Energy: 1.3681302220207765
Energy: 1.007844950390831
Energy: 1.2971403111469755
Energy: 0.8723699878021318
Energy: 1.0087140880646575
Energy: 1.2717553718754626
Energy: 0.8698920077279739
Energy: 1.007088814493377
Energy: 1.4067643473343068
Energy: 0.8719221730739994
Energy: 0.862094262395831
Energy: 1.3387858502406773
Energy: 0.8674734765505233
Energy: 1.0530865742712567
Energy: 1.4178704422576065
Energy: 1.2156131558876975
Energy: 1.0295684814292976
Energy: 1.3366306969627144
Energy: 1.2336088190211143
Energy: 1.0350125655518934
Energy: 0.9112284638842834
Energy: 1.1316083650433706
Energy: 0.9168692782540407
Energy: 0.9132187664069978
Energy: 1.2055657105032735
Energy: 0.9113179019244194
Energy: 1.1833284723683464
Energy: 1.024446549954545
Energy: 1.0482612316685114
Energy: 1.1859316226439673
Energy: 1.4982901625185898
Energy: 1.0540104509305381
Energy: 1.344365644522181
Energy: 1.0734278515220868
Energy: 1.0678534337604872
Energy: 1.345913170633602
Energy: 1.0711464503656267
Energy: 1.0632501988662584
Energy: 1.5748636743908122
Energy: 1.0510998178090947
Energy: 1.0145001041255814
Energy: 1.5325162111108226
Energy: 1.0476424166449712
Energy: 1.0923843889120937
Energy: 1.4744815745318358
Energy: 1.1745064368787255
Energy: 1.1101629076601636
Energy: 1.238928901854671
Energy: 1.2307481007865024
Energy: 1.1018911830104916
Energy: 1.2046424471006758
Energy: 1.222968665817296
Energy: 1.2417922700291557
Energy: 1.2057567573537056
Energy: 1.34675786183878
Energy: 1.2433055595967086
Energy: 1.3029949265742042
Energy: 1.0658179867495605
Energy: 1.0655106272619388
Energy: 1.3024643309115655
Energy: 1.053814507495483
Energy: 1.1725456280855777
Energy: 1.3779876330045857
Energy: 1.207874947893946
Energy: 1.1170650910790938
Energy: 1.3456225252401595
Energy: 1.331527536553901
Energy: 1.1716823303612456
Energy: 1.6460779480823478
Energy: 1.2259648016472298
Energy: 1.0448352819289468
Energy: 1.6479875963412138
Energy: 1.222406888169221
Energy: 1.099548183520018

minimum gb energy = 0.8093430804240966 eV
minimum distance =  2.53618967950771 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 1.4668487509313242
Energy: 1.0036026076398123
Energy: 0.9814237232703753
Energy: 1.4687733149463087
Energy: 1.130138913375187
Energy: 0.927835289991657
Energy: 1.1763733495592905
Energy: 0.9987199064986224
Energy: 0.9365285316338465
Energy: 1.159280070019225
Energy: 1.0299108644242607
Energy: 0.9841798262981967
Energy: 1.0969489929364575
Energy: 0.9036631156058256
Energy: 0.9352666774178119
Energy: 1.0471437085903212
Energy: 1.089627805576013
Energy: 0.9232199696738816
Energy: 0.9054971113517952
Energy: 0.9352965649505263
Energy: 0.9351378860126637
Energy: 0.9067065972758783
Energy: 1.1889919376853466
Energy: 0.9115813968621495
Energy: 1.011003740211672
Energy: 0.9720778585995727
Energy: 0.8959745450340508
Energy: 1.0131013876536181
Energy: 1.0736746405854778
Energy: 0.9300671378725524
Energy: 1.4006591470562035
Energy: 0.8134444359190636
Energy: 0.8906391596802421
Energy: 1.3741475635894307
Energy: 0.8136024388882961
Energy: 0.860641469969343
Energy: 1.1006253786497595
Energy: 0.8097362390766396
Energy: 0.8597041373566375
Energy: 1.0848104092244975
Energy: 0.8095584970319744
Energy: 0.9403330025139767
Energy: 1.0408949134028398
Energy: 0.882315151728407
Energy: 0.9005129216481695
Energy: 1.0428722366230203
Energy: 1.1233844644904558
Energy: 0.8949753377515448
Energy: 0.7567567393093926
Energy: 0.8674647947559004
Energy: 0.7553882539464678
Energy: 0.7582989106187601
Energy: 1.1567465229423186
Energy: 0.7557060395449116
Energy: 0.9906066224132006
Energy: 1.0272320313058496
Energy: 0.8924313452905466
Energy: 0.946773460198344
Energy: 1.1177254972320763
Energy: 0.8827443916053704
Energy: 1.311140201199261
Energy: 0.731847256930301
Energy: 0.7315397497713
Energy: 1.3159024834242925
Energy: 0.7315717864186253
Energy: 0.8419805481868514
Energy: 1.1509029758995408
Energy: 0.7069451258764222
Energy: 0.7071155183266967
Energy: 0.991936592295011
Energy: 0.7072386150046787
Energy: 0.8764152065795916
Energy: 1.1070027276003371
Energy: 0.8595997615162213
Energy: 0.8875229767528524
Energy: 1.0923739102499679
Energy: 0.8449776306734049
Energy: 0.8642549817950704
Energy: 0.687314142604645
Energy: 0.9470021091894187
Energy: 0.7031948103769552
Energy: 0.689318330409074
Energy: 0.9698744010739914
Energy: 0.687485802507361
Energy: 1.0755930416133823
Energy: 0.9841048917465254
Energy: 0.9471839641927949
Energy: 1.0191247323806507
Energy: 1.1075734767826078
Energy: 0.8791147461183829
Energy: 1.2378327543680334
Energy: 0.7003193582200198
Energy: 0.6945815068554806
Energy: 1.1771800402787218
Energy: 0.7004245907146515
Energy: 0.851190558517868
Energy: 1.1448410480675801
Energy: 0.6961221088072819
Energy: 0.6957855890580431
Energy: 1.0967247170673857
Energy: 0.6954050429868991
Energy: 0.8499914586147095
Energy: 1.0884567480874676
Energy: 0.9488318223861462
Energy: 0.9462889200375262
Energy: 1.0387188025432654
Energy: 1.1457583291755469
Energy: 0.8961493005135468
Energy: 0.6782824215498353
Energy: 1.0283204872739864
Energy: 0.67830294761274
Energy: 0.6794519993133735
Energy: 0.9769758527081499
Energy: 0.6786012448924731
Energy: 1.0858907638550452
Energy: 0.9345831486234667
Energy: 0.9026426059945648
Energy: 1.0437304833033698
Energy: 1.2294401943482658
Energy: 0.9101302002698032
Energy: 1.119966928442385
Energy: 0.7068158041744462
Energy: 0.7064451583056829
Energy: 1.090601632264187
Energy: 0.7059393481138836
Energy: 0.8576004818025746
Energy: 1.2981851981533665
Energy: 0.7035139847777878
Energy: 0.7033096032959205
Energy: 1.1877908435901752
Energy: 0.7040366917104074
Energy: 0.8603707090570323
Energy: 1.1273496012082918
Energy: 0.9704634077764922
Energy: 0.9037391658747389
Energy: 1.0691090741239835
Energy: 1.0558995481990388
Energy: 0.8879959722825254
Energy: 0.7142397507721185
Energy: 1.0143095355406584
Energy: 0.7223144407468594
Energy: 0.716141220962046
Energy: 0.9780829460979662
Energy: 0.7142839356163959
Energy: 1.0709975119123087
Energy: 0.8645377334520866
Energy: 0.8373941022844708
Energy: 1.0711094549819844
Energy: 0.8498089446652638
Energy: 0.8375349528041449
Energy: 1.1526031803564032
Energy: 0.7479014997171256
Energy: 0.7479785547846324
Energy: 1.0078186427520375
Energy: 0.7483416223584763
Energy: 0.9150968778420041
Energy: 1.3573947039395404
Energy: 0.764130172259786
Energy: 0.7645688954288639
Energy: 1.3591494808689937
Energy: 0.7638508062451055
Energy: 0.8523379741209598
Energy: 1.0784955652740424
Energy: 1.0927586980480208
Energy: 0.8641427875281337
Energy: 0.9906315952292922
Energy: 1.1270178583876191
Energy: 0.8562894096558772
Energy: 0.8110436328396471
Energy: 0.8840538711701527
Energy: 0.8094382633539858
Energy: 0.8127022858473798
Energy: 1.2130900746929372
Energy: 0.8095312168557568
Energy: 1.0284471656856977
Energy: 0.8914692168099908
Energy: 0.9162155842298757
Energy: 1.0302039943874726
Energy: 1.1710898550500999
Energy: 0.9096208533905593
Energy: 1.1506983796377661
Energy: 0.9013820949650296
Energy: 0.9883568680047667
Energy: 1.1264884944481517
Energy: 0.9082808355925321
Energy: 0.9275107588884648
Energy: 1.4554299302780187
Energy: 0.9011740717197874
Energy: 0.9301292849327091
Energy: 1.428692255920569
Energy: 0.9009809799424046
Energy: 0.8788544527048473
Energy: 1.0327446360279242
Energy: 0.9471711349099107
Energy: 0.936458332769318
Energy: 1.0271415895342992
Energy: 1.0441334930237542
Energy: 0.9409689202086786
Energy: 1.039218220730798
Energy: 0.9728771556966039
Energy: 0.9698205580221044
Energy: 1.0450179129488664
Energy: 1.2490174140560835
Energy: 0.9024865430577228
Energy: 1.0975684833278088
Energy: 0.9212665934032157
Energy: 0.9016212977316209
Energy: 1.0988754454007477
Energy: 1.1616362718571152
Energy: 0.8853970783276497
Energy: 1.1620948737206982
Energy: 1.0504165715258829
Energy: 0.9413840033895676
Energy: 1.1132426558381863
Energy: 1.0781244760339894
Energy: 0.9401474275737903

minimum gb energy = 0.6782824215498353 eV
minimum distance =  2.55081590224911 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.04913351789751619
Energy: 0.48331575762384554
Energy: 0.049966466558771114
Energy: 0.05198435344649984
Energy: 0.07930822177462545
Energy: 0.04975135702755457
Energy: 0.5914600746949481
Energy: 0.050344110141736564
Energy: 0.05039404650110908
Energy: 0.05029188538076072
Energy: 0.052164479034174656
Energy: 0.12312416056120484
Energy: 0.6023059311139564
Energy: 0.04978586144688643
Energy: 0.0500150260301895
Energy: 0.6027949571535336
Energy: 0.04982051159961041
Energy: 0.09398968018990514
Energy: 0.0520149163482788
Energy: 0.04977862026959315
Energy: 0.05057183890564595
Energy: 0.05004126861146474
Energy: 0.04973590308746194
Energy: 0.0944962895193376
Energy: 0.0937376870375046
Energy: 0.5946776000175328
Energy: 0.5951568039641078
Energy: 0.094966284673143
Energy: 0.5979316022781407
Energy: 0.04998242377498856
Energy: 0.050559240024037694
Energy: 0.12178078966693985
Energy: 0.05201480550809917
Energy: 0.05221651843442475
Energy: 0.12264933574414702
Energy: 0.04989700264440483
Energy: 0.5948688879500998
Energy: 0.04993918517182072
Energy: 0.050112268305885756
Energy: 0.6470398314586192
Energy: 0.050063865940851916
Energy: 0.12281932246836083
Energy: 0.5946673890931853
Energy: 0.0498237061290356
Energy: 0.04981318899382253
Energy: 0.5949363395375258
Energy: 0.04984665781204395
Energy: 0.050615567912131065
Energy: 0.051363421531186206
Energy: 0.049918169567774145
Energy: 0.05065107438769371
Energy: 0.05252284814936413
Energy: 0.049936818970102104
Energy: 0.0958752271720214
Energy: 0.05059972399691799
Energy: 0.6045043699827608
Energy: 0.5948308922285669
Energy: 0.049527843685905536
Energy: 0.5976934486602369
Energy: 0.291882992079109

minimum gb energy = 0.04913351789751619 eV
minimum distance =  2.70207118113313 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 1.5490884043998931
Energy: 1.2280061585839792
Energy: 1.0249624145851033
Energy: 1.5511657224522262
Energy: 1.046559455417285
Energy: 1.2767822141024125
Energy: 1.055320450677828
Energy: 1.052355288030806
Energy: 1.0395965119358015
Energy: 1.1172039265675058
Energy: 1.0645177342117738
Energy: 1.0510286347273032
Energy: 1.0398613902995024
Energy: 0.9944940177781726
Energy: 1.0005363462501646
Energy: 1.0408168636760067
Energy: 0.993545339332514
Energy: 1.0542956966741461
Energy: 1.044913139406071
Energy: 1.0257293617876981
Energy: 1.037865846980371
Energy: 1.0464292332459781
Energy: 1.0256448229942676
Energy: 1.1218821305901632
Energy: 0.9654359697456019
Energy: 1.081027447464369
Energy: 1.074684037106102
Energy: 0.9240720897767404
Energy: 1.0853243513801472
Energy: 1.0685240938589764
Energy: 1.531371596393804
Energy: 1.0920558770554476
Energy: 1.0169661608379401
Energy: 1.4931158301370866
Energy: 1.0818735199231146
Energy: 0.9667264007980698
Energy: 0.993060949239951
Energy: 1.0198607302459122
Energy: 1.0384730967011944
Energy: 0.9925419787673506
Energy: 1.0207620140987332
Energy: 1.001620590110914
Energy: 0.9159128251169926
Energy: 0.942579803889147
Energy: 0.9674418007316297
Energy: 0.9159961983925645
Energy: 1.0099066897203364
Energy: 0.8889026052563513
Energy: 1.068055080487586
Energy: 0.9694993829931149
Energy: 1.0011887890825961
Energy: 1.0698147837263443
Energy: 0.8629834809127278
Energy: 1.045267014825331
Energy: 0.9602976859320614
Energy: 0.8293738419698156
Energy: 0.8284395667239277
Energy: 0.9577755469626434
Energy: 0.8326721268484137
Energy: 0.8939907757639494
Energy: 1.4108173730386449
Energy: 0.9363051794922241
Energy: 0.9679016316086025
Energy: 1.318243281510839
Energy: 0.9395868243605793
Energy: 0.9427266966887449
Energy: 0.7842009757552851
Energy: 1.0098071726567803
Energy: 0.9773118667702315
Energy: 0.7846294066155962
Energy: 0.9843058500791236
Energy: 0.8525112173490206
Energy: 0.7751208768582476
Energy: 0.9458571067685628
Energy: 0.953291669773921
Energy: 0.7751331528735652
Energy: 1.2707603259173241
Energy: 0.9041138878112144
Energy: 1.125639548784649
Energy: 0.9837347332009381
Energy: 0.9312380579151649
Energy: 1.1273277047366532
Energy: 0.8142444129159018
Energy: 0.9544143295841493
Energy: 1.160005718641897
Energy: 0.7414511879786633
Energy: 0.7415064541320803
Energy: 1.0388408723462905
Energy: 0.7442472929916967
Energy: 0.8405968081469604
Energy: 1.2198286942521592
Energy: 0.9110749935578446
Energy: 0.9448964265981533
Energy: 1.1039585792855988
Energy: 0.8813364136105933
Energy: 0.945516802265156
Energy: 0.7282647301067309
Energy: 0.8948679968950386
Energy: 0.9259861228532255
Energy: 0.728248432175044
Energy: 0.9359377876784034
Energy: 0.8002447947317781
Energy: 0.7284112730504831
Energy: 1.0297821043049986
Energy: 0.971417354738473
Energy: 0.7283103561115216
Energy: 1.1755951783697853
Energy: 0.8938779456649202
Energy: 1.2159762214699739
Energy: 0.8634752152577904
Energy: 0.9167678643370974
Energy: 1.1809327250668122
Energy: 0.8663710101911628
Energy: 0.9272416225181994
Energy: 0.9973470397313549
Energy: 0.7280813390641597
Energy: 0.7277108016011083
Energy: 0.9383872856606053
Energy: 0.7266000709307672
Energy: 0.8035059787188049
Energy: 1.1432974208212858
Energy: 0.9420555579407369
Energy: 0.9422731204097868
Energy: 1.0992133117175094
Energy: 0.9200228921255847
Energy: 0.9422160692451756
Energy: 0.7431677913239018
Energy: 0.8772433396482878
Energy: 0.8994374124606462
Energy: 0.7444527909242381
Energy: 0.8730439627865081
Energy: 0.74127228293999
Energy: 0.7498596473174062
Energy: 1.0225772215088123
Energy: 1.0200347847586415
Energy: 0.7480643485791973
Energy: 1.0427846904284546
Energy: 0.9616938296441158
Energy: 1.3086366746520006
Energy: 0.7760124411377622
Energy: 0.9025658788896177
Energy: 1.3106631390990444
Energy: 0.7757745413540124
Energy: 0.9291996594952667
Energy: 1.1107473101572023
Energy: 0.7728675034171935
Energy: 0.8099288113828469
Energy: 1.0353564607007182
Energy: 0.8100678280464295
Energy: 0.8496377352808699
Energy: 1.124702676992781
Energy: 0.9462982434253016
Energy: 0.9426514761978131
Energy: 0.9319366781174753
Energy: 0.993052788093972
Energy: 0.9787443215798978
Energy: 0.8283640053264348
Energy: 0.9527235062937257
Energy: 0.9511598890717864
Energy: 0.8304965941035602
Energy: 0.9493565632774916
Energy: 0.828612407196234
Energy: 0.8050384572238171
Energy: 1.0116426404543053
Energy: 1.0137185487512423
Energy: 0.8061173311213047
Energy: 1.0391226749360305
Energy: 1.0034147369471607
Energy: 1.4094604605160816
Energy: 0.9161532066500212
Energy: 0.9242828644844373
Energy: 1.4277110345093802
Energy: 0.915670957294563
Energy: 0.9483833475705508
Energy: 1.0634446438937393
Energy: 0.9522927984937495
Energy: 0.9892916346995385
Energy: 1.0596474939517164
Energy: 0.9365555059083864
Energy: 0.9785886502827319
Energy: 1.0957488162901432
Energy: 0.9721995689208467
Energy: 1.0035099961806613
Energy: 1.0697232422058869
Energy: 0.941367578735729
Energy: 0.9903771817434144
Energy: 1.025568311542098
Energy: 0.9713090907588734
Energy: 1.0441069784949832
Energy: 1.0274036257178318
Energy: 0.8873520478598491
Energy: 1.0398375577868038
Energy: 0.9524689370230418
Energy: 0.9645809145241449
Energy: 1.0439781742952188
Energy: 1.0631505715299296
Energy: 1.075593249418171
Energy: 1.1457528087119522

minimum gb energy = 0.7266000709307672 eV
minimum distance =  2.5069552864657 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 1.520909664025695
Energy: 1.4406909493271136
Energy: 1.125440870245028
Energy: 1.522822240530932
Energy: 1.5962356530840736
Energy: 1.4165908113648906
Energy: 1.1852552664895486
Energy: 1.2160748995153035
Energy: 1.2195033117551313
Energy: 1.3187694217995594
Energy: 1.2249295324437717
Energy: 1.2680483087176562
Energy: 1.2161398135259336
Energy: 1.162428891932493
Energy: 1.349520403640777
Energy: 1.202035855840318
Energy: 1.0881064665297837
Energy: 1.2169823469357197
Energy: 1.1446116076981094
Energy: 1.322615723330283
Energy: 1.3147775599743694
Energy: 1.163339937041249
Energy: 1.1750219184267123
Energy: 1.3649124363031333
Energy: 1.262291062880282
Energy: 1.2479590051012976
Energy: 1.318079333405242
Energy: 1.2624364281445686
Energy: 1.2623020901497453
Energy: 1.247552168944413
Energy: 1.5026332244268832
Energy: 1.2441975799389005
Energy: 1.1912831247158142
Energy: 1.4690826854209529
Energy: 1.2425612053540571
Energy: 1.2028729155121762
Energy: 1.0731053712045233
Energy: 1.1712865596786775
Energy: 1.3324130610746554
Energy: 1.0603375019861134
Energy: 1.1913898754050158
Energy: 1.1563925723866522
Energy: 1.0405771345354589
Energy: 1.1118373447712047
Energy: 1.1407752528630242
Energy: 1.039374027069782
Energy: 1.3127798169602507
Energy: 1.0913299047999037
Energy: 1.2671748605501698
Energy: 1.1608796611900594
Energy: 1.1562940099959775
Energy: 1.2737762276825566
Energy: 1.0429238686711955
Energy: 1.1548329230211745
Energy: 1.187892060212271
Energy: 0.9407739789186147
Energy: 0.934805889766289
Energy: 1.1869611928065646
Energy: 0.9381105080076715
Energy: 1.0877366359437035
Energy: 1.5948281462698148
Energy: 1.092925774153018
Energy: 1.1229068762512078
Energy: 1.3870367928193257
Energy: 1.0686679502067578
Energy: 1.1338054240459703
Energy: 0.8994305583892215
Energy: 1.2019787808520626
Energy: 1.1479341454302003
Energy: 0.9006661681057423
Energy: 1.2014072972593801
Energy: 0.9913297027528111
Energy: 0.8994034747458083
Energy: 1.2215885815968204
Energy: 1.1861185313519755
Energy: 0.9003787373626033
Energy: 1.3028202178376687
Energy: 0.9959045156435038
Energy: 1.4358786680384725
Energy: 1.094071623526555
Energy: 1.0935707069135847
Energy: 1.2615767777221585
Energy: 1.0415719022065486
Energy: 1.126558300582586
Energy: 1.1758800931657265
Energy: 0.8963882573366497
Energy: 0.914269224453486
Energy: 1.1772684149102959
Energy: 0.894652748312767
Energy: 1.004157863220584
Energy: 1.320610281308367
Energy: 1.1103497464475076
Energy: 1.1086090894181229
Energy: 1.321998219355026
Energy: 1.0254123717100616
Energy: 1.136632344203228
Energy: 0.9377407898440956
Energy: 1.0889944940615564
Energy: 1.1169855773800856
Energy: 0.9382094613289539
Energy: 1.233405238791923
Energy: 1.0543905949649817
Energy: 0.9451637218315463
Energy: 1.1911041859950595
Energy: 1.2207915963713272
Energy: 0.9453418036672817
Energy: 1.1678151930365368
Energy: 1.1070977059737646
Energy: 1.4194589260923232
Energy: 1.1770775638075532
Energy: 1.162384050189964
Energy: 1.402164749790916
Energy: 1.1299415452766284
Energy: 1.1444881624212666
Energy: 1.2828917370057873
Energy: 1.1607307476960833
Energy: 1.1781649184944067
Energy: 1.2186963866142442
Energy: 1.0454327182219398
Energy: 1.122289419679454
Energy: 1.225642739669851
Energy: 1.2098559080393434
Energy: 1.216557758591292
Energy: 1.226782281457774
Energy: 1.1334863315887502
Energy: 1.2615383822347361
Energy: 1.199012083854149
Energy: 1.1587952316106929
Energy: 1.2471919417273785
Energy: 1.2004055510539
Energy: 1.100501318319603
Energy: 1.1771721457643955
Energy: 1.1853737122920032
Energy: 1.169239556917856
Energy: 1.220935100796138
Energy: 1.234866959513924
Energy: 1.1670456069404254
Energy: 1.311749683705768

minimum gb energy = 0.894652748312767 eV
minimum distance =  2.51049814895362 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 1.7180699675444995
Energy: 1.44192648809189
Energy: 1.4432808168860218
Energy: 1.7211872908769437
Energy: 1.7512986743127992
Energy: 1.5307993120554602
Energy: 1.200368365383447
Energy: 1.2945446356234422
Energy: 1.29844537139907
Energy: 1.3548540227189303
Energy: 1.3128650038714829
Energy: 1.3463427612408334
Energy: 1.3084677597884964
Energy: 1.4427477991518176
Energy: 1.4470366660845775
Energy: 1.3330217982972878
Energy: 1.4420936449364106
Energy: 1.301498516092253
Energy: 1.2406404873106178
Energy: 1.414882694870223
Energy: 1.418814914471929
Energy: 1.2420503969063663
Energy: 1.3149050581533623
Energy: 1.4030633543644682
Energy: 1.3011160505444535
Energy: 1.3308682981958997
Energy: 1.4197396534060305
Energy: 1.2984615481086583
Energy: 1.3595388322631434
Energy: 1.3994210068001423
Energy: 1.5743457736136437
Energy: 1.324933454565479
Energy: 1.3601108730326992
Energy: 1.5763169689470586
Energy: 1.325052086765562
Energy: 1.2722910778419827
Energy: 1.1165941040938678
Energy: 1.2742048547629545
Energy: 1.329190756142175
Energy: 1.1165657803591011
Energy: 1.3477859252235858
Energy: 1.2301579120098525
Energy: 1.0896343070095869
Energy: 1.2756691420871524
Energy: 1.2322261033113187
Energy: 1.090790080371623
Energy: 1.2750745456083334
Energy: 1.145102173760798
Energy: 1.4068875662571034
Energy: 1.2379981869366494
Energy: 1.234112311856543
Energy: 1.2736205499260411
Energy: 1.0782555588623222
Energy: 1.2333164033988877
Energy: 1.3929447033400943
Energy: 1.000340733049622
Energy: 1.0000974351306084
Energy: 1.2644134037460892
Energy: 1.0026986462785732
Energy: 1.2005804429731406
Energy: 1.5591191555263237
Energy: 1.1801123602940895
Energy: 1.2063901615558867
Energy: 1.3972243306567662
Energy: 1.138181990318741
Energy: 1.22609515190365
Energy: 0.998035328378824
Energy: 1.2781084420293298
Energy: 1.2714991840030674
Energy: 0.9982046759056133
Energy: 1.2921244748512357
Energy: 1.1100473131716087
Energy: 1.0055305207112482
Energy: 1.3628634511373992
Energy: 1.2601587536816823
Energy: 1.005743508765324
Energy: 1.2991955978659158
Energy: 1.1342333561793876
Energy: 1.5426021120640787
Energy: 1.1916873761776268
Energy: 1.254679895089328
Energy: 1.4510968643163489
Energy: 1.1924224723960728
Energy: 1.2630707959642815
Energy: 1.2584824032232962
Energy: 1.1507075519695755
Energy: 1.1062556927639278
Energy: 1.1995997459612606
Energy: 1.1540799444440024
Energy: 1.2207568151413835
Energy: 1.3268555890757694
Energy: 1.2944554897406482
Energy: 1.2969234327348553
Energy: 1.3278793747896287
Energy: 1.1583801244490528
Energy: 1.3286895210042073
Energy: 1.309012178192516
Energy: 1.3215470215039682
Energy: 1.3191158107428544
Energy: 1.3087985510616937
Energy: 1.3214572495854102
Energy: 1.2465302232050768
Energy: 1.3576545355495087
Energy: 1.2392697948698668
Energy: 1.3477517651035154
Energy: 1.3588538790911204
Energy: 1.243750861044189
Energy: 1.3309212615132349
Energy: 1.702384318442688
Energy: 1.290165635492302
Energy: 1.4911421107881404
Energy: 1.7129531396543969
Energy: 1.2897108439895477
Energy: 1.2848830560384554
Energy: 1.199330147232199
Energy: 1.297753912762786
Energy: 1.2983499667848157
Energy: 1.2016497029314481
Energy: 1.3128148240479744
Energy: 1.3699682899263268
Energy: 1.3295102091003634
Energy: 1.3553724009190706
Energy: 1.3601968432451472
Energy: 1.330910486641465
Energy: 1.3554419632624548
Energy: 1.3014261377014686
Energy: 1.2372389330697608
Energy: 1.4427544651568316
Energy: 1.4474714014046637
Energy: 1.2386717551086122
Energy: 1.4421154551900237
Energy: 1.4121836653597468
Energy: 1.3005176820133504
Energy: 1.3660550125664748
Energy: 1.3527869736994234
Energy: 1.298125056907126
Energy: 1.3849815758590842
Energy: 1.3282613187639514
Energy: 1.583803567750213
Energy: 1.3247712457040905
Energy: 1.359834851087598
Energy: 1.5836761193596465
Energy: 1.3249040011217865
Energy: 1.3870886916093326
Energy: 1.1160350773789922
Energy: 1.273390739184334
Energy: 1.3304325236578936
Energy: 1.1168426418709914
Energy: 1.2906539361440248
Energy: 1.2458333158707109
Energy: 1.0876138985631978
Energy: 1.2766434114062644
Energy: 1.2897566281712283
Energy: 1.0891338589987967
Energy: 1.274557629815667
Energy: 1.145309791298028
Energy: 1.267932174780477
Energy: 1.233634620996898
Energy: 1.2360923901324519
Energy: 1.2688298287224034
Energy: 1.116365593480813
Energy: 1.3301817905299145
Energy: 1.335484052026843
Energy: 1.012154141908156
Energy: 1.0153782281418764
Energy: 1.295583240530835
Energy: 1.007068136349598
Energy: 1.134249089896541
Energy: 1.4613599783617637
Energy: 1.124831687494505
Energy: 1.208283269770583
Energy: 1.3698952457860947
Energy: 1.1359134859340299
Energy: 1.2740355037818651
Energy: 0.9981392689783453
Energy: 1.3499069200027791
Energy: 1.2782420441343676
Energy: 0.9961882428476513
Energy: 1.292024714264831
Energy: 1.1341804973413563
Energy: 1.0073670727324229
Energy: 1.334467186534121
Energy: 1.213468455012172
Energy: 1.0088091431584523
Energy: 1.29557797873386
Energy: 1.1206918264279038
Energy: 1.545560173481807
Energy: 1.1895999876607604
Energy: 1.2532812605977435
Energy: 1.310987994398278
Energy: 1.192071172877087
Energy: 1.261649343459013
Energy: 1.2317692498532882
Energy: 1.08758850893054
Energy: 1.149559248232975
Energy: 1.1995684867628036
Energy: 1.0904410974606205
Energy: 1.2345009184456062
Energy: 1.2953547682349218
Energy: 1.2671257631109603
Energy: 1.3268119416288706
Energy: 1.297443377573675
Energy: 1.0317616117854298
Energy: 1.3228774699471937
Energy: 1.307016779606649
Energy: 1.3213409104475824
Energy: 1.3261296290714422
Energy: 1.3074112627956451
Energy: 1.4502518563004543
Energy: 1.3171579704446026
Energy: 1.355978422755351
Energy: 1.2391092138870718
Energy: 1.3459120840840697
Energy: 1.3014545062409648
Energy: 1.3024087305188645
Energy: 1.3464788515724446
Energy: 1.7916288000632872
Energy: 1.2875620787507873
Energy: 1.4333101390906045
Energy: 1.706918650680436
Energy: 1.2870854376638958
Energy: 1.3111920649787203

minimum gb energy = 0.9961882428476513 eV
minimum distance =  2.54193240941206 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 1.5868423294295326
Energy: 1.6320286725002198
Energy: 1.6367866770450932
Energy: 1.5896365677952324
Energy: 1.9571855486407173
Energy: 1.8486172142270203
Energy: 1.2545442916864757
Energy: 1.4281793577180575
Energy: 1.3716008759961493
Energy: 1.4208083148136619
Energy: 1.4239405154759057
Energy: 1.4541376765367326
Energy: 1.6683969547403694
Energy: 1.550157136682683
Energy: 1.5547607528879173
Energy: 1.5371322170053148
Energy: 1.4406901940502075
Energy: 1.3641941312407566
Energy: 1.3820178933488523
Energy: 1.5092420189318967
Energy: 1.514873210446127
Energy: 1.4141311349650008
Energy: 1.4091601696256264
Energy: 1.3761572305604908
Energy: 1.4489963568714157
Energy: 1.5403716185675587
Energy: 1.4880885135561026
Energy: 1.4491113330546816
Energy: 1.538571838905522
Energy: 1.4625696172012903
Energy: 1.4843689760768626
Energy: 1.5100814549776718
Energy: 1.5245925933438245
Energy: 1.4850975983423347
Energy: 1.5067054555890051
Energy: 1.5132249837435368
Energy: 1.1853189954810235
Energy: 1.4127466847943322
Energy: 1.411821853451191
Energy: 1.185875967393631
Energy: 1.3820140573564466
Energy: 1.3240434596193151
Energy: 1.1584014481483598
Energy: 1.405568916678305
Energy: 1.3803090963341187
Energy: 1.1596447802054133
Energy: 1.4805294157185491
Energy: 1.2428009287184565
Energy: 1.4574362750578267
Energy: 1.3935260258605906
Energy: 1.3827799536543286
Energy: 1.4588513737154463
Energy: 1.2079653472823946
Energy: 1.3844718240560379
Energy: 1.4284110081677779
Energy: 1.1827002062174454
Energy: 1.1859199736879127
Energy: 1.397887282854791
Energy: 1.1816382791430955
Energy: 1.2816828762921766
Energy: 1.5230474373303757
Energy: 1.4085638450445817
Energy: 1.4851778107028635
Energy: 1.5223768319054358
Energy: 1.257222758604004
Energy: 1.4837673235686124
Energy: 1.5223756906183086
Energy: 1.542083313070385
Energy: 1.505353187301212
Energy: 1.4688183690725582
Energy: 1.6028469823058409
Energy: 1.4320924822248047
Energy: 1.4187819815691556
Energy: 1.3056844401719692
Energy: 1.4645856630097236
Energy: 1.4200730567824138
Energy: 1.401699570272883
Energy: 1.4362672192044241
Energy: 1.7429015096114029
Energy: 1.4176284151251923
Energy: 1.62050774435627
Energy: 1.7426652188937743
Energy: 1.4136723364841524
Energy: 1.6416691492042554

minimum gb energy = 1.1584014481483598 eV
minimum distance =  2.48330287834293 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 1.9533148042676514
Energy: 2.098596275974625
Energy: 1.8338722486501973
Energy: 1.955650616998526
Energy: 2.2680937747648695
Energy: 1.640292052836567
Energy: 1.586795276831552
Energy: 1.5302363751991956
Energy: 1.6466977019067006
Energy: 1.6667172252281308
Energy: 1.5328358247433072
Energy: 1.5743381681931385
Energy: 1.7873364989208793
Energy: 1.7006526569431932
Energy: 1.67445971250032
Energy: 1.7556485501392711
Energy: 1.7289385089415268
Energy: 1.7616585529127302
Energy: 1.6582199849515773
Energy: 1.6800444963622652
Energy: 1.6095743278863306
Energy: 1.630391015339263
Energy: 1.4063957084306586
Energy: 1.5623345108117217
Energy: 1.6888177928875314
Energy: 1.445672404881558
Energy: 1.3882005951950078
Energy: 1.5560298131768575
Energy: 1.4474335905607378
Energy: 1.5301086951950602
Energy: 1.5350796649556335
Energy: 1.3591786746722685
Energy: 1.4877541012918112
Energy: 1.536519853310512
Energy: 1.3288790267703652
Energy: 1.4950821435000623
Energy: 1.3079357969706038
Energy: 1.5279992248242527
Energy: 1.5062385695005873
Energy: 1.3082277086088139
Energy: 1.490477416333749
Energy: 1.4717791000288503
Energy: 1.3433002620932015
Energy: 1.5048607858212355
Energy: 1.5118411423686602
Energy: 1.3448478220010942
Energy: 1.4976729098998294
Energy: 1.4562400906688522
Energy: 1.5829712761957495
Energy: 1.6204621652391045
Energy: 1.5745515072582388
Energy: 1.5361668094179406
Energy: 1.5835387885533065
Energy: 1.7205488068479118
Energy: 1.5356516331750898
Energy: 1.7960482248260805
Energy: 1.5891006884638186
Energy: 1.5127127604253758
Energy: 1.795545792549248
Energy: 1.729398669843631
Energy: 1.593803566635011
Energy: 1.4507129678703017
Energy: 1.5424287610167988
Energy: 1.5954373204060182
Energy: 1.4635703114678338
Energy: 1.4665958304810882
Energy: 1.9070713287575563
Energy: 1.858528455396318
Energy: 1.750346331600496
Energy: 1.9070919568260867
Energy: 1.8615257373454104
Energy: 1.7371254751599015
Energy: 1.304127959084109
Energy: 1.731048665390828
Energy: 1.5748394394832739
Energy: 1.3042315075600777
Energy: 1.7447545870112864
Energy: 1.5318655763730378
Energy: 1.7283920889233557
Energy: 1.6638944907603268
Energy: 1.5751795344581823
Energy: 1.6773500742802225
Energy: 1.6610593215176512
Energy: 1.6471607013011385
Energy: 1.286000660196511
Energy: 1.6523246942132985
Energy: 1.5535395694211491
Energy: 1.2862209273999068
Energy: 1.6427899944001454
Energy: 1.497874538344769
Energy: 1.3066752885318818
Energy: 1.528652971576975
Energy: 1.5272872012218808
Energy: 1.3075227795209323
Energy: 1.5281696120900428
Energy: 1.394303128525709
Energy: 1.2663864912421865
Energy: 1.4593556830736538
Energy: 1.4948805330396042
Energy: 1.2668365395149463
Energy: 1.5303742151935054
Energy: 1.4601654283616912
Energy: 1.6113599970004342
Energy: 1.4335851485387658
Energy: 1.4269399464458297
Energy: 1.5938502355042947
Energy: 1.4359298042234896
Energy: 1.5947502132917366
Energy: 1.3952638773784103
Energy: 1.4774408356697897
Energy: 1.480413698024411
Energy: 1.3490734815922543
Energy: 1.4843971902430435
Energy: 1.4826298468845682
Energy: 1.5889555366845447
Energy: 1.7468525953649117
Energy: 1.6890513340631772
Energy: 1.5876186954926057
Energy: 1.835590364163078
Energy: 1.860736916723057
Energy: 1.6944656927161612
Energy: 1.7082518707727048
Energy: 1.5182521108953864
Energy: 1.696987148153453
Energy: 1.4199071772659213
Energy: 1.4594596244085112
Energy: 1.3549313019495317
Energy: 1.5306343964242874
Energy: 1.437291686441707
Energy: 1.4761483798503836
Energy: 1.69789458344892
Energy: 1.5274813318320497
Energy: 1.9500920503114831
Energy: 1.7114996412802854
Energy: 1.741971328242651
Energy: 1.789355773904718
Energy: 1.7088888355026155
Energy: 1.7541270234347381
Energy: 1.5099558118720873
Energy: 1.3432666248103229
Energy: 1.4398897568055524
Energy: 1.5099809829676467
Energy: 1.342751476129471
Energy: 1.5233736908787772
Energy: 1.417325019850549
Energy: 1.651468961323923
Energy: 1.608401082269672
Energy: 1.4194344894170785
Energy: 1.5713560677287837
Energy: 1.5397995598933092
Energy: 1.706355901847283
Energy: 1.417430820515133
Energy: 1.4606230357223515
Energy: 1.5676025062350742
Energy: 1.2870586851429027
Energy: 1.49886192411856
Energy: 1.653706433749652
Energy: 1.3263148090921624
Energy: 1.3260617637146441
Energy: 1.6158654662909198
Energy: 1.3281048563459064
Energy: 1.424378320399962
Energy: 1.6166922587500037
Energy: 1.4745409459449892
Energy: 1.497982173014446
Energy: 1.618341553396553
Energy: 1.3161055881161141
Energy: 1.5222207464057715
Energy: 1.6167287525737744
Energy: 1.6560623667822805
Energy: 1.62150052047783
Energy: 1.6188564323212151
Energy: 1.6123254532174953
Energy: 1.530288686697587
Energy: 1.6896535113491786
Energy: 1.3578161850896127
Energy: 1.523301359770009
Energy: 1.6802944936022506
Energy: 1.357829131329373
Energy: 1.561348180081678
Energy: 1.9573165465587847
Energy: 1.7911893268910786
Energy: 1.8354050970243558
Energy: 1.9326207553175319
Energy: 1.791174806120448
Energy: 1.8571788127905984

minimum gb energy = 1.2663864912421865 eV
minimum distance =  2.49492540777 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.7515252606047729
Energy: 1.5871739865427115
Energy: 1.5922113986609754
Energy: 1.7556433962059572
Energy: 2.1066449503864555
Energy: 1.7345737680317195
Energy: 1.2528854895860677
Energy: 1.590386201833643
Energy: 1.6293519108880998
Energy: 1.536788284496281
Energy: 1.7008249916615075
Energy: 1.6669234807817381
Energy: 1.9607452718832914
Energy: 1.5906444347515534
Energy: 1.5948074998652257
Energy: 1.96033053270704
Energy: 1.5851312793463308
Energy: 1.6243960512674667
Energy: 1.6250732873006122
Energy: 1.485913293245024
Energy: 1.5748633982882712
Energy: 1.626640514637078
Energy: 1.7200663514035195
Energy: 1.4480827882514358
Energy: 1.4467494346466392
Energy: 1.7180337439987463
Energy: 1.574876609680709
Energy: 1.310422779207418
Energy: 1.726503168316442
Energy: 1.6189315821725518
Energy: 1.8417829083341821
Energy: 1.6237773617853382
Energy: 1.6247513177176152
Energy: 1.7022297786255791
Energy: 1.5119501800335478
Energy: 1.6086005350799017
Energy: 1.4080761010858334
Energy: 1.345972978176005
Energy: 1.4395442959817928
Energy: 1.4093168228573332
Energy: 1.3492063568929358
Energy: 1.498171110531575
Energy: 1.5356192685317909
Energy: 1.505609034229617
Energy: 1.5336674331822542
Energy: 1.5373304226658093
Energy: 1.4749255638334162
Energy: 1.5302315032940663
Energy: 1.2536117352103917
Energy: 1.5429529847737977
Energy: 1.5560376481205427
Energy: 1.479235830249039
Energy: 1.5389066251807546
Energy: 1.6411352064464777
Energy: 1.2523593037077254
Energy: 1.6028270469251795
Energy: 1.5572444226689883
Energy: 1.478963678838252
Energy: 1.599154111933329
Energy: 1.641624035710144
Energy: 1.5358219256028882
Energy: 1.590049989839428
Energy: 1.4972218118667768
Energy: 1.5372137273455795
Energy: 1.567952394134544
Energy: 1.6126035479558836
Energy: 1.9738664302198934
Energy: 1.5567230565603003
Energy: 1.517664955667719
Energy: 1.976731404357895
Energy: 1.551879144694113
Energy: 1.9818276911315293
Energy: 1.448841218904121
Energy: 1.6618529078205257
Energy: 1.659659027912655
Energy: 1.4499251332253658
Energy: 1.6277371388781867
Energy: 1.592413691900405
Energy: 1.7009169581123293
Energy: 1.5122291955192873
Energy: 1.5726720927807494
Energy: 1.7011306103476935
Energy: 1.6013226132935976
Energy: 1.5748254125327383
Energy: 1.4667701126763613
Energy: 1.549181804578259
Energy: 1.4707742529570556
Energy: 1.4670721373636055
Energy: 1.5438204548997816
Energy: 1.5428469061310295
Energy: 1.5874114402387223
Energy: 1.3825071896628314
Energy: 1.4632241177858512
Energy: 1.588740384486781
Energy: 1.3855329287147322
Energy: 1.4569189527226496
Energy: 1.2521975796170945
Energy: 1.4750485788290353
Energy: 1.5274558394546942
Energy: 1.2528666431747453
Energy: 1.4789567067415508
Energy: 1.550053267962502

minimum gb energy = 1.2521975796170945 eV
minimum distance =  2.4900454727793 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 2.066597984793112
Energy: 2.18904119911045
Energy: 1.832468509381483
Energy: 2.0699217839422306
Energy: 2.4546894740432137
Energy: 1.9133779509840636
Energy: 1.6581652609206377
Energy: 1.6560053513759465
Energy: 1.6310496531469487
Energy: 1.76544799426557
Energy: 1.7385279850341033
Energy: 1.596755246909451
Energy: 1.683550074742264
Energy: 1.5124317375188547
Energy: 1.7192944820380982
Energy: 1.683978922368321
Energy: 1.5201604914275884
Energy: 1.7195799007137056
Energy: 1.595266884101655
Energy: 1.6005619500482724
Energy: 1.5310348671723748
Energy: 1.5758780739627247
Energy: 1.683941088971912
Energy: 1.5469200282809972
Energy: 1.461428918378234
Energy: 1.508325436636693
Energy: 1.4609008345986372
Energy: 1.4628113309885478
Energy: 1.5129014937214196
Energy: 1.4384140854453087
Energy: 1.432527857587146
Energy: 1.4826538143707162
Energy: 1.4552041312333874
Energy: 1.4300458819539417
Energy: 1.4696306242739463
Energy: 1.4544279026177676
Energy: 1.9921828730914628
Energy: 1.5796349528671794
Energy: 1.8805436514062326
Energy: 1.7960201187034828
Energy: 1.589492382370873
Energy: 1.8695552303036278
Energy: 1.644100273012489
Energy: 1.5073659725065862
Energy: 1.5107408569330454
Energy: 1.6450411189776244
Energy: 1.576439287933324
Energy: 1.57784556764516
Energy: 1.8855858264025724
Energy: 1.7124645092001087
Energy: 1.6980421956407752
Energy: 1.8355220034728565
Energy: 1.7674186830390963
Energy: 1.5685781944934905
Energy: 1.7501583181457712
Energy: 1.621757784007596
Energy: 1.6398105714444802
Energy: 1.6985284688195441
Energy: 1.651595246835421
Energy: 1.6025389438478836
Energy: 1.516593219266663
Energy: 1.4534089814766125
Energy: 1.4670073120458695
Energy: 1.518198493641465
Energy: 1.4800678725679006
Energy: 1.4499409248976893
Energy: 1.4545062283600392
Energy: 1.5059792800126408
Energy: 1.4608563156184258
Energy: 1.4565562146176019
Energy: 1.459297012011566
Energy: 1.4587345774109821
Energy: 1.6554197518321216
Energy: 1.7004770116545271
Energy: 1.700128521496173
Energy: 1.5620261914425222
Energy: 1.689082770557602
Energy: 1.5637791949315547
Energy: 1.7130876801616326
Energy: 1.6891724782487663
Energy: 1.5872697305978756
Energy: 1.663865434512017
Energy: 1.6854603462684083
Energy: 1.6108203246382944
Energy: 1.674668434419067
Energy: 1.5368340477214737
Energy: 1.6629824842897332
Energy: 1.6756814260304254
Energy: 1.7920390435506215
Energy: 1.6424936610014158
Energy: 1.8084809317828405
Energy: 1.7612794406233017
Energy: 2.0621279808069093
Energy: 1.8090578046892059
Energy: 1.8265880706771283
Energy: 1.946798816041369
Energy: 1.6299936191006845
Energy: 1.6945656882599247
Energy: 1.546850370243842
Energy: 1.57668285623804
Energy: 1.6894259910871772
Energy: 1.546687258990377
Energy: 1.5378256677578606
Energy: 1.5541414277579624
Energy: 1.525868604925795
Energy: 1.5392742952328595
Energy: 1.4699577655447567
Energy: 1.5235792829789165
Energy: 1.4937763630969536
Energy: 1.599127338716693
Energy: 1.5773580687911957
Energy: 1.4950038634555685
Energy: 1.438384441981846
Energy: 1.5611256057775764
Energy: 1.6810386182900867
Energy: 1.528344439517918
Energy: 1.5283565474920915
Energy: 1.6829979259501833
Energy: 1.5068738725135047
Energy: 1.548797622806666
Energy: 1.7334506200379918
Energy: 1.735756435184721
Energy: 1.6346813592457807
Energy: 1.6297656160897875
Energy: 1.6981600958892655
Energy: 1.5660393284050602

minimum gb energy = 1.4300458819539417 eV
minimum distance =  2.46366383482278 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.6506055470708834
Energy: 1.660277866783998
Energy: 1.6477523220135604
Energy: 1.6527669958413418
Energy: 2.1930452302993584
Energy: 1.6209770524857523
Energy: 1.9215283441480955
Energy: 1.7237815843143796
Energy: 1.7264895194909229
Energy: 1.7872286883588397
Energy: 1.7279526730396595
Energy: 1.7135813902265293
Energy: 2.1296590706516305
Energy: 1.664652435197397
Energy: 1.5521675847662197
Energy: 2.1314266475618857
Energy: 1.3324041469865433
Energy: 1.5449395126245224
Energy: 1.9541366449026434
Energy: 1.6310227378993143
Energy: 1.6309084629725488
Energy: 1.9556313580131777
Energy: 1.7759444904137935
Energy: 1.6372999729242892
Energy: 1.3693161018276687
Energy: 1.6279333582140703
Energy: 1.589879717604289
Energy: 1.3705691743339825
Energy: 1.6532080060344332
Energy: 1.6329045176869603
Energy: 1.7409290071500096
Energy: 1.5237100197740818
Energy: 1.4966413358123587
Energy: 1.4983951625200118
Energy: 1.5226531075878214
Energy: 1.5111048956233808
Energy: 1.5969139065077798
Energy: 1.4546680408985921
Energy: 1.45777255830005
Energy: 1.6255382287233562
Energy: 1.4539829122924688
Energy: 1.4735909834223695
Energy: 1.6021717418358636
Energy: 1.4516834871811053
Energy: 1.6054384913666844
Energy: 1.6330912779739717
Energy: 1.4486670700151574
Energy: 1.5916050371135038
Energy: 1.8263259493513875
Energy: 1.7284925021660986
Energy: 1.6064566236509359
Energy: 1.5253236746801961
Energy: 2.0286506094556094
Energy: 1.5602985662496305
Energy: 1.8431953376270604
Energy: 1.526582282821712
Energy: 1.514653356717452
Energy: 1.804554235983883
Energy: 1.9609689557580516
Energy: 1.5141291949760465
Energy: 1.512889578400098
Energy: 1.458998276114785
Energy: 1.4458565457698958
Energy: 1.5226225118555108
Energy: 1.3302666420665377
Energy: 1.4374875759296837
Energy: 1.412523539221412
Energy: 1.3189010692323277
Energy: 1.3467345993203448
Energy: 1.424497680022126
Energy: 1.3193382457755198
Energy: 1.3446543284582348
Energy: 1.2465952763914607
Energy: 1.3262297758350252
Energy: 1.3163794901462127
Energy: 1.2474428507833215
Energy: 1.3293539982337965
Energy: 1.296550977369432
Energy: 1.2487743441217412
Energy: 1.3254336088812102
Energy: 1.2926896532120982
Energy: 1.2483544560695947
Energy: 1.3250615462629767
Energy: 1.2926345425431864
Energy: 1.7875024751963122
Energy: 1.4224858937063143
Energy: 1.4039720581646353
Energy: 1.7869394445513558
Energy: 1.4239952034504266
Energy: 1.4246330719634281
Energy: 2.0884624349369743
Energy: 1.804896831805915
Energy: 1.8046944480418063
Energy: 2.0054460815606086
Energy: 1.7003857393891324
Energy: 1.4449657016383302
Energy: 1.3674861629866744
Energy: 1.6528919348671087
Energy: 1.576668217213603
Energy: 1.3679005024586885
Energy: 1.6547322103610191
Energy: 1.5762301213565897
Energy: 1.5496481485824445
Energy: 1.5926195902427474
Energy: 1.5685771520072402
Energy: 1.499514242256707
Energy: 1.5473069612285955
Energy: 1.4886088471409185
Energy: 1.614188881357996
Energy: 1.4492143991175044
Energy: 1.4564046866532854
Energy: 1.58721964900848
Energy: 1.4494624605394772
Energy: 1.4554417326195628
Energy: 1.624741455009406
Energy: 1.4495189249284413
Energy: 1.4563541649055833
Energy: 1.6261662272161181
Energy: 1.4494543096710653
Energy: 1.4554599589065669
Energy: 1.7916290410094224
Energy: 1.5578504834768303
Energy: 1.5740987199088494
Energy: 1.7923024283459412
Energy: 1.5572641026033445
Energy: 1.572844690558645
Energy: 1.3304291430283974
Energy: 2.0200467887367273
Energy: 1.6426529123956286
Energy: 1.3307535191760187
Energy: 1.9587425591033716
Energy: 1.6439432447503806
Energy: 1.8136750909318171
Energy: 1.5444190016892818
Energy: 1.5579411815431552
Energy: 1.612948712837123
Energy: 1.5439245537520594
Energy: 1.6014792686184822
Energy: 1.7245570717138412
Energy: 1.5459713014344176
Energy: 1.5680263467023592
Energy: 1.7265558527103726
Energy: 1.5200674023069634
Energy: 1.5802699106972935
Energy: 1.8692949379040749
Energy: 1.7393870054001608
Energy: 1.7083955532929676
Energy: 1.8694640125214577
Energy: 1.7364648221721675
Energy: 1.638026850688929

minimum gb energy = 1.2465952763914607 eV
minimum distance =  2.54204798349251 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.9720474154630299
Energy: 2.319556865315836
Energy: 2.0909310810924415
Energy: 1.9754151056993936
Energy: 2.52361478053419
Energy: 2.0881849203931746
Energy: 1.6095840866568636
Energy: 1.528087282848879
Energy: 1.538969707084158
Energy: 1.6934801150031693
Energy: 1.595771526925727
Energy: 1.4596491464980528
Energy: 1.4969411323259116
Energy: 1.4843015831422288
Energy: 1.4918766777454973
Energy: 1.509060185408321
Energy: 1.4720103567106126
Energy: 1.5253123043322088
Energy: 1.6030059847292246
Energy: 1.4979696855309295
Energy: 1.4731117166686056
Energy: 1.5527530644586653
Energy: 1.5872120885849297
Energy: 1.4722687869417144
Energy: 1.2983339386802513
Energy: 1.5130301336185494
Energy: 1.540999973813898
Energy: 1.3000696840678816
Energy: 1.5019886965574665
Energy: 1.4639629412216895
Energy: 1.5604196369566792
Energy: 1.6213763710019367
Energy: 1.4364696409913695
Energy: 1.5609608727664939
Energy: 1.6060367980216077
Energy: 1.435506380453406
Energy: 1.7695992359418893
Energy: 2.019216594738742
Energy: 1.9697675961035321
Energy: 1.6502737584125233
Energy: 2.1086472904232147
Energy: 1.915475275971583
Energy: 1.5175690107551696
Energy: 1.4551491426891907
Energy: 1.462460154645732
Energy: 1.4833788134947048
Energy: 1.6876305174840343
Energy: 1.5411365129998245
Energy: 1.2838904970269098
Energy: 1.4562886419386725
Energy: 1.4144885295308864
Energy: 1.2845700719066284
Energy: 1.4104793308475283
Energy: 1.35193254549202
Energy: 1.335862875721975
Energy: 1.4537487042961743
Energy: 1.4514938369838504
Energy: 1.4031074791864901
Energy: 1.4719318375747537
Energy: 1.3891071373354829
Energy: 1.6691039442019473
Energy: 1.6113158366572962
Energy: 1.5681688401754754
Energy: 1.6710188615162158
Energy: 1.5893359515818206
Energy: 1.626722563268224
Energy: 1.6238564066754744
Energy: 1.5146838343839395
Energy: 1.4597540278984384
Energy: 1.5910814467560033
Energy: 1.4932994200881184
Energy: 1.4298400685035628
Energy: 1.8090127923877206
Energy: 1.6074214670311637
Energy: 1.8610129141809557
Energy: 1.8099648882519295
Energy: 1.731141918376099
Energy: 1.6048748305770602
Energy: 1.8040555777283735
Energy: 1.5363923503477257
Energy: 1.4533355284244351
Energy: 1.7410508689297204
Energy: 1.548018287992695
Energy: 1.4538786324382074
Energy: 1.3534390505711744
Energy: 1.3199141796772427
Energy: 1.3570093225931366
Energy: 1.3538084010980458
Energy: 1.2624500400428378
Energy: 1.3574435275375847
Energy: 1.501381886197253
Energy: 1.3745945877804655
Energy: 1.3669286272199486
Energy: 1.4723855435822946
Energy: 1.310890031707446
Energy: 1.3756099246331743
Energy: 1.6446801826574742
Energy: 1.743487959167981
Energy: 1.8479724348411557
Energy: 1.6463620014400042
Energy: 1.732623923211201
Energy: 1.825168409200353
Energy: 1.7561574969317781
Energy: 1.5226919496576101
Energy: 1.4557407471664137
Energy: 1.6014075100131115
Energy: 1.5738967302051703
Energy: 1.5000668228186143
Energy: 1.572312060544038
Energy: 1.5933376591588184
Energy: 1.5530778323377015
Energy: 1.5647907065509157
Energy: 1.6607600500971564
Energy: 1.6026687922068874
Energy: 1.6266061310669486
Energy: 1.6935241532957093
Energy: 1.6895470307804938
Energy: 1.6271994839316068
Energy: 1.7660382848556988
Energy: 1.5511180471373727
Energy: 1.2621078236755123
Energy: 1.3699936969748685
Energy: 1.3951071822341057
Energy: 1.2639923959571855
Energy: 1.3937551205357783
Energy: 1.3583027924641278
Energy: 1.357079210971069
Energy: 1.3992224874860928
Energy: 1.3915781481262588
Energy: 1.3578325087497352
Energy: 1.4556026971272813
Energy: 1.370691473119375
Energy: 1.6728886028234793
Energy: 1.8420371848937438
Energy: 1.861605537530313
Energy: 1.6742026554615212
Energy: 1.9353023911408693
Energy: 1.618554845421559
Energy: 1.6358147151080211
Energy: 1.4975256046620893
Energy: 1.5861436620459075
Energy: 1.636308542592769
Energy: 1.6096331673613427
Energy: 1.5607043887332703
Energy: 1.7029274093079196
Energy: 1.5013104675706095
Energy: 1.4468497299425156
Energy: 1.5486467835864783
Energy: 1.52576981262744
Energy: 1.4926884962217692
Energy: 1.4718998682399107
Energy: 1.5431618386255377
Energy: 1.5864142047269212
Energy: 1.472566366468676
Energy: 1.7029408707627662
Energy: 1.5674377378289746
Energy: 1.428407824672349
Energy: 1.3480118223278597
Energy: 1.375879741336356
Energy: 1.421397156418001
Energy: 1.332122325768154
Energy: 1.3984576316412551
Energy: 1.4791155524148052
Energy: 1.3251493623806119
Energy: 1.4057233599613277
Energy: 1.529328828173193
Energy: 1.3244645709425396
Energy: 1.401837192860713
Energy: 1.8753661026414545
Energy: 1.567683943085908
Energy: 1.567301394549768
Energy: 1.8689267911641259
Energy: 1.6339633741928854
Energy: 1.5910470023311372

minimum gb energy = 1.2621078236755123 eV
minimum distance =  2.47216882725503 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.790533403900003
Energy: 2.0966778205257395
Energy: 2.1299891307442578
Energy: 1.7929198831347717
Energy: 2.4516284052593464
Energy: 1.698389602946885
Energy: 1.6243521210331977
Energy: 1.5990457077365647
Energy: 1.4122529192092648
Energy: 1.733621042057534
Energy: 1.5545714585222843
Energy: 1.3803115488894118
Energy: 1.5310804346316627
Energy: 1.5337165436299838
Energy: 1.522884498072739
Energy: 1.532106615631083
Energy: 1.5357844824809765
Energy: 1.5195962971391044
Energy: 1.6159105279121606
Energy: 1.4515632937191414
Energy: 1.4229561498873908
Energy: 1.6175262366484058
Energy: 1.4875340984819563
Energy: 1.3769153715500217
Energy: 1.2424828173932245
Energy: 1.5789913184603415
Energy: 1.585889136800526
Energy: 1.2452634162624547
Energy: 1.5756294069094998
Energy: 1.4314069137211731
Energy: 1.3854778357873003
Energy: 1.6714316841542838
Energy: 1.3909394391083676
Energy: 1.3858627505407635
Energy: 1.650181749382502
Energy: 1.3966296786176071
Energy: 2.3808926242018886
Energy: 2.037546329531523
Energy: 1.9510329940951405
Energy: 2.367533720865098
Energy: 2.0380970538584933
Energy: 1.9023550286054776
Energy: 1.4352126075082483
Energy: 1.5817530002359599
Energy: 1.3947425292270799
Energy: 1.5908695981029615
Energy: 1.6635254841462646
Energy: 1.5359026676420668
Energy: 1.2280487976086827
Energy: 1.400546065952174
Energy: 1.3898585380061461
Energy: 1.2265712625191425
Energy: 1.456013213885581
Energy: 1.3246418628187975
Energy: 1.2269653640835017
Energy: 1.4439392304690215
Energy: 1.4077432988618777
Energy: 1.2257293557174656
Energy: 1.516064632207586
Energy: 1.3829632124945872
Energy: 1.8924813739692148
Energy: 1.7525799988222368
Energy: 1.6984316588954957
Energy: 1.894161148401057
Energy: 1.755567990817449
Energy: 1.7076002872974574
Energy: 1.7302789884087522
Energy: 1.4839726343658608
Energy: 1.4623921900648662
Energy: 1.5178454672787645
Energy: 1.628764503740982
Energy: 1.3960208294801333
Energy: 1.516803486491171
Energy: 1.9136271955503292
Energy: 1.9616281004073157
Energy: 1.5180317390078015
Energy: 1.9028480065935156
Energy: 1.9052213216331093
Energy: 1.7226837476098134
Energy: 1.514475083631703
Energy: 1.3969025171533176
Energy: 1.7243040393810618
Energy: 1.6631909857597147
Energy: 1.4090761505964866
Energy: 1.3746552734658695
Energy: 1.263175787450649
Energy: 1.3358274888980666
Energy: 1.376138884080157
Energy: 1.2614537129687207
Energy: 1.3583979953616476
Energy: 1.5107458796649904
Energy: 1.2861616905878035
Energy: 1.3385653941235267
Energy: 1.5112782841864918
Energy: 1.4541344243295276
Energy: 1.3444338376386564
Energy: 1.7970890312471117
Energy: 1.813638703482134
Energy: 2.1339562871077526
Energy: 1.7918270369366278
Energy: 1.850969410854741
Energy: 1.6971651439317055
Energy: 1.742364182542951
Energy: 1.481392036134318
Energy: 1.5694542974163876
Energy: 1.5554793965790237
Energy: 1.6511618259933494
Energy: 1.3814355414940807
Energy: 1.53600079301631
Energy: 1.6048270935147524
Energy: 1.5529195268064346
Energy: 1.549513816450056
Energy: 1.5053457025036512
Energy: 1.5521752188459077
Energy: 1.5712578227847773
Energy: 1.5509580788600448
Energy: 1.3817072280970322
Energy: 1.570891840599659
Energy: 1.5943391265619349
Energy: 1.5322830267543153
Energy: 1.2467560597733212
Energy: 1.5978688747685896
Energy: 1.622700698363341
Energy: 1.2440126139746586
Energy: 1.5998461561669195
Energy: 1.3708622298119149
Energy: 1.3858163075553385
Energy: 1.5900645242885119
Energy: 1.4314974122788315
Energy: 1.386085368143839
Energy: 1.6153946612004269
Energy: 1.3826335152726381
Energy: 1.531209214758244
Energy: 2.0538471660163835
Energy: 1.977756389651873
Energy: 1.5316621449439245
Energy: 2.0552055666847076
Energy: 1.9495890479658342
Energy: 1.5875231646520427
Energy: 1.7197482980025862
Energy: 1.8148695236398613
Energy: 1.5875106502791243
Energy: 1.850345135786027
Energy: 1.5555703685640228
Energy: 1.2244520492491022
Energy: 1.4369523884011286
Energy: 1.3380679720045123
Energy: 1.2244986074505855
Energy: 1.4537750856348928
Energy: 1.322136688068
Energy: 1.2241926566334984
Energy: 1.5054900746953706
Energy: 1.3918050555590527
Energy: 1.225038141012876
Energy: 1.4922041349766233
Energy: 1.3926233048360228
Energy: 1.638614286536879
Energy: 1.7558036210173174
Energy: 1.729965504766301
Energy: 1.6379054749210118
Energy: 1.759978572554387
Energy: 1.7113235110365719
Energy: 1.5502473681850586
Energy: 1.7512483257833757
Energy: 1.5656823412241527
Energy: 1.5862911468677634
Energy: 1.5272677531063672
Energy: 1.5822185090994716
Energy: 1.6139639961361085
Energy: 1.6153798861657085
Energy: 1.6289893240966162
Energy: 1.5178886918760002
Energy: 1.50985076001756
Energy: 1.4826041663115097
Energy: 1.5169566860661237
Energy: 1.6065867871365584
Energy: 1.5519517026943388
Energy: 1.51816092356188
Energy: 1.5995754705172174
Energy: 1.5794196893995738
Energy: 1.4025609484389165
Energy: 1.2615805834785405
Energy: 1.3370646875607248
Energy: 1.4090784450349103
Energy: 1.261332628674023
Energy: 1.4010290779310823
Energy: 1.4889904758676429
Energy: 1.2859056314714012
Energy: 1.3450528155250727
Energy: 1.5098560123362268
Energy: 1.3120791987483418
Energy: 1.3699812144971253
Energy: 1.790743212896171
Energy: 1.5096307529763928
Energy: 1.5631865118003534
Energy: 1.7918862824600392
Energy: 1.5051534862559208
Energy: 1.4273408479036094

minimum gb energy = 1.2241926566334984 eV
minimum distance =  2.54216312834479 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.021443149519813378
Energy: 0.023144062431105287
Energy: 0.022244303357462435
Energy: 0.02381002514712372
Energy: 0.9999870685551739
Energy: 0.022217113595676557
Energy: 0.0222813425670447
Energy: 0.15476509227296534
Energy: 0.1525045849039589
Energy: 0.1545263105186512
Energy: 0.15519759576020895
Energy: 0.15245939675969003
Energy: 1.6639753620444178
Energy: 1.0001746705641932
Energy: 0.9987600437646627
Energy: 1.0030327778387345
Energy: 1.290920981045125
Energy: 0.9983670749006476
Energy: 0.8084814707723531
Energy: 0.15476509227262958
Energy: 0.15250458490467234
Energy: 0.1545263105182735
Energy: 0.15519759575949554
Energy: 0.15245939675935433

minimum gb energy = 0.021443149519813378 eV
minimum distance =  2.73362093946376 Angstroms
sigma value = 1