Model name: model_name=MEAM_LAMMPS_AsadiZaeemNouranian_2015_Ni__MO_700541006254_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5213917642831802
cohesive_energy=4.45034997785486
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: 0.01814369655269708
Energy: 0.018558505890503924
Energy: 1.2362832582956529
Energy: 0.018558505889842918
Energy: 0.018558505890503924
Energy: 0.9033489096725764
Energy: 0.018558505890503924
Energy: 0.9033489096725764
Energy: 1.2362832582956529
Energy: 0.018558505890503924
Energy: 0.01814369655269708
Energy: 0.018558505890503924
Energy: 0.018558505890503924
Energy: 0.9033489096725764
Energy: 0.018558505890503924
Energy: 0.9033489096725764

minimum gb energy = 0.01814369655269708 eV
minimum distance =  2.42362670727147 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 1.3953615034270888
Energy: 1.4219215298615697
Energy: 1.3584077304144915
Energy: 1.4219215298615697
Energy: 1.324208600290558
Energy: 1.3730385933152986
Energy: 1.3305128431446558
Energy: 1.3730385933161002
Energy: 1.2845402393268297
Energy: 1.4054791380347236
Energy: 1.3383802261613718
Energy: 1.4054791380347236
Energy: 1.3132862544043244
Energy: 1.303147756291635
Energy: 1.2794745825547662
Energy: 1.3031477562924365
Energy: 1.3169086010551136
Energy: 1.4235068496597425
Energy: 1.3305798085409979
Energy: 1.4235068496605443
Energy: 1.2733691204414017
Energy: 1.4921698009043165
Energy: 1.2342835766892528
Energy: 1.4921698009059197
Energy: 1.3255790065258348
Energy: 1.3718413620790308
Energy: 1.2743339655285946
Energy: 1.3718413620790308
Energy: 1.2368496738927208
Energy: 1.4290048924378689
Energy: 1.2297126418893838
Energy: 1.4290048924378689
Energy: 1.28004870870222
Energy: 1.5497787942945924
Energy: 1.4359817378488653
Energy: 1.5497787942945924
Energy: 1.2364408168482524
Energy: 1.4049830501414526
Energy: 1.2327179534230297
Energy: 1.4049830501414526
Energy: 1.453465877577977
Energy: 1.383742400730251
Energy: 1.2802053446791914
Energy: 1.383742400730251
Energy: 1.356035820558014
Energy: 1.428240520155719
Energy: 1.2538174337466346
Energy: 1.428240520155719
Energy: 1.3282707922252326
Energy: 1.3704583062975202
Energy: 1.3640711092007634
Energy: 1.3704583062967186
Energy: 1.3371722863216526
Energy: 1.3912487658486883
Energy: 1.2668471500467704
Energy: 1.3912487658494899
Energy: 1.3097405035263199
Energy: 1.4214894912598597
Energy: 1.3233655868373924
Energy: 1.4214894912598597
Energy: 1.3079291885295532
Energy: 1.393526032487305
Energy: 1.3233168421427999
Energy: 1.3935260324865033
Energy: 1.338114226578635
Energy: 1.4056467467657026
Energy: 1.2579814710257788
Energy: 1.4056467467665044
Energy: 1.330536628179599
Energy: 1.3706521508616392
Energy: 1.459516603377177
Energy: 1.3706521508616392
Energy: 1.2335068635557378
Energy: 1.4261124641233711
Energy: 1.2530793274250025
Energy: 1.4261124641225695
Energy: 1.4496342248111294
Energy: 1.8063208095777514
Energy: 1.2830561931739255
Energy: 1.8063208095801562
Energy: 1.2406847655940052
Energy: 1.4058340971659506
Energy: 1.2302399893442553
Energy: 1.405834097165149
Energy: 1.280493837110857
Energy: 1.501769746248119
Energy: 1.428375700381737
Energy: 1.5017697462457142
Energy: 1.383390160152102
Energy: 1.4234929963591236
Energy: 1.2613418001900694
Energy: 1.423492996358322
Energy: 1.3638788682251612
Energy: 1.403336456996397
Energy: 1.2733518558185601
Energy: 1.4033364569971989
Energy: 1.274469696893779
Energy: 1.4962070846485154
Energy: 1.4452644491318138
Energy: 1.4962070846477138
Energy: 1.326273107022656
Energy: 1.4285262020505338
Energy: 1.2902980925865992
Energy: 1.4285262020513352
Energy: 1.3122428822466685
Energy: 1.5449067932798612
Energy: 1.27977852925218
Energy: 1.5449067932806628
Energy: 1.4324400355309097
Energy: 1.4021311936526961
Energy: 1.3678089650069882
Energy: 1.4021311936526961
Energy: 1.3233343128340067
Energy: 1.3709903942982933
Energy: 1.3240860192810462
Energy: 1.3709903942990949
Energy: 1.3931709140205493
Energy: 1.4238052957510616
Energy: 1.3524937182147685
Energy: 1.4238052957510616
Energy: 1.32828464818852
Energy: 1.3703737448932118
Energy: 1.3281820921532719
Energy: 1.3703737448932118
Energy: 1.2888892285776061
Energy: 1.4035407599615197
Energy: 1.336804265724711
Energy: 1.4035407599623213
Energy: 1.3169224317646628
Energy: 1.303615681548616
Energy: 1.2794309814287628
Energy: 1.3036156815478142

minimum gb energy = 1.2297126418893838 eV
minimum distance =  2.25922111399564 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 1.4607913655295233
Energy: 1.462332757396738
Energy: 1.4196597755505473
Energy: 1.462332757395824
Energy: 1.3555751517864303
Energy: 1.4400479062932117
Energy: 1.3708326811870533
Energy: 1.440047906291384
Energy: 1.3396367212850635
Energy: 1.4539464085174798
Energy: 1.3754417303482365
Energy: 1.4539464085193077
Energy: 1.3090276179052729
Energy: 1.3247356931305458
Energy: 1.31956090269974
Energy: 1.3247356931305458
Energy: 1.3105109430053388
Energy: 1.4303027559255388
Energy: 1.4773937388999003
Energy: 1.4303027559264527
Energy: 1.4314957083479865
Energy: 1.4306652252365233
Energy: 1.3736571789012495
Energy: 1.4306652252356094
Energy: 1.4405208285170403
Energy: 1.5570859222280355
Energy: 1.3115311881454583
Energy: 1.5570859222271214
Energy: 1.2773623103671734
Energy: 1.453799297385234
Energy: 1.2846685027948443
Energy: 1.453799297383406
Energy: 1.3116933441521168
Energy: 1.8732041357096227
Energy: 1.5203562187316335
Energy: 1.8732041357114508
Energy: 1.2906873834999506
Energy: 1.4534875631136763
Energy: 1.4130546766483902
Energy: 1.4534875631127622
Energy: 1.356894547064619
Energy: 1.387525196096208
Energy: 1.3792975466144448
Energy: 1.387525196098036
Energy: 1.2951820457081966
Energy: 1.4701948063026578
Energy: 1.375196355672329
Energy: 1.4701948063017436
Energy: 1.3958249410817625
Energy: 1.4458288556373742
Energy: 1.3595128256026245
Energy: 1.4458288556373742
Energy: 1.3957655829889413
Energy: 1.4458545351830603
Energy: 1.3443495283028286
Energy: 1.4458545351839744
Energy: 1.2952575256630072
Energy: 1.4624793372500506
Energy: 1.4044432209807733
Energy: 1.4624793372491365
Energy: 1.3567839947731506
Energy: 1.3874360529756473
Energy: 1.3705607746115724
Energy: 1.3874360529793035
Energy: 1.2905177755088373
Energy: 1.453596396248425
Energy: 1.2850381210127484
Energy: 1.4535963962466383
Energy: 1.3116908951338775
Energy: 1.8672986381891274
Energy: 1.5204347035755956
Energy: 1.8672986381909555
Energy: 1.2773625973612281
Energy: 1.4538409764285063
Energy: 1.284539322203738
Energy: 1.4538409764303344
Energy: 1.4407467070599078
Energy: 1.557274682541693
Energy: 1.3194706048074787
Energy: 1.557274682543521
Energy: 1.4305308798260823
Energy: 1.4308354721744088
Energy: 1.284843926816561
Energy: 1.4308354721716667
Energy: 1.310640228272248
Energy: 1.4303138129708093
Energy: 1.3599273584239349
Energy: 1.4303138129698951
Energy: 1.3108488447948135
Energy: 1.3247506938156768
Energy: 1.3114764820500886
Energy: 1.3247506938147626
Energy: 1.3392926546122423
Energy: 1.4541225599494543
Energy: 1.4064942623022745
Energy: 1.4541225599485401
Energy: 1.355864105352528
Energy: 1.439783775237501
Energy: 1.3705933884118635
Energy: 1.439783775238415
Energy: 1.4607913655286093
Energy: 1.462332757396738
Energy: 1.422997544479923
Energy: 1.4623327573949099
Energy: 1.3555751517855164
Energy: 1.4400479062932117
Energy: 1.3708326811879672
Energy: 1.440047906292298
Energy: 1.3396367212850635
Energy: 1.4539464085174798
Energy: 1.3379600465056378
Energy: 1.4539464085193077
Energy: 1.3090276179052729
Energy: 1.3247356931305458
Energy: 1.3150269261257082
Energy: 1.3247356931305458

minimum gb energy = 1.2773623103671734 eV
minimum distance =  2.23358660941249 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 1.4023897578871594
Energy: 1.5446473499644282
Energy: 1.5071170353244998
Energy: 1.5446473499644282
Energy: 1.426015608093558
Energy: 1.4761474985519831
Energy: 1.3680430228345322
Energy: 1.4761474985519831
Energy: 1.3962872771383634
Energy: 1.5950871851943251
Energy: 1.3558028114128844
Energy: 1.5950871851932626
Energy: 1.3660495103339143
Energy: 1.377395702968269
Energy: 1.3527204908265995
Energy: 1.3773957029693318
Energy: 1.353755795832084
Energy: 1.4717918139089987
Energy: 1.52823807310666
Energy: 1.4717918139089987
Energy: 1.5008867851198417
Energy: 1.5039634369213455
Energy: 1.5338737829359324
Energy: 1.5039634369255956
Energy: 1.532862073828465
Energy: 1.6249796920773778
Energy: 1.3874209928862704
Energy: 1.6249796920773778
Energy: 1.6265135929427983
Energy: 1.549554291132296
Energy: 1.337900898097803
Energy: 1.549554291132296
Energy: 1.387822977121069
Energy: 1.5295669977667328
Energy: 1.4321395708602425
Energy: 1.52956699776567
Energy: 1.3621736129213207
Energy: 1.5047836292572139
Energy: 1.344730601893386
Energy: 1.5047836292561514
Energy: 1.4206452716723337
Energy: 1.4585771181140246
Energy: 1.423806561891484
Energy: 1.4585771181140246
Energy: 1.4132786925363894
Energy: 1.547525031351237
Energy: 1.3649144295827176
Energy: 1.547525031351237
Energy: 1.3557870683483613
Energy: 1.4681939991204827
Energy: 1.3450184229673705
Energy: 1.4681939991204827
Energy: 1.3884931834889098
Energy: 1.356076119860508
Energy: 1.4322877652196004
Energy: 1.356076119860508
Energy: 1.3423861434369566
Energy: 1.5522955056438437
Energy: 1.3345685702458399
Energy: 1.552295505642781
Energy: 1.4320820760355568
Energy: 1.3757669211396153
Energy: 1.353679421336248
Energy: 1.3757669211396153
Energy: 1.3222992130163025
Energy: 1.5929795083360407
Energy: 1.3221962257680009
Energy: 1.5929795083360407
Energy: 1.3539565649436422
Energy: 1.4876164477395053
Energy: 1.52890256478985
Energy: 1.4876164477395053
Energy: 1.3360621507163262
Energy: 1.3784494399307934
Energy: 1.353987894139588
Energy: 1.3784494399307934
Energy: 1.4310191242856902
Energy: 1.5033831237618631
Energy: 1.3709174537717457
Energy: 1.5033831237618631
Energy: 1.3798997930365722
Energy: 1.4389752730020444
Energy: 1.3714023692482
Energy: 1.4389752730020444
Energy: 1.399910658635153
Energy: 1.5453067781849528
Energy: 1.5029979769757693
Energy: 1.5453067781849528
Energy: 1.4245979777722861
Energy: 1.473608435563472
Energy: 1.3684851984135713
Energy: 1.4736084355645342
Energy: 1.3971784975479793
Energy: 1.5932373345340576
Energy: 1.3623505262715931
Energy: 1.5932373345340576
Energy: 1.5984229794617804
Energy: 1.3799414111484383
Energy: 1.3536337775766463
Energy: 1.3799414111484383

minimum gb energy = 1.3221962257680009 eV
minimum distance =  2.2454798922496 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 1.4351875130379805
Energy: 1.4351530286282759
Energy: 1.585155494432745
Energy: 1.4351530286282759
Energy: 1.4147980467718773
Energy: 1.5367517837544513
Energy: 1.429877661403529
Energy: 1.5367517837544513
Energy: 1.4510246362972892
Energy: 1.4540995562806485
Energy: 1.4322413333596036
Energy: 1.4540995562806485
Energy: 1.6359830469298124
Energy: 1.5838387508064276
Energy: 1.384125334744801
Energy: 1.5838387508064276
Energy: 1.5764838379455253
Energy: 1.5249595940842409
Energy: 1.6264394123261146
Energy: 1.5249595940842409
Energy: 1.3585205932876439
Energy: 1.4186775190547447
Energy: 1.7378240125969613
Energy: 1.4186775190547447
Energy: 1.4381815295640754
Energy: 1.3844625220318516
Energy: 1.384688962015684
Energy: 1.3844625220331193
Energy: 1.54327743024413
Energy: 1.4187890510335897
Energy: 1.3801800165966132
Energy: 1.4187890510335897
Energy: 1.4380539288127248
Energy: 1.5366914320135805
Energy: 1.4285030104397536
Energy: 1.5366914320135805
Energy: 1.4352276039547454
Energy: 1.4347334935635836
Energy: 1.4825044843105757
Energy: 1.434733493562316
Energy: 1.3792368478783297
Energy: 1.5436344745774384
Energy: 1.4297290698018987
Energy: 1.543634474578706
Energy: 1.5331353694951564
Energy: 1.6004844300504086
Energy: 1.3841505533878748
Energy: 1.6004844300504086
Energy: 1.3570155619467132
Energy: 1.4806545892562197
Energy: 1.389101189035223
Energy: 1.4806545892549523
Energy: 1.4545666985956338
Energy: 1.4201794351295112
Energy: 1.4842337234337755
Energy: 1.4201794351282437
Energy: 1.3570238980191354
Energy: 1.480507702770436
Energy: 1.4662684361549592
Energy: 1.480507702770436
Energy: 1.5330019316623416
Energy: 1.6005483565730938
Energy: 1.384059334396758
Energy: 1.6005483565730938
Energy: 1.3792528295796516
Energy: 1.543541613764408
Energy: 1.400206971031736
Energy: 1.543541613761873
Energy: 1.4352847027542566
Energy: 1.4352022077079623
Energy: 1.48255057410962
Energy: 1.4352022077079623
Energy: 1.4033471702411444
Energy: 1.5367866081400503
Energy: 1.490856803285583
Energy: 1.5367866081400503
Energy: 1.5433622783025303
Energy: 1.418743152777444
Energy: 1.3801824574299077
Energy: 1.418743152777444
Energy: 1.438100613187582
Energy: 1.3843318961199051
Energy: 1.3846998206066987
Energy: 1.3843318961199051

minimum gb energy = 1.3570155619467132 eV
minimum distance =  2.31425563618532 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 1.4098254226860538
Energy: 1.5672711471524363
Energy: 1.7008136993430099
Energy: 1.5672711471524363
Energy: 1.3822904589973928
Energy: 1.5843100823774765
Energy: 1.3729822346980478
Energy: 1.5843100823774765
Energy: 1.5121625656452822
Energy: 1.6037004235381402
Energy: 1.3721083967221044
Energy: 1.6037004235397074
Energy: 1.5606497343082777
Energy: 1.5965343138773949
Energy: 1.6032521591704636
Energy: 1.5965343138773949
Energy: 1.6003617918059008
Energy: 1.3846181160185784
Energy: 1.4584004062937235
Energy: 1.3846181160185784
Energy: 1.373855691635769
Energy: 1.5869011145435705
Energy: 1.844406459924621
Energy: 1.5869011145435705
Energy: 1.4528678368279273
Energy: 1.531869023129682
Energy: 1.5136923337152057
Energy: 1.531869023129682
Energy: 1.5885774912234836
Energy: 1.6097600736620348
Energy: 1.408815777574941
Energy: 1.6097600736620348
Energy: 1.3710997380904644
Energy: 1.4865846886372387
Energy: 1.3846117177365658
Energy: 1.4865846886372387
Energy: 1.6330711517954055
Energy: 1.559265922703977
Energy: 1.5119380917904777
Energy: 1.559265922703977
Energy: 1.4464756112030457
Energy: 1.5684596093320828
Energy: 1.8132768622861248
Energy: 1.5684596093320828
Energy: 1.3736395957421457
Energy: 1.4776342906856357
Energy: 1.6332554268635977
Energy: 1.4776342906856357
Energy: 1.6007441803302238
Energy: 1.602856762110496
Energy: 1.3671598765575357
Energy: 1.602856762110496
Energy: 1.3743524251114883
Energy: 1.5696037081968237
Energy: 1.560647443590055
Energy: 1.5696037081968237
Energy: 1.4190337102548294
Energy: 1.5701639459056809
Energy: 1.7284313494178352
Energy: 1.5701639459056809
Energy: 1.3848281834246343
Energy: 1.5216913150456315
Energy: 1.3735769197003778
Energy: 1.5216913150456315
Energy: 1.5145151035457414
Energy: 1.5021780702265175
Energy: 1.6316869347930698
Energy: 1.5021780702265175

minimum gb energy = 1.3671598765575357 eV
minimum distance =  2.30445933279741 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 1.4728810111272919
Energy: 1.4752916428027283
Energy: 1.7917709128522321
Energy: 1.4752916427991773
Energy: 1.5702189673436255
Energy: 1.5341058805631296
Energy: 1.3858465980129704
Energy: 1.5341058805640175
Energy: 1.7265020106383995
Energy: 1.4621118993304671
Energy: 1.3852995649834512
Energy: 1.4621118993295792
Energy: 1.4839795002010703
Energy: 1.4745076375958361
Energy: 1.5183372608270786
Energy: 1.4745076376020505
Energy: 1.650304507633715
Energy: 1.464665496889903
Energy: 1.4351952346124033
Energy: 1.464665496890791
Energy: 1.4009786277008354
Energy: 1.4951222398434718
Energy: 1.8491999114380564
Energy: 1.4951222398443595
Energy: 1.4730149628567624
Energy: 1.5255540511763899
Energy: 1.3854444667049028
Energy: 1.5255540511763899
Energy: 1.7258560070506657
Energy: 1.4970157534154374
Energy: 1.398509834152096
Energy: 1.4970157534145494
Energy: 1.4025111258596747
Energy: 1.6066030556190094
Energy: 1.6478336395705042
Energy: 1.6066030556181217
Energy: 1.7782323274921659
Energy: 1.4668915978370993
Energy: 1.3862768780927677
Energy: 1.4668915978370993
Energy: 1.3889144248733396
Energy: 1.541021683526938
Energy: 1.8988868705413449
Energy: 1.5410216835260502
Energy: 1.3970849112114971
Energy: 1.5259794956018584
Energy: 1.3992065438048513
Energy: 1.525979495600083
Energy: 1.8513078680412292
Energy: 1.4739446599982735
Energy: 1.479166425824794
Energy: 1.4739446599991612
Energy: 1.385791382511599
Energy: 1.6276918068518795
Energy: 1.5718874817083495
Energy: 1.6276918068527673
Energy: 1.5277579540698207
Energy: 1.5266252559611813
Energy: 1.4908312505533394
Energy: 1.5266252559611813
Energy: 1.6188705594516957
Energy: 1.4950015912537904
Energy: 1.6210031964321499
Energy: 1.4950015912537904
Energy: 1.3857467752832304
Energy: 1.5776368204682083
Energy: 1.727148555900728
Energy: 1.5776368204682083
Energy: 1.6726997036596694
Energy: 1.4638018363499654
Energy: 1.4008463327884868
Energy: 1.4638018363490777
Energy: 1.4529860473990566
Energy: 1.5587778333067368
Energy: 1.4604200620223033
Energy: 1.558777833305849
Energy: 1.385138506624561
Energy: 1.4741074334413165
Energy: 1.47779496677106
Energy: 1.4741074334457556
Energy: 1.5018051236084795
Energy: 1.4851974286776093
Energy: 1.616087129044305
Energy: 1.4851974286776093
Energy: 1.38748746197415
Energy: 1.694963185952826
Energy: 1.7768676549326
Energy: 1.694963185952826
Energy: 1.6460247162296449
Energy: 1.5383459903415866
Energy: 1.3842822684737912
Energy: 1.5383459903406989
Energy: 1.3977840479761692
Energy: 1.5693391965475403
Energy: 1.6889204213632243
Energy: 1.5693391965475403
Energy: 1.4642260299482854
Energy: 1.4853146375471915
Energy: 1.6918458051554677
Energy: 1.4853146375480792
Energy: 1.6456810793781524
Energy: 1.5016672448494108
Energy: 1.3858867821818586
Energy: 1.5016672448511865
Energy: 1.419024717989793
Energy: 1.689756595217809
Energy: 1.8106092443315132
Energy: 1.689756595217809
Energy: 1.5622894054587297
Energy: 1.494638320021717
Energy: 1.6174044906968497
Energy: 1.4946383200208293
Energy: 1.6728067380375897
Energy: 1.6480598218208145
Energy: 1.4754746004576682
Energy: 1.6480598218208145
Energy: 1.398267925430347
Energy: 1.5589395684054923
Energy: 1.672074462045131
Energy: 1.5589395684063803

minimum gb energy = 1.3842822684737912 eV
minimum distance =  2.197588370224 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 1.2737514553047504
Energy: 1.2733043937975341
Energy: 1.806096117717805
Energy: 1.2733043937975341
Energy: 1.604569203370204
Energy: 1.4312867053621796
Energy: 1.2998162047353914
Energy: 1.4312867053621796
Energy: 1.274292882515068
Energy: 1.2730298296610514
Energy: 1.4570906729488082
Energy: 1.273029829663095
Energy: 1.2744012264853186
Energy: 1.2729715384222062
Energy: 1.4629262453753713
Energy: 1.2729715384201623
Energy: 1.6045746300107433
Energy: 1.4313687542034572
Energy: 1.299907379902971
Energy: 1.4313687542055011
Energy: 1.2737514553047504
Energy: 1.2733043937975341
Energy: 1.860951247622411
Energy: 1.2733043937975341
Energy: 1.604569203370204
Energy: 1.431286705364177
Energy: 1.4621042138872313
Energy: 1.4312867053621796
Energy: 1.274292882515068
Energy: 1.2730298296610514
Energy: 1.5869738471458341
Energy: 1.273029829663095
Energy: 1.2744012264873623
Energy: 1.2729715384222062
Energy: 1.5219788099203742
Energy: 1.2729715384222062
Energy: 1.6045746300107433
Energy: 1.4313687542055011
Energy: 1.5179987380429216
Energy: 1.4313687542055011
Energy: 1.2737514553047504
Energy: 1.2733043937975341
Energy: 1.860951247624455
Energy: 1.2733043937975341
Energy: 1.604569203370204
Energy: 1.4312867053621796
Energy: 1.5213893618871124
Energy: 1.4312867053621796
Energy: 1.274292882515068
Energy: 1.2730298296610514
Energy: 1.5869738471458341
Energy: 1.273029829663095

minimum gb energy = 1.2729715384201623 eV
minimum distance =  2.2851564688401 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 1.4006935505220086
Energy: 1.7431679502136315
Energy: 1.9247599635927692
Energy: 1.7431679502136315
Energy: 1.7549108330446377
Energy: 1.498593459783332
Energy: 1.4518652544134638
Energy: 1.498593459783332
Energy: 1.4591611375355098
Energy: 1.3796743498501132
Energy: 1.4180554377896504
Energy: 1.3796743498501132
Energy: 1.6372079822566046
Energy: 1.692341145516519
Energy: 1.4515992881617135
Energy: 1.6923411455172754
Energy: 1.6823852716048309
Energy: 1.4700345224364224
Energy: 1.4175786379122874
Energy: 1.4700345224364224
Energy: 1.3804623607748967
Energy: 1.3779642553340523
Energy: 1.9338620979210537
Energy: 1.3779642553348088
Energy: 1.9535597103962739
Energy: 1.4635597216499934
Energy: 1.4520259727062912
Energy: 1.4635597216499934
Energy: 1.462203969893947
Energy: 1.6650909817244728
Energy: 1.664885640674619
Energy: 1.6650909817244728
Energy: 1.4574713461562374
Energy: 1.6910754655656135
Energy: 1.3779735198600493
Energy: 1.6910754655671263
Energy: 1.4159739409491303
Energy: 1.4977489498601508
Energy: 1.3784654977738777
Energy: 1.4977489498593943
Energy: 1.471009922354841
Energy: 1.6939766633038302
Energy: 1.9478824342175056
Energy: 1.6939766633015607
Energy: 1.6753087714689217
Energy: 1.744257533764286
Energy: 1.4427908454206704
Energy: 1.744257533760504
Energy: 1.4673394743034704
Energy: 1.5919843255327444
Energy: 1.7806717921979964
Energy: 1.5919843255327444
Energy: 1.6394223270800234
Energy: 1.6868612038501327
Energy: 1.4073723890403385
Energy: 1.6868612038508892
Energy: 1.4480398490339912
Energy: 1.4809472708248967
Energy: 1.6095261586179506
Energy: 1.4809472708248967
Energy: 1.4684682194687797
Energy: 1.6642986930311585
Energy: 1.6666621949072393
Energy: 1.6642986930304018
Energy: 1.5688815646740724
Energy: 1.4280521515557345
Energy: 1.447804790911878
Energy: 1.4280521515542217
Energy: 1.470585330280102
Energy: 1.4640442974685055
Energy: 1.6707313748621666
Energy: 1.464044297467749
Energy: 1.7088701902965184
Energy: 1.4798855720594501
Energy: 1.3846610519394853
Energy: 1.4798855720594501
Energy: 1.4418448741189502
Energy: 1.5176214354025075
Energy: 1.6415806163759725
Energy: 1.5176214354025075
Energy: 1.658154660663831
Energy: 1.6572629221894477
Energy: 1.658223244686051
Energy: 1.6572629221894477
Energy: 1.5806989870591406
Energy: 1.579360287826509
Energy: 1.4476870569628157
Energy: 1.5793602878257524
Energy: 1.3780263910551518
Energy: 1.4801532183330166
Energy: 1.4492670528722296
Energy: 1.4801532183322599
Energy: 1.9213179598549006
Energy: 1.512568247072524
Energy: 1.4635043726795893
Energy: 1.5125682470732804
Energy: 1.4526190970712405
Energy: 1.7540492610548597
Energy: 1.8762602666710329
Energy: 1.7540492610541032
Energy: 1.5836997106818176
Energy: 1.4928734960148957
Energy: 1.47041939569954
Energy: 1.492873496015652
Energy: 1.4788238775048537
Energy: 1.5074190614439005
Energy: 1.6606705233849943
Energy: 1.5074190614439005
Energy: 1.3965917525428106
Energy: 1.6888608249832513
Energy: 1.6367112266641541
Energy: 1.6888608249840078
Energy: 1.5449055910871574
Energy: 1.4926763356258395
Energy: 1.4647964666183828
Energy: 1.4926763356258395
Energy: 1.455238703554039
Energy: 1.7553440741705733
Energy: 1.8779253170870085
Energy: 1.7553440741713298
Energy: 1.7741047386253823
Energy: 1.7258220977156975
Energy: 1.469983680981852
Energy: 1.7258220977156975
Energy: 1.3789284498490377
Energy: 1.4669342673419585
Energy: 1.4625690503761397
Energy: 1.4669342673412022
Energy: 1.4268508412983436
Energy: 1.5649339491195018
Energy: 1.4616772111235745
Energy: 1.5649339491202583
Energy: 1.6608062460030517
Energy: 1.6598740783492285
Energy: 1.661775823358755
Energy: 1.6598740783492285
Energy: 1.4443873429575405
Energy: 1.661970015592534
Energy: 1.9652354076981202
Energy: 1.6619700155918462

minimum gb energy = 1.3779642553340523 eV
minimum distance =  2.21956847537894 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 1.4627260403041653
Energy: 1.4636116820021865
Energy: 1.8649044060158633
Energy: 1.4636116820021865
Energy: 1.502257194373035
Energy: 1.5169164759759144
Energy: 1.4424863397810246
Energy: 1.5169164759759144
Energy: 1.4497962131144462
Energy: 1.464175106998915
Energy: 1.4164428753206968
Energy: 1.464175106998915
Energy: 1.459861798396658
Energy: 1.5902750774967434
Energy: 1.5000779210689437
Energy: 1.5902750774967434
Energy: 1.4809970681691969
Energy: 1.5294343958287162
Energy: 1.399016643429998
Energy: 1.5294343958275163
Energy: 1.449765939679028
Energy: 1.4102743344860973
Energy: 1.8739953078916163
Energy: 1.4102743344860973
Energy: 1.9534447378739137
Energy: 1.6234849370017541
Energy: 1.4817145219212562
Energy: 1.6234849370017541
Energy: 1.4313076763370145
Energy: 1.3678456444995315
Energy: 1.73962150546646
Energy: 1.3678456444983313
Energy: 1.9656634185705384
Energy: 1.3687528971331588
Energy: 1.3685306465526808
Energy: 1.368752897134359
Energy: 1.4416492991672702
Energy: 1.561411894503669
Energy: 1.3679517778930947
Energy: 1.5614118945048692
Energy: 1.4346212886465264
Energy: 1.4640770434127508
Energy: 1.818853054781147
Energy: 1.4640770434127508
Energy: 1.625414005778762
Energy: 1.417131983477872
Energy: 1.4587415365800416
Energy: 1.4171319834766989
Energy: 1.4499692895001397
Energy: 1.4884481657618207
Energy: 1.839855083710616
Energy: 1.4884481657606206
Energy: 1.846670702407216
Energy: 1.585132306367102
Energy: 1.4987389313273323
Energy: 1.585132306367102
Energy: 1.4364933573485525
Energy: 1.6603404591720252
Energy: 1.773028446595885
Energy: 1.6603404591720252
Energy: 1.7451707594307793
Energy: 1.5496676240356457
Energy: 1.4321387624600252
Energy: 1.5496676240344456
Energy: 1.4615427876709242
Energy: 1.4619347916514858
Energy: 1.4500880403227525
Energy: 1.4619347916514858
Energy: 1.461865158922158
Energy: 1.4620115874527575
Energy: 1.4816133463249697
Energy: 1.4620115874527575
Energy: 1.565449205624864
Energy: 1.4635805336446281
Energy: 1.4459774866238693
Energy: 1.4635805336434282
Energy: 1.4723047157333748
Energy: 1.5301947790049626
Energy: 1.9174437342811688
Energy: 1.5301947790037624
Energy: 1.8549583023390184
Energy: 1.4625049644837809
Energy: 1.4517422629090762
Energy: 1.4625049644837809
Energy: 1.5002854834579813
Energy: 1.523076157002839
Energy: 1.6062747778030266
Energy: 1.523076157002839

minimum gb energy = 1.3678456444983313 eV
minimum distance =  2.23235392413353 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 1.384633073091066
Energy: 1.3854434809051088
Energy: 1.897900280830512
Energy: 1.3854434809059575
Energy: 1.7800567519750203
Energy: 1.4568409129021338
Energy: 1.475745989404746
Energy: 1.4568409129012851
Energy: 1.4049761072891145
Energy: 1.6045374258154446
Energy: 1.3948027053726288
Energy: 1.6045374258137475
Energy: 1.386955448555992
Energy: 1.492570995685494
Energy: 1.4344241929372792
Energy: 1.4925709956846454
Energy: 1.3955531674089772
Energy: 1.4939005737809223
Energy: 1.3889226748160108
Energy: 1.4939005737826196
Energy: 1.4301331674411872
Energy: 1.5167081649276428
Energy: 1.9005131565695323
Energy: 1.5167081649259455
Energy: 1.5925284521475138
Energy: 1.6181556326334938
Energy: 1.507793759602244
Energy: 1.6181556326309479
Energy: 1.4297020811900234
Energy: 1.5179953297291848
Energy: 2.002868497799364
Energy: 1.5179953297308824
Energy: 1.5628789050290994
Energy: 1.4745833907677965
Energy: 1.435222447186612
Energy: 1.474583390769494
Energy: 1.4290771439361858
Energy: 1.4952743951656644
Energy: 1.513105511560314
Energy: 1.4952743951631187
Energy: 1.4727796789989278
Energy: 1.4196996993624247
Energy: 1.472565347120086
Energy: 1.4196996993624247
Energy: 1.38547958509306
Energy: 1.4931874723115228
Energy: 1.459226335898324
Energy: 1.493187472314069
Energy: 1.38549399888394
Energy: 1.38652120850348
Energy: 1.4587472084074904
Energy: 1.38652120850348
Energy: 1.3938612544390625
Energy: 1.3757181304039592
Energy: 1.439382754354597
Energy: 1.3757181304031105
Energy: 1.4288482074554323
Energy: 1.6680640729935934
Energy: 1.7790641095725437
Energy: 1.6680640729935934
Energy: 1.9698202884836162
Energy: 1.3766419137670707
Energy: 1.407038523468981
Energy: 1.3766419137670707
Energy: 1.4283832828233625
Energy: 1.4793412422645955
Energy: 1.6122556329015396
Energy: 1.4793412422654444
Energy: 1.3945425317410034
Energy: 1.49096799496196
Energy: 1.4386757380947603
Energy: 1.49096799496196
Energy: 1.4285907879815807
Energy: 1.5179655959938985
Energy: 1.439622454387469
Energy: 1.5179655959938985
Energy: 1.3920274543399391
Energy: 1.4970459991390814
Energy: 1.3775976000433532
Energy: 1.4970459991416274
Energy: 1.4536513251380208
Energy: 1.420261033367409
Energy: 1.4352043319344712
Energy: 1.4202610333691061
Energy: 1.42842066662465
Energy: 1.604729170615611
Energy: 1.5119051379985426
Energy: 1.6047291706139137
Energy: 1.7951162420452111
Energy: 1.4751403099735114
Energy: 1.4682479286135117
Energy: 1.4751403099718137
Energy: 1.3924180399301374
Energy: 1.3858689749162854
Energy: 1.9802707484864748
Energy: 1.385868974917134
Energy: 1.40662521124988
Energy: 1.4970342086453636
Energy: 1.4600113117279008
Energy: 1.4970342086428179
Energy: 1.3898149919551568
Energy: 1.5984435921922602
Energy: 1.4645977908668175
Energy: 1.5984435921922602
Energy: 1.404946243922378
Energy: 1.494238241680197
Energy: 1.497872318804341
Energy: 1.4942382416835918
Energy: 1.454346418255411
Energy: 1.4784910737185994
Energy: 1.4341873057316714
Energy: 1.4784910737185994
Energy: 1.404830938631453
Energy: 1.5171143181070128
Energy: 1.6407607500783445
Energy: 1.5171143181061642
Energy: 1.5879223053509919
Energy: 1.6505152273696397
Energy: 1.4741128289056125
Energy: 1.6505152273696397
Energy: 1.404476739737476
Energy: 1.5169377643815496
Energy: 1.7938968353994995
Energy: 1.516937764380701

minimum gb energy = 1.3757181304031105 eV
minimum distance =  2.21404191526246 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 1.2652007043827054
Energy: 1.251517247865804
Energy: 1.7454902395779441
Energy: 1.251517247865804
Energy: 1.489220262919953
Energy: 1.2664935220360587
Energy: 1.2629643487758004
Energy: 1.2664935220360587
Energy: 1.3103365740502015
Energy: 1.335291877462018
Energy: 1.4895034990167153
Energy: 1.335291877462018
Energy: 1.2626863877067813
Energy: 1.2067358933671157
Energy: 1.5015317950549443
Energy: 1.2067358933671157
Energy: 1.2657520963549955
Energy: 1.3044872190647063
Energy: 1.4897358956969213
Energy: 1.3044872190647063
Energy: 1.3097033798782245
Energy: 1.3359898437662836
Energy: 1.3097883870024836
Energy: 1.3359898437665794
Energy: 1.2513775646995207
Energy: 1.304223401776489
Energy: 1.2657701919975857
Energy: 1.3042234017770804
Energy: 1.5014928981724518
Energy: 1.2067952070362504
Energy: 1.2626304426966142
Energy: 1.2067952070368089
Energy: 1.4894932478715837
Energy: 1.3354493940554293
Energy: 1.489658443012948
Energy: 1.3354493940551664

minimum gb energy = 1.2067358933671157 eV
minimum distance =  2.27644192545268 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 1.3120255957969813
Energy: 1.3133079256756939
Energy: 1.6811615606829702
Energy: 1.3133079256748923
Energy: 1.4292536550690094
Energy: 1.39991694110752
Energy: 1.332856734746984
Energy: 1.39991694110752
Energy: 1.2827419339332808
Energy: 1.425100805317144
Energy: 1.57041274297843
Energy: 1.4251008053163423
Energy: 1.2858568117144815
Energy: 1.392051873986678
Energy: 1.28958911027227
Energy: 1.3920518739874799
Energy: 1.3087274106428335
Energy: 1.3987450082161375
Energy: 1.4751862729417609
Energy: 1.3987450082153359
Energy: 1.4248283097411547
Energy: 1.4318082626485533
Energy: 1.2816409967301934
Energy: 1.4318082626485533
Energy: 1.2764223000089618
Energy: 1.3953526055158239
Energy: 1.2766070331254293
Energy: 1.3953526055158239
Energy: 1.2768679073915667
Energy: 1.434044731624994
Energy: 1.2992032704053638
Energy: 1.4340447316241927
Energy: 1.2845605367757686
Energy: 1.3967807663651846
Energy: 1.3349394317510108
Energy: 1.3967807663651846
Energy: 1.2840444481155182
Energy: 1.3963693801231227
Energy: 1.2866882249913796
Energy: 1.3963693801231227
Energy: 1.393061791428561
Energy: 1.5382771829855557
Energy: 1.2854374703982137
Energy: 1.5382771829855557
Energy: 1.337751031806232
Energy: 1.2993768328262967
Energy: 1.313178848495836
Energy: 1.2993768328262967
Energy: 1.3442413385108714
Energy: 1.3151778129938485
Energy: 1.3215943718789651
Energy: 1.3151778129938485
Energy: 1.306408953537716
Energy: 1.3133784745623545
Energy: 1.5626867760280023
Energy: 1.313378474563156
Energy: 1.30386018572474
Energy: 1.3937362722109405
Energy: 1.2852988500327218
Energy: 1.3937362722109405
Energy: 1.286376662753659
Energy: 1.305789861787259
Energy: 1.6212236620244667
Energy: 1.3057898617864574
Energy: 1.464927580832938
Energy: 1.299990442042349
Energy: 1.3091066813522283
Energy: 1.2999904420415473
Energy: 1.2918428192307179
Energy: 1.4315647219100422
Energy: 1.7770122853925898
Energy: 1.431564721909241
Energy: 1.2823069775684528
Energy: 1.3996596646658455
Energy: 1.2767801927434017
Energy: 1.3996596646650439
Energy: 1.303237659517685
Energy: 1.5352969166208557
Energy: 1.292166238033179
Energy: 1.535296916620054
Energy: 1.29595029281111
Energy: 1.3881799495342535
Energy: 1.2846536564764022
Energy: 1.3881799495342535
Energy: 1.3431380745399055
Energy: 1.3961005845848817
Energy: 1.2839580728587443
Energy: 1.3961005845848817
Energy: 1.287144163904179
Energy: 1.3146627922873666
Energy: 1.2974100649340943
Energy: 1.3146627922857634
Energy: 1.3124088755834866
Energy: 1.3285232590976483
Energy: 1.3359766722142592
Energy: 1.3285232590968465
Energy: 1.312138344233909
Energy: 1.309973115507093
Energy: 1.3328672979998923
Energy: 1.309973115507093
Energy: 1.3014908396478253
Energy: 1.3137015509157983
Energy: 1.3115968697602993
Energy: 1.3137015509166
Energy: 1.2883202519299857
Energy: 1.2746539653634994
Energy: 1.2923209090153864
Energy: 1.2746539653634994
Energy: 1.6456315766712264
Energy: 1.3596313606119237
Energy: 1.2864463265195327
Energy: 1.3596313606119237
Energy: 1.2974539634511595
Energy: 1.6181767891428471
Energy: 1.4750279645689253
Energy: 1.6181767891428471
Energy: 1.748925753756399
Energy: 1.4326725028679832
Energy: 1.2922354179539954
Energy: 1.4326725028671818
Energy: 1.2792452239749563
Energy: 1.2920562328421992
Energy: 1.75163962385817
Energy: 1.2920562328421992
Energy: 1.4649842378059128
Energy: 1.4006581948740373
Energy: 1.2979909673957344
Energy: 1.4006581948732357
Energy: 1.288592947560452
Energy: 1.3605904095577241
Energy: 1.2955933916880948
Energy: 1.3605904095585257

minimum gb energy = 1.2746539653634994 eV
minimum distance =  2.21294241357395 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 1.2744196040144726
Energy: 1.274425120779807
Energy: 1.8581617111768953
Energy: 1.2744251207786987
Energy: 1.2763227009517546
Energy: 1.399064565872882
Energy: 1.265121812100763
Energy: 1.3990645658739902
Energy: 1.237657732877635
Energy: 1.4461292352959296
Energy: 1.5075985296422187
Energy: 1.446129235294821
Energy: 1.3366479545608947
Energy: 1.3775848840344822
Energy: 1.244614286724794
Energy: 1.3775848840333738
Energy: 1.2634294709400413
Energy: 1.2781921632361555
Energy: 1.5619060576774888
Energy: 1.278192163235047
Energy: 1.260164810224608
Energy: 1.3424596728010751
Energy: 1.2446763604037425
Energy: 1.3424596727999665
Energy: 1.2377932671134644
Energy: 1.4119598182673319
Energy: 1.2492176938389663
Energy: 1.41195981826844
Energy: 1.237779516706058
Energy: 1.44630966687104
Energy: 1.2625674847795745
Energy: 1.4463096668732571
Energy: 1.273653674139658
Energy: 1.279247326848041
Energy: 1.3736972365778544
Energy: 1.279247326848041
Energy: 1.2735845276334756
Energy: 1.2789855944586335
Energy: 1.2625643832941287
Energy: 1.2789855944597421
Energy: 1.2377893330502514
Energy: 1.446403857086514
Energy: 1.3024556136239918
Energy: 1.4464038570876228
Energy: 1.2378299684383016
Energy: 1.4118217647622227
Energy: 1.2482391355118592
Energy: 1.4118217647600058
Energy: 1.2603464361682724
Energy: 1.3422857273355195
Energy: 1.2443454399551912
Energy: 1.3422857273355195
Energy: 1.2631093922035967
Energy: 1.2784635437823468
Energy: 1.2740867141522605
Energy: 1.2784635437845637
Energy: 1.3365100951134647
Energy: 1.3778925194597782
Energy: 1.2446868973636176
Energy: 1.3778925194597782
Energy: 1.2376614195838829
Energy: 1.4459885011135054
Energy: 1.4434160424162712
Energy: 1.4459885011146139
Energy: 1.276252456613365
Energy: 1.3992302892665003
Energy: 1.2651569406715866
Energy: 1.3992302892665003
Energy: 1.2744196040133644
Energy: 1.274425120779807
Energy: 1.6316691842312228
Energy: 1.2744251207786987
Energy: 1.2763227009539715
Energy: 1.399064565872882
Energy: 1.265121812100763
Energy: 1.3990645658750986
Energy: 1.237657732877635
Energy: 1.446129235294821
Energy: 1.7623288566895616
Energy: 1.446129235294821
Energy: 1.3366479545608947
Energy: 1.3775848840344822
Energy: 1.244614286724794
Energy: 1.3775848840333738
Energy: 1.2634294709400413
Energy: 1.2781921632372637
Energy: 1.5619060576774888
Energy: 1.2781921632361555
Energy: 1.260164810224608
Energy: 1.3424596728010751
Energy: 1.2446763604026339
Energy: 1.3424596728021836
Energy: 1.2377932671134644
Energy: 1.4119598182673319
Energy: 1.2492176938367494
Energy: 1.41195981826844

minimum gb energy = 1.237657732877635 eV
minimum distance =  2.23051035822001 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 1.2795508521299468
Energy: 1.2793446296231048
Energy: 1.6817547960382302
Energy: 1.2793446296203645
Energy: 1.594566571598126
Energy: 1.2701466318438108
Energy: 1.2546013118762538
Energy: 1.2701466318458663
Energy: 1.2502761668025235
Energy: 1.3740333148571557
Energy: 1.537478220235139
Energy: 1.3740333148564705
Energy: 1.4647885022893736
Energy: 1.2412299607317032
Energy: 1.2485657930021494
Energy: 1.2412299607323882
Energy: 1.2515363198325538
Energy: 1.279782908503346
Energy: 1.5816311877856934
Energy: 1.279782908503346
Energy: 1.282988675242424
Energy: 1.7901849741975566
Energy: 1.2646329748581222
Energy: 1.7901849741996116
Energy: 1.282930395682151
Energy: 1.3496545826195376
Energy: 1.2641139641538086
Energy: 1.3496545826188528
Energy: 1.245644115081195
Energy: 1.5470729355219548
Energy: 1.2465936827014445
Energy: 1.5470729355219548
Energy: 1.2636649563505538
Energy: 1.5332859684181774
Energy: 1.3312235000040957
Energy: 1.5332859684195477
Energy: 1.2633775837716303
Energy: 1.5368815527134057
Energy: 1.2627547214186359
Energy: 1.536881552714091
Energy: 1.2425880260602395
Energy: 1.3236897167180495
Energy: 1.2567081531348738
Energy: 1.32368971672079
Energy: 1.2420539966755575
Energy: 1.346183780853861
Energy: 1.2384166850192415
Energy: 1.346183780853176
Energy: 1.289297053243001
Energy: 1.523693193358082
Energy: 1.2528554657512163
Energy: 1.523693193357397
Energy: 1.2779426730732955
Energy: 1.3704449689451212
Energy: 1.2785723288333228
Energy: 1.3704449689451212
Energy: 1.275634624128718
Energy: 1.2487723773892316
Energy: 1.2919444411257663
Energy: 1.2487723773926571
Energy: 1.2579183294415004
Energy: 1.3763187163276065
Energy: 1.5821153270085984
Energy: 1.376318716328292
Energy: 1.2497265297012616
Energy: 1.2483166267754144
Energy: 1.2532609913065218
Energy: 1.248316626778155
Energy: 1.2425916820743574
Energy: 1.3878882152263399
Energy: 1.7497149993896994
Energy: 1.387888215227025
Energy: 1.4095817788942193
Energy: 1.2567928846645442
Energy: 1.2543404642446747
Energy: 1.2567928846652292
Energy: 1.2590220786960842
Energy: 1.2645073718395363
Energy: 1.6574574032901732
Energy: 1.2645073718402213
Energy: 1.3498371021814752
Energy: 1.2592846440392422
Energy: 1.2803146737944693
Energy: 1.2592846440392422
Energy: 1.279738967564267
Energy: 1.3891911267953454
Energy: 1.3511918554497016
Energy: 1.3891911267953454
Energy: 1.4719206375186806
Energy: 1.2572623128325704
Energy: 1.2614044988075412
Energy: 1.2572623128332554
Energy: 1.254663904043402
Energy: 1.2592748246341643
Energy: 1.4139563555906878
Energy: 1.2592748246355345
Energy: 1.5991110239611872
Energy: 1.387968955065146
Energy: 1.2453766468610945
Energy: 1.387968955065831
Energy: 1.2522899298215266
Energy: 1.3725377736057702
Energy: 1.2498916131859266
Energy: 1.372537773606455
Energy: 1.3935223113410156
Energy: 1.337620634689395
Energy: 1.2604142837267043
Energy: 1.3376206346900803
Energy: 1.2910842241697815
Energy: 1.5101690590361811
Energy: 1.2758048627150258
Energy: 1.510169059034811
Energy: 1.2786523057917567
Energy: 1.3694678895610648
Energy: 1.2785839860895827
Energy: 1.3694678895596946
Energy: 1.2525283318900908
Energy: 1.529691840750746
Energy: 1.2836637041852572
Energy: 1.529691840750746
Energy: 1.238422383309514
Energy: 1.3680277444623683
Energy: 1.2423096302471335
Energy: 1.368027744460998
Energy: 1.2565273925774028
Energy: 1.32103309004287
Energy: 1.2522570123133219
Energy: 1.32103309004287
Energy: 1.2604853952046378
Energy: 1.3473072983535659
Energy: 1.4104981830617005
Energy: 1.3473072983535659
Energy: 1.3309263688746713
Energy: 1.5263604457071787
Energy: 1.2670898420584438
Energy: 1.5263604457078015
Energy: 1.2453945287814219
Energy: 1.3889353146222507
Energy: 1.2934182461178778
Energy: 1.3889353146215657
Energy: 1.2640502299796037
Energy: 1.35187282521367
Energy: 1.2806899174995532
Energy: 1.351872825214355
Energy: 1.2610126110598778
Energy: 1.788175800531031
Energy: 1.282690738692806
Energy: 1.788175800531654
Energy: 1.3450515806133945
Energy: 1.2798339956300862
Energy: 1.2583718264062116
Energy: 1.2798339956314564

minimum gb energy = 1.2384166850192415 eV
minimum distance =  2.22088327309265 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 1.1425678390639717
Energy: 1.1428550763646186
Energy: 1.811783499357545
Energy: 1.142855076366411
Energy: 1.1431940082484737
Energy: 1.1825866733585775
Energy: 1.165598132674347
Energy: 1.18258667336037
Energy: 1.1618840498680891
Energy: 1.6774092995616092
Energy: 1.8919722265221905
Energy: 1.677409299642275
Energy: 1.2630993116790037
Energy: 1.182684369277261
Energy: 1.165461086762054
Energy: 1.182684369277261
Energy: 1.1613454254872637
Energy: 1.14533343088055
Energy: 1.5419358511243606
Energy: 1.1453334308823424
Energy: 1.161525600968204
Energy: 1.1434176392792081
Energy: 1.1420757529047287
Energy: 1.1434176392792081
Energy: 1.1620709570300318
Energy: 1.377275800234497
Energy: 1.1427036548528156
Energy: 1.377275800234497
Energy: 1.1949547033677879
Energy: 1.2456881147365244
Energy: 1.1642122110623088
Energy: 1.245688114738317
Energy: 1.1614319022738233
Energy: 1.2741670737800563
Energy: 1.1459022377523904
Energy: 1.2741670737800563
Energy: 1.1819933343556728
Energy: 1.142732994866911
Energy: 1.161350232121491
Energy: 1.1427329948687035
Energy: 1.1422903379199447
Energy: 1.1835272005854331
Energy: 1.1615321700949384
Energy: 1.1835272005854331
Energy: 1.1423598341554524
Energy: 1.3792410721295285
Energy: 1.1647593131252505
Energy: 1.3792410721295285
Energy: 1.1614048371413335
Energy: 1.1430864930925977
Energy: 1.1946593986256369
Energy: 1.1430864930925977
Energy: 1.1616493283808402
Energy: 1.2733212535255032
Energy: 1.1617030159150905
Energy: 1.2733212535255032
Energy: 1.1459297452124062
Energy: 1.143009108086806
Energy: 1.1613326149707957
Energy: 1.143009108086806

minimum gb energy = 1.1420757529047287 eV
minimum distance =  2.24365174037513 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 1.1731601683915913
Energy: 1.4159557149745576
Energy: 1.6681309581369888
Energy: 1.4159557149723037
Energy: 1.2462997936387368
Energy: 1.4385017375006393
Energy: 1.1314126915240228
Energy: 1.4385017374976337
Energy: 1.1406069283000042
Energy: 1.300832878817025
Energy: 1.3400046585884897
Energy: 1.3008328788155221
Energy: 1.131644739839719
Energy: 1.30037125521664
Energy: 1.1289683679354805
Energy: 1.3003712552128832
Energy: 1.147444776384652
Energy: 1.7237954386436445
Energy: 1.2197178830022573
Energy: 1.723795438645147
Energy: 1.1275876778160332
Energy: 1.3017623463795
Energy: 1.1460393019661304
Energy: 1.301762346384008
Energy: 1.1475793322317072
Energy: 1.6751956781539192
Energy: 1.527093743505727
Energy: 1.6751956781539192
Energy: 1.133401013523715
Energy: 1.4566452128811442
Energy: 1.1458818590731918
Energy: 1.4566452128818954
Energy: 1.1480151794964273
Energy: 1.2368818050402628
Energy: 1.3153669667790269
Energy: 1.236881805045522
Energy: 1.312434362418088
Energy: 1.455224001488341
Energy: 1.1290190352107907
Energy: 1.4552240014920976
Energy: 1.1476912292511743
Energy: 1.2588576862878968
Energy: 1.1287491090866713
Energy: 1.258857686285643
Energy: 1.4608302196224647
Energy: 1.3890084324530325
Energy: 1.1379289060507696
Energy: 1.3890084324507785
Energy: 1.1813968989668269
Energy: 1.1541895351520457
Energy: 1.169616036324086
Energy: 1.1541895351520457
Energy: 1.4148556080415113
Energy: 1.2571598522389786
Energy: 1.1361234061906325
Energy: 1.2571598522412326
Energy: 1.1480907632540787
Energy: 1.2969901850498662
Energy: 1.1399200693863876
Energy: 1.2969901850468608
Energy: 1.1270503921982977
Energy: 1.4588439432784914
Energy: 1.1261824672519807
Energy: 1.4588439432770572
Energy: 1.142463656246607
Energy: 1.2944529819126844
Energy: 1.12591686322939
Energy: 1.2944529818743666
Energy: 1.1678884787243897
Energy: 1.233316257245483
Energy: 1.1414612745468518
Energy: 1.233316257245483
Energy: 1.1430646267267526
Energy: 1.2906721130498506
Energy: 1.1412692119064922
Energy: 1.2906721128193293
Energy: 1.1424629877706158
Energy: 1.2911197776908516
Energy: 1.1414305343041056
Energy: 1.291119777687095
Energy: 1.1679403400111055
Energy: 1.2333042828235328
Energy: 1.141426656716683
Energy: 1.233304282825787
Energy: 1.142835146508084
Energy: 1.2946436452249843
Energy: 1.1260486974865744
Energy: 1.2946436452257355
Energy: 1.1272517086546348
Energy: 1.4586112442373396
Energy: 1.1262197991454888
Energy: 1.458611244240345
Energy: 1.1480682748608946
Energy: 1.2963963524879072
Energy: 1.1375353086808346
Energy: 1.2963963524849018
Energy: 1.4152304335514758
Energy: 1.257340788053887
Energy: 1.1378450091992527
Energy: 1.257340788056141
Energy: 1.1810984572676553
Energy: 1.1544106634616693
Energy: 1.1308609179702702
Energy: 1.1544106634624205
Energy: 1.460616139201911
Energy: 1.389039698364861
Energy: 1.136643744779094
Energy: 1.3890396983723743
Energy: 1.1470642665596131
Energy: 1.2592799324465633
Energy: 1.1250283644706864
Energy: 1.2592799324480661
Energy: 1.3124179169668344
Energy: 1.676091559503258
Energy: 1.128942401629652
Energy: 1.6760915595025063
Energy: 1.1477498280040157
Energy: 1.236995514925186
Energy: 1.2737267625816528
Energy: 1.2369955149289427
Energy: 1.1333255167064706
Energy: 1.4581466020556995
Energy: 1.1458425838837416
Energy: 1.4581466020556995
Energy: 1.1478096082972409
Energy: 1.6743127811504674
Energy: 1.4171449298364747
Energy: 1.6743127811489646
Energy: 1.1278028719667428
Energy: 1.302052688366284
Energy: 1.1459042184552848
Energy: 1.3020526883700407
Energy: 1.1471896865885418
Energy: 1.724241245261162
Energy: 1.4286907201915537
Energy: 1.7242412452589082
Energy: 1.1316576498867035
Energy: 1.3003032586559309
Energy: 1.1289438800502236
Energy: 1.300303258654428

minimum gb energy = 1.1250283644706864 eV
minimum distance =  2.21697598964083 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 1.223302823135056
Energy: 1.2224868177075539
Energy: 1.0955787259997194
Energy: 1.2224868177075539
Energy: 1.312193118253497
Energy: 1.4427261939066098
Energy: 1.0628538011910955
Energy: 1.4427261939066098
Energy: 1.0844647999602914
Energy: 1.706119577939253
Energy: 1.410969588374551
Energy: 1.706119577939253
Energy: 1.1619505986827658
Energy: 1.2077860072961286
Energy: 1.0628837402629066
Energy: 1.2077860072961286
Energy: 1.061845651971064
Energy: 1.0894246687434763
Energy: 1.2037877183914099
Energy: 1.0894246687434763
Energy: 1.069737989345273
Energy: 1.5619210847889913
Energy: 1.1642385514058868
Energy: 1.5619210847889913
Energy: 1.0779312131677603
Energy: 1.7043323504831855
Energy: 1.4167810120972766
Energy: 1.704332350481893
Energy: 1.0442991747779022
Energy: 1.0905601961805877
Energy: 1.0918728270698277
Energy: 1.090560196179295
Energy: 1.0633405956398132
Energy: 1.4420899179226923
Energy: 1.3006267007729038
Energy: 1.442089917923985
Energy: 1.4109012287421292
Energy: 1.572804682812405
Energy: 1.1643232677131499
Energy: 1.572804682812405
Energy: 1.0864266699254967
Energy: 1.511443463802845
Energy: 1.1622826915480045
Energy: 1.511443463802845
Energy: 1.353157993874223
Energy: 1.5037941447705687
Energy: 1.0626905782064002
Energy: 1.5037941447705687
Energy: 1.1616528168870306
Energy: 1.4422986507431457
Energy: 1.048462255113567
Energy: 1.4422986507431457
Energy: 1.4162431839787377
Energy: 1.809829805889188
Energy: 1.0443683494907607
Energy: 1.809829805889188
Energy: 1.2220643561028843
Energy: 1.2581952936015315
Energy: 1.0443395695691307
Energy: 1.2581952936015315
Energy: 1.2228622371562423
Energy: 1.4426908419912599
Energy: 1.0623009125288194
Energy: 1.4426908419912599
Energy: 1.1616396764294503
Energy: 1.8287297303857668
Energy: 1.0714902069678403
Energy: 1.8287297303857668
Energy: 1.161955832658145
Energy: 1.5099289473434365
Energy: 1.0612329329146146
Energy: 1.5099289473434365
Energy: 1.0613588342510618
Energy: 1.0905511527529212
Energy: 1.0614122524289147
Energy: 1.090551152754214
Energy: 1.0616780299471023
Energy: 1.4424082053768925
Energy: 1.1620972154139009
Energy: 1.4424082053755998

minimum gb energy = 1.0442991747779022 eV
minimum distance =  2.21472110847521 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 1.129369381229614
Energy: 1.2361403174771999
Energy: 0.9731924123312337
Energy: 1.2361403174761905
Energy: 1.4524116418440398
Energy: 1.3341452743837408
Energy: 0.9721717751406195
Energy: 1.3341452743837408
Energy: 1.0633497524893605
Energy: 1.064536943601898
Energy: 1.2286554412108088
Energy: 1.064536943600889
Energy: 1.1435105491054784
Energy: 1.2682644894659638
Energy: 0.9810007911915305
Energy: 1.268264489466973
Energy: 0.9890496202412239
Energy: 1.3332313977889985
Energy: 1.0612768715702097
Energy: 1.333231397790008
Energy: 1.0376379124249837
Energy: 1.3320861571300147
Energy: 0.990966660386379
Energy: 1.3320861571300147
Energy: 0.9748086970502651
Energy: 0.9660981284022119
Energy: 1.2744661041820196
Energy: 0.9660981284022119
Energy: 0.9587504061697802
Energy: 1.2756277551320876
Energy: 1.0655050825966401
Energy: 1.2756277551341064
Energy: 0.9712179491364294
Energy: 1.3329956295546126
Energy: 1.3396902686458085
Energy: 1.3329956295556218
Energy: 0.9461542237770751
Energy: 1.140169795214362
Energy: 1.0318014603588468
Energy: 1.140169795214362
Energy: 0.9750522242509279
Energy: 0.9685341560756103
Energy: 1.3194086755594907
Energy: 0.9685341560735915
Energy: 1.2294620400066554
Energy: 1.3852030409524045
Energy: 1.0656818006543636
Energy: 1.385203040953414
Energy: 0.983123796458193
Energy: 1.2686615380828556
Energy: 1.2397010499893548
Energy: 1.2686615380899213
Energy: 1.2090439060807747
Energy: 1.265421963140668
Energy: 0.9910847592476154
Energy: 1.2654219631396586
Energy: 0.9895368133460914
Energy: 0.9688061450208555
Energy: 1.0354063280627674
Energy: 0.9688061450228742
Energy: 1.273610228217324
Energy: 1.502191624716003
Energy: 0.9732752716820942
Energy: 1.502191624716003
Energy: 1.0681478314639017
Energy: 1.2762042733593852
Energy: 0.94850334391355
Energy: 1.276204273361404
Energy: 1.2568521372801789
Energy: 1.2531588981520823
Energy: 0.9722849509913398
Energy: 1.2531588981520823
Energy: 1.1320378514605638
Energy: 0.9864356768788829
Energy: 0.9464821453107937
Energy: 0.986435676881911
Energy: 1.448143648853081
Energy: 1.4745281885198211
Energy: 0.973673511831272
Energy: 1.4745281885248682
Energy: 1.0687364639476056
Energy: 1.2194853992153791
Energy: 0.9605847377077905
Energy: 1.2194853992093229
Energy: 1.0630701381015768
Energy: 1.268822427730253
Energy: 0.9806240560253664
Energy: 1.268822427729244
Energy: 0.9897931541776895
Energy: 1.17271168214567
Energy: 1.2099034413217464
Energy: 1.1727116821436512
Energy: 1.0351954953239957
Energy: 1.4708944386569833
Energy: 0.9898134843160861
Energy: 1.4708944386579927
Energy: 0.9736700867648127
Energy: 1.1930778868426009
Energy: 1.273626890575211
Energy: 1.1930778868295249
Energy: 0.9540932979453076
Energy: 1.192099650999906
Energy: 1.0630554538724986
Energy: 1.1920996510009152

minimum gb energy = 0.9461542237770751 eV
minimum distance =  2.22713109040059 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 1.1818641223326212
Energy: 1.186051465075092
Energy: 0.8880039712245636
Energy: 1.1860514650850222
Energy: 1.2502539036310343
Energy: 1.1734445155577344
Energy: 0.8823309456070589
Energy: 1.1734445155569067
Energy: 0.9115502860657922
Energy: 1.1628594476015142
Energy: 1.5507144228670218
Energy: 1.1628594476015142
Energy: 1.1783883006718574
Energy: 1.1710817719300284
Energy: 0.882492060376803
Energy: 1.1710817719283735
Energy: 0.8763517585563081
Energy: 1.20198474282922
Energy: 0.9544455315405108
Energy: 1.2019847428283925
Energy: 0.9489744579603241
Energy: 1.1731913366678153
Energy: 0.8824640405178249
Energy: 1.1731913366694702
Energy: 0.8812961754079194
Energy: 1.1716941205878084
Energy: 0.9494887080692775
Energy: 1.1716941205878084
Energy: 0.8641211291027379
Energy: 1.0491257978492627
Energy: 0.8776565957268687
Energy: 1.0491257978492627
Energy: 0.8856231264308695
Energy: 1.1837027967572842
Energy: 1.172901862053524
Energy: 1.183702796758939
Energy: 0.8662686035932298
Energy: 1.1668448791536996
Energy: 0.9127911692119764
Energy: 1.166844879152872
Energy: 0.8813956652217297
Energy: 1.1722271313191306
Energy: 1.3337743883115067
Energy: 1.1722271313199581
Energy: 0.8679579173212905
Energy: 1.1843966308138247
Energy: 1.183198796717562
Energy: 1.1843966308129972
Energy: 0.88562607715628
Energy: 1.366584366075554
Energy: 1.4244281593600094
Energy: 1.3665843660747266
Energy: 1.0984292724342808
Energy: 1.419510922962757
Energy: 0.9127585749722926
Energy: 1.4195109229644118
Energy: 0.8814047691439828
Energy: 1.171284122540638
Energy: 1.1627022633870447
Energy: 1.171284122537328
Energy: 1.081829200297192
Energy: 1.211035724313836
Energy: 0.8776473973450156
Energy: 1.2110357243146639
Energy: 0.8856436650138368
Energy: 1.0489590122060541
Energy: 1.1081897179893807
Energy: 1.0489590121986065
Energy: 1.0740772310343447
Energy: 1.0837375873273778
Energy: 0.8824685504920421
Energy: 1.0837375873257227
Energy: 0.8813889149536557
Energy: 1.0490331495910767
Energy: 0.8636425707180668
Energy: 1.0490331495927319
Energy: 1.0683334760440197
Energy: 1.1835962114409155
Energy: 0.8853740983447289
Energy: 1.1835962114409155
Energy: 0.9161696573905537
Energy: 1.0484740164880295
Energy: 0.8664126607954672
Energy: 1.0484740164905122
Energy: 1.3364779792461392
Energy: 1.2967904827404815
Energy: 0.8824877812148089
Energy: 1.296790482741309
Energy: 1.187248380698328
Energy: 1.1849887264132073
Energy: 0.8680098029605793
Energy: 1.184988726423965
Energy: 1.182517324532061
Energy: 1.048830073810637
Energy: 0.8855446062287314
Energy: 1.0488300738023617
Energy: 0.9161145311570844
Energy: 1.2791149136342947
Energy: 0.8729462890667061
Energy: 1.2791149136318123
Energy: 1.1634440144593923
Energy: 1.543737098727525
Energy: 0.8826033939406428
Energy: 1.543737098727525
Energy: 0.8815420615085342
Energy: 1.073727032262138
Energy: 1.0822763571531016
Energy: 1.0737270322497252
Energy: 0.8772481341717472
Energy: 1.3675400407488782
Energy: 0.8857897531863982
Energy: 1.367540040748051
Energy: 0.8860968870082624
Energy: 1.1411472606151405
Energy: 1.0736875080338608
Energy: 1.1411472605597717
Energy: 0.8633548946329331
Energy: 1.4190404579697884
Energy: 0.8834942075048734
Energy: 1.4190404579697884
Energy: 0.8816449262376519
Energy: 1.0475814111993709
Energy: 1.0675915216830456
Energy: 1.0475814111985433
Energy: 0.8674013422908445
Energy: 1.3678707998735011
Energy: 0.920924913191657
Energy: 1.3678707998743287

minimum gb energy = 0.8633548946329331 eV
minimum distance =  2.21626500610732 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 1.085165330393157
Energy: 0.8366614213384421
Energy: 1.2899742740555464
Energy: 0.8366614213384421
Energy: 1.5475242650983068
Energy: 0.9500810806678599
Energy: 0.8320121734735045
Energy: 0.9500810806720662
Energy: 0.86251743503182
Energy: 1.0649745600940264
Energy: 1.467071835343869
Energy: 1.0649745600940264
Energy: 1.1988717452678999
Energy: 0.949998462327799
Energy: 0.8320873197300734
Energy: 0.949998462326397
Energy: 0.8280586188432508
Energy: 0.9875409903918819
Energy: 0.8748995640043731
Energy: 0.9875409903932841
Energy: 1.0507094077634458
Energy: 0.9489127251602119
Energy: 0.8322600537179874
Energy: 0.9489127251595109
Energy: 0.8312579066409403
Energy: 1.0752831330948192
Energy: 0.8697844260075039
Energy: 1.0752831330843036
Energy: 0.9367793369529536
Energy: 1.0742171545362216
Energy: 0.8322015682431553
Energy: 1.0742171545355206
Energy: 0.8344147554865425
Energy: 0.9618858908298359
Energy: 0.9949828732125774
Energy: 0.961885892817062
Energy: 0.8002351726797563
Energy: 0.9457818597279128
Energy: 0.8290592244812345
Energy: 0.9457818596893562
Energy: 0.831254140972878
Energy: 1.0637098217926946
Energy: 1.2339718918875078
Energy: 1.0637098217919934
Energy: 0.8019514655627
Energy: 1.0630008808696119
Energy: 0.8631001007872198
Energy: 1.063000880871014
Energy: 0.8345105817204506
Energy: 0.8488929224467161
Energy: 1.3167934015619338
Energy: 0.8488929224474171
Energy: 0.8031634484419398
Energy: 0.8368367291932133
Energy: 1.0858934801820048
Energy: 0.8368367291946155
Energy: 0.8315015241092458
Energy: 0.9499073912378883
Energy: 1.3417453389940843
Energy: 0.9499073912371873
Energy: 0.9979895509835403
Energy: 1.0626945176021145
Energy: 0.8633293919886783
Energy: 1.0626945176014135
Energy: 0.8344511483573401
Energy: 0.8468927241627671
Energy: 1.2015327377831582
Energy: 0.8468927241732827
Energy: 0.986215579081129
Energy: 1.1046552291044058
Energy: 0.8289343084167426
Energy: 1.1046552291058078
Energy: 0.8313152472661796
Energy: 0.9494726669122974
Energy: 1.049885483004523
Energy: 0.9494726669094932
Energy: 0.9807811881899784
Energy: 1.0874595590622216
Energy: 0.8322013157254796
Energy: 1.0874595590608194
Energy: 0.8343817392649407
Energy: 0.9764643613773768
Energy: 0.9382123190291269
Energy: 0.9764643591126706
Energy: 0.9820363614353572
Energy: 1.0974796811525291
Energy: 0.8375753810393117
Energy: 1.0974796811525291
Energy: 0.8313489040370836
Energy: 0.945516980095164
Energy: 0.8001010869785095
Energy: 0.945516980095164
Energy: 1.2149099493392213
Energy: 0.9461920278293726
Energy: 0.8320474308478388
Energy: 0.946192027837785
Energy: 0.8656092263863611
Energy: 0.9793116316277292
Energy: 0.80372397877171
Energy: 0.9793116316116053
Energy: 1.2320257234674747
Energy: 0.9586383884576906
Energy: 0.8380240876466072
Energy: 0.9586383884380617
Energy: 1.0886437227000367
Energy: 0.9460753300945023
Energy: 0.803519764218278
Energy: 0.9460753300973064
Energy: 1.339066420655428
Energy: 0.8297885818619667
Energy: 0.8321384980669858
Energy: 0.8297885818633687
Energy: 0.8655640489393467
Energy: 1.1710656479765582
Energy: 0.8093269226433909
Energy: 1.1710656479786614
Energy: 1.0617391613496
Energy: 0.8467475487695966
Energy: 0.8380268254429272
Energy: 0.8467475487688955
Energy: 0.8314428955051207
Energy: 1.0258425531133775
Energy: 0.9862362782818955
Energy: 1.025842489401308
Energy: 1.049471932366498
Energy: 0.9447657754078562
Energy: 0.8320996901470171
Energy: 0.9447657753076729
Energy: 0.8344189564559196
Energy: 1.0593666572206926
Energy: 0.9806659523802697
Energy: 1.059366645393249
Energy: 0.8076412491830858
Energy: 0.9783526916947406
Energy: 0.8380717861221348
Energy: 0.9783526916927012
Energy: 0.824959637383958
Energy: 1.0276332690070777
Energy: 0.9823582861999118
Energy: 1.027633269035119
Energy: 0.8000396557126106
Energy: 0.94560858428485
Energy: 0.83521460380205
Energy: 0.9456085842743344
Energy: 0.8346332633815264
Energy: 0.9769007506197595
Energy: 1.2150950940626175
Energy: 0.9769007506183573

minimum gb energy = 0.8000396557126106 eV
minimum distance =  2.22802454060544 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 1.0355748210774114
Energy: 1.302557718717502
Energy: 1.3247548364639161
Energy: 1.302557718717502
Energy: 1.4169818443133544
Energy: 0.8973520433045288
Energy: 0.7666692709584172
Energy: 0.8973520433045288
Energy: 0.9870804785230696
Energy: 0.9878210041264963
Energy: 0.9920488172254482
Energy: 0.9878210058488053
Energy: 1.214831815750429
Energy: 0.897762069102552
Energy: 0.766863522076681
Energy: 0.897762069101944
Energy: 0.8070678998795071
Energy: 0.9547640003126482
Energy: 0.7280629703043695
Energy: 0.9547640003126482
Energy: 1.0759976316228939
Energy: 0.9022341179103512
Energy: 0.7665850453212898
Energy: 0.9022341179133637
Energy: 0.7626764191848246
Energy: 1.0106747621611567
Energy: 0.8458194872767446
Energy: 1.0106747621721008
Energy: 0.9404593215636197
Energy: 0.8976054059924623
Energy: 0.7666820700257682
Energy: 0.8976054068633448
Energy: 0.765710660975573
Energy: 0.9692978518836443
Energy: 0.9532275736089358
Energy: 0.9692978518836443
Energy: 0.8427575739147916
Energy: 1.01072686802338
Energy: 0.7637069031881056
Energy: 1.0107268679188588
Energy: 0.766035108105869
Energy: 1.0056615246855938
Energy: 1.101691454869198
Energy: 1.0056615246886338
Energy: 0.7253827135346484
Energy: 0.8968549377793836
Energy: 0.8079491141894066
Energy: 0.8968549377818157
Energy: 0.7660207980706524
Energy: 0.9697416723855549
Energy: 1.2101075783253339
Energy: 0.9697416723843388
Energy: 0.7279715349824689
Energy: 0.9878581250432227
Energy: 0.9879836882195534
Energy: 0.9878581250432227
Energy: 0.766320050946059
Energy: 0.8973064664433321
Energy: 1.3193210007212366
Energy: 0.8973064664445481
Energy: 0.7274680001124783
Energy: 0.8156206925178169
Energy: 1.0364111743812472
Energy: 0.8156206925184247
Energy: 0.7658174980918906
Energy: 0.9698469059554587
Energy: 1.3195398796542723
Energy: 0.9698469059548508
Energy: 0.8991627218697616
Energy: 0.9875162796734396
Energy: 0.9879418892341342
Energy: 0.9875162796728315
Energy: 0.7661823283288186
Energy: 0.8974107585940733
Energy: 1.2152351508665427
Energy: 0.8974107585946813
Energy: 0.8851684152003911
Energy: 0.9326936449246697
Energy: 0.8080008335031578
Energy: 0.9326936449234537
Energy: 0.7660503747621386
Energy: 0.9697587777374197
Energy: 1.0760136415850021
Energy: 0.9697587777374197
Energy: 0.8829200021636897
Energy: 1.0060240220007686
Energy: 0.7635957444991581
Energy: 1.0060240220007686
Energy: 0.7665557667511778
Energy: 0.8973390096567834
Energy: 0.9404032390510907
Energy: 0.8973390098725141
Energy: 0.8888357326012367
Energy: 1.1796972937540073
Energy: 0.7666504912518838
Energy: 1.1796972937503594
Energy: 0.7659849586749388
Energy: 0.8971232954653551
Energy: 0.8332079904423685
Energy: 0.8971232954653551
Energy: 1.0924687494671816
Energy: 0.987329179343261
Energy: 0.7667043631934101
Energy: 0.9873291793450852
Energy: 0.8099944535029807
Energy: 0.8967307693411903
Energy: 0.7250809308456716
Energy: 0.8967307692761892
Energy: 1.0978119064881602
Energy: 0.9389784189216538
Energy: 0.7661811256071924
Energy: 0.9389784189204379
Energy: 0.990572921290363
Energy: 0.9874037610943937
Energy: 0.7281583154149279
Energy: 0.9874037610950017
Energy: 1.31960321876133
Energy: 0.8974930336402532
Energy: 0.7661760607402205
Energy: 0.8974930336378211
Energy: 1.0387218396678362
Energy: 1.0061622330864821
Energy: 0.7275098467302655
Energy: 1.0061622330864821
Energy: 1.2498320654150663
Energy: 1.0285131896904716
Energy: 0.7662660664273043
Energy: 1.0285131896898634
Energy: 0.9906707525499838
Energy: 0.9874619731548201
Energy: 0.7359986597300906
Energy: 0.9874619731554282
Energy: 1.2270442590269366
Energy: 0.8977847433576042
Energy: 0.7662304953515227
Energy: 0.8977847433576042
Energy: 0.8101401278388893
Energy: 1.037403986205199
Energy: 0.8863922015637808
Energy: 1.037403986205199
Energy: 0.9557309365422604
Energy: 1.3187244938276104
Energy: 0.7664890671666215
Energy: 1.3187244938282188
Energy: 0.7659500771868142
Energy: 1.007090477894255
Energy: 0.8823683733467448
Energy: 1.007090477894863
Energy: 0.9401897352185545
Energy: 0.9875410738687141
Energy: 0.765559553767395
Energy: 0.9875410738699302
Energy: 0.7666029042193242
Energy: 0.8967804581008052
Energy: 0.8890327158342696
Energy: 0.8967804737718256
Energy: 0.7350297520612757
Energy: 1.2052237851675025
Energy: 0.7624954940549462
Energy: 1.2052237851681102
Energy: 0.7654604101965395
Energy: 0.8966381272258349
Energy: 1.0922447799673254
Energy: 0.8966381271340815
Energy: 0.7250172106530554
Energy: 0.8965929608134895
Energy: 0.8067544896601825
Energy: 0.8965929608128815
Energy: 0.7663447066868022
Energy: 0.8070160974569494
Energy: 1.0972751250513315
Energy: 0.8070160974575574

minimum gb energy = 0.7250172106530554 eV
minimum distance =  2.26274591877469 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.02052193273580114
Energy: 0.02125752445364669
Energy: 1.1302307358959074
Energy: 0.021257524452763823
Energy: 1.1292642667012744
Energy: 1.814222264189081
Energy: 0.4612406222700987
Energy: 1.8142222641881462
Energy: 0.02052193273580114
Energy: 0.02125752445364669
Energy: 1.1302307358963746
Energy: 0.021257524453179286
Energy: 1.1292642667012744
Energy: 1.814222264189081
Energy: 0.4612406222705142
Energy: 1.8142222641867962
Energy: 0.02052193273580114
Energy: 0.021257524454114097
Energy: 1.130230735830575
Energy: 0.021257524453179286
Energy: 1.1292642667012744
Energy: 1.8142222641886139
Energy: 0.4612406222705142
Energy: 1.8142222641886139

minimum gb energy = 0.02052193273580114 eV
minimum distance =  2.44519001787315 Angstroms
sigma value = 1