Model name: model_name=EAM_IMD_BrommerGaehler_2006A_AlNiCo__MO_122703700223_003
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.128871455788613
cohesive_energy=3.7144354827541424
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.53307330188668e-19, 2.72959628781312e-19, 3.1593641481172796e-19, 3.4645627751279396e-19, 3.7803838332220197e-19, 4.0803753861721796e-19, 4.36134910247676e-19, 4.60387057956534e-19, 4.8013228279395e-19, 4.96259792791794e-19, 5.098750898275259e-19, 5.21466837774516e-19, 5.31483646090284e-19, 5.4157575670785e-19, 5.518200741056459e-19, 5.61477994855398e-19, 5.70081683379978e-19, 5.77373189241312e-19, 5.83259586194628e-19, 5.87837004837966e-19, 5.91206382299268e-19, 5.93452633940136e-19, 5.94689514301584e-19, 5.95070832340476e-19, 5.946574707689039e-19, 5.9332285763278195e-19, 5.909308079182199e-19, 5.873595562010339e-19, 5.825001544701119e-19, 5.76242052537708e-19, 5.684730980394419e-19, 5.590474929016199e-19, 5.477569541618219e-19, 5.34329111792268e-19, 5.18518832767956e-19, 4.99883916337902e-19, 4.77644102481348e-19, 4.50693889320834e-19, 4.1738784145324197e-19, 3.75338715693912e-19, 3.21478343788734e-19, 2.5215696736545595e-19, 1.63737645464898e-19, 5.2003769621698797e-20, -9.06806340017856e-20, -2.8015660622123996e-19, -4.17240441202914e-19, -5.8301605534626e-19, -9.08748178098264e-19, -1.46817058033224e-18, -2.4868344842294397e-18, -4.25568555346446e-18, -7.39646445262734e-18, -1.3253397377644079e-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: 0.010981148399131613
Energy: 0.04610878060290889
Energy: 0.38441392964670346
Energy: 0.011468453260527943
Energy: 0.04610878060477871
Energy: 0.34805677817118985
Energy: 0.046108780603362993
Energy: 0.34805677817073577
Energy: 0.38441392964809246
Energy: 0.0461087806038438
Energy: 0.010981148399131613
Energy: 0.046108780601973993
Energy: 0.011468453260527943
Energy: 0.3480567781660346
Energy: 0.046108780601973993
Energy: 0.34805677816745023

minimum gb energy = 0.010981148399131613 eV
minimum distance =  2.83816668483231 Angstroms
sigma value = 1


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

Energy: 0.6748751299240091
Energy: 0.4701076694758351
Energy: 0.4711887644201952
Energy: 0.43080436728329863
Energy: 0.43439571747404265
Energy: 0.4636439233603067
Energy: 0.4346772296413466
Energy: 0.4636439233614729
Energy: 0.4710005221280507
Energy: 0.4703748620223512
Energy: 0.4579885044907396
Energy: 0.4703748620206284
Energy: 0.4347512225938743
Energy: 0.4356196242885988
Energy: 0.43469100804572286
Energy: 0.4356196242891819
Energy: 0.4595357978650518
Energy: 0.4345488718511661
Energy: 0.4354396807898648
Energy: 0.43454887185060953
Energy: 0.4579148729603464
Energy: 0.46869193735280296
Energy: 0.43556464079970614
Energy: 0.46869193735280296
Energy: 0.45126710344723336
Energy: 0.45472969401473423
Energy: 0.4597691787430744
Energy: 0.45472969401590047
Energy: 0.45117760526554945
Energy: 0.4550971910931753
Energy: 0.46846576569811077
Energy: 0.4550971910925922
Energy: 0.4581288802831219
Energy: 0.4580012160510177
Energy: 0.45679238650411913
Energy: 0.45800121605160077
Energy: 0.4634803719447293
Energy: 0.4580440177343472
Energy: 0.45796748436291795
Energy: 0.4580440177360965
Energy: 0.4560043499017181
Energy: 0.45723133751971967
Energy: 0.45693594186944286
Energy: 0.45723133751971967
Energy: 0.4532777500264413
Energy: 0.4563915102756
Energy: 0.4683261965322002
Energy: 0.4563915102756
Energy: 0.45305244942275635
Energy: 0.4544373701290521
Energy: 0.4626047648810165
Energy: 0.45443737012963525
Energy: 0.45779468093059683
Energy: 0.45479835362653337
Energy: 0.45101165757107997
Energy: 0.4547983536259502
Energy: 0.45124244234039473
Energy: 0.43472230472984297
Energy: 0.4348717977494325
Energy: 0.43472230473100926
Energy: 0.44976570630770984
Energy: 0.43513384659474347
Energy: 0.43462151746422517
Energy: 0.4351338465953266
Energy: 0.47061038316086784
Energy: 0.47037980367803334
Energy: 0.4693345417364436
Energy: 0.470379803676284
Energy: 0.434505257289463
Energy: 0.435179245732983
Energy: 0.4388198206303272
Energy: 0.435179245732983
Energy: 0.46684206762425295
Energy: 0.4704561394994439
Energy: 0.47203200188982813
Energy: 0.4704561394994439
Energy: 0.45547417246050936
Energy: 0.4349153149991372
Energy: 0.4344248426590982
Energy: 0.4349153149985541
Energy: 0.43703675652821644
Energy: 0.43598051448936354
Energy: 0.46038345926949104
Energy: 0.43598051448878045
Energy: 0.43523214392618953
Energy: 0.4347467900287165
Energy: 0.45541110936017554
Energy: 0.4347467900281334
Energy: 0.4600847211674944
Energy: 0.4694764914846982
Energy: 0.4500526998251487
Energy: 0.4694764914852813
Energy: 0.47021244859107214
Energy: 0.45592719529338116
Energy: 0.44986378424943824
Energy: 0.45592719529338116
Energy: 0.45693387933255214
Energy: 0.4574360979465412
Energy: 0.45764732975275213
Energy: 0.457436097945375
Energy: 0.45844571074114454
Energy: 0.45625615360619737
Energy: 0.4645313376695852
Energy: 0.45625615360619737
Energy: 0.4569638151589903
Energy: 0.45742713347289043
Energy: 0.4558146076513541
Energy: 0.45742713347289043
Energy: 0.4669491123473922
Energy: 0.45634940579982963
Energy: 0.4635613393524644
Energy: 0.4563494058004127
Energy: 0.4510743922045954
Energy: 0.45438541463221677
Energy: 0.45286323345136636
Energy: 0.45438541463279986
Energy: 0.45086584148937336
Energy: 0.45638769468949175
Energy: 0.4575643839077559
Energy: 0.45638769469007484
Energy: 0.4348046386408276
Energy: 0.43462635569661734
Energy: 0.4509828671011135
Energy: 0.43462635569661734
Energy: 0.4345583541366059
Energy: 0.4351437739723765
Energy: 0.44953966326505235
Energy: 0.4351437739723765
Energy: 0.4497261802463181
Energy: 0.4363908904062262
Energy: 0.47117578642746955
Energy: 0.4363908904062262

minimum gb energy = 0.43080436728329863 eV
minimum distance =  2.5701725657809 Angstroms
sigma value = 1


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

Energy: 0.7680006574618983
Energy: 0.48731826998337546
Energy: 0.4877267534335447
Energy: 0.4429714040697154
Energy: 0.44972525029711063
Energy: 0.47840492533551027
Energy: 0.44959378224076163
Energy: 0.47840492533551027
Energy: 0.48706250223601
Energy: 0.4873988758119358
Energy: 0.4740547212164342
Energy: 0.4873988758092764
Energy: 0.450281602262011
Energy: 0.45037427759426885
Energy: 0.4494628644393287
Energy: 0.4503742775949337
Energy: 0.45074550798828406
Energy: 0.44926895166499087
Energy: 0.45099200488667474
Energy: 0.44926895166698544
Energy: 0.47583838698095343
Energy: 0.488180167856108
Energy: 0.4495923256682112
Energy: 0.4881801678574377
Energy: 0.4721212824017427
Energy: 0.47605217585686027
Energy: 0.4820115572836371
Energy: 0.47605217585622567
Energy: 0.4699251409583185
Energy: 0.4771123243175539
Energy: 0.4887150260577232
Energy: 0.47711232431555933
Energy: 0.46931868788913117
Energy: 0.4838910593485124
Energy: 0.47613348113927934
Energy: 0.4838910593518366
Energy: 0.48909547105600887
Energy: 0.4841655018507739
Energy: 0.47173583101086913
Energy: 0.48416550185143875
Energy: 0.45731343407259156
Energy: 0.4757564455627944
Energy: 0.4715098751710072
Energy: 0.4757564455647587
Energy: 0.47225886173667314
Energy: 0.4766575042276396
Energy: 0.47566371486343983
Energy: 0.4766575042276396
Energy: 0.4503003820431758
Energy: 0.44963987707138775
Energy: 0.47245993154187815
Energy: 0.44963987706739866
Energy: 0.4494300860950306
Energy: 0.45009935741759666
Energy: 0.46595640027397534
Energy: 0.4500993574189263
Energy: 0.44116885332544464
Energy: 0.48730581498226094
Energy: 0.48762446849088414
Energy: 0.48730581498359066
Energy: 0.4577118434334304
Energy: 0.4504447229447868
Energy: 0.44933527546806007
Energy: 0.4504447229447868
Energy: 0.4879465249386469
Energy: 0.4872267416481324
Energy: 0.4506308810849004
Energy: 0.4872267416481324
Energy: 0.4496364126140108
Energy: 0.4500891620475202
Energy: 0.4762311048382159
Energy: 0.4500891620508445
Energy: 0.44966520354432665
Energy: 0.4511693207138145
Energy: 0.4507578872580281
Energy: 0.45116932071447935
Energy: 0.4759592254968574
Energy: 0.4502659946565133
Energy: 0.45041063040239393
Energy: 0.4502659946545187
Energy: 0.47028915867201826
Energy: 0.48967629221314274
Energy: 0.48152596410257675
Energy: 0.48967629221114817
Energy: 0.4689825897058344
Energy: 0.4774974191379117
Energy: 0.49059477229711773
Energy: 0.4774974191359172
Energy: 0.4694098968638463
Energy: 0.48428750740484733
Energy: 0.47612626831227284
Energy: 0.48428750740617704
Energy: 0.48864851301081536
Energy: 0.48371897518815454
Energy: 0.4702009238914962
Energy: 0.4837189751888194
Energy: 0.457171517768161
Energy: 0.47552416451888657
Energy: 0.4725703168464429
Energy: 0.47552416451822166
Energy: 0.47206974377388594
Energy: 0.4763767039513016
Energy: 0.47900954532286427
Energy: 0.47637670395196646
Energy: 0.45022422672212037
Energy: 0.4499534407301139
Energy: 0.45724752070674024
Energy: 0.44995344073077875
Energy: 0.44953605525344986
Energy: 0.45006596728618303
Energy: 0.4657978406115316
Energy: 0.4500659672828588
Energy: 0.4405944672106894
Energy: 0.4512144594831676
Energy: 0.4873773317647878
Energy: 0.45121445948183786

minimum gb energy = 0.4405944672106894 eV
minimum distance =  2.5667495815481 Angstroms
sigma value = 25


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

Energy: 0.7260582428994583
Energy: 0.5045209333056255
Energy: 0.5048891276032555
Energy: 0.4552331902211334
Energy: 0.46793909053658006
Energy: 0.49343483111559927
Energy: 0.4675708279538656
Energy: 0.49343483111559927
Energy: 0.5046411342667921
Energy: 0.5044225773122458
Energy: 0.4682183501974109
Energy: 0.5044225773122458
Energy: 0.4677091800336824
Energy: 0.46887138814575213
Energy: 0.46751476396763475
Energy: 0.468871388146525
Energy: 0.467093601037871
Energy: 0.46791945768957505
Energy: 0.46741426563182675
Energy: 0.46791945768957505
Energy: 0.502913089647234
Energy: 0.49924293102986955
Energy: 0.46751547182450387
Energy: 0.49924293103064243
Energy: 0.4887045097997783
Energy: 0.5060331942819525
Energy: 0.486851397514092
Energy: 0.5060331942819525
Energy: 0.487379207700909
Energy: 0.5072915583876203
Energy: 0.5153749515959732
Energy: 0.5072915583876203
Energy: 0.4876896856643564
Energy: 0.506038728579578
Energy: 0.4814880546494424
Energy: 0.5060387285788052
Energy: 0.5028264581236835
Energy: 0.5073598152010341
Energy: 0.4673640628109361
Energy: 0.5073598152010341
Energy: 0.4510151408598364
Energy: 0.4678742280654655
Energy: 0.46714349954487266
Energy: 0.46787422806469264
Energy: 0.48419067681526073
Energy: 0.46825995788630276
Energy: 0.4675746636341474
Energy: 0.4682599578855299
Energy: 0.5042192827468676
Energy: 0.5044565618139846
Energy: 0.45245134877303983
Energy: 0.5044565618124388
Energy: 0.467405510486111
Energy: 0.4686512643117908
Energy: 0.4817440782836409
Energy: 0.46865126431256365
Energy: 0.4686442438890869
Energy: 0.5047249713757166
Energy: 0.506538339969905
Energy: 0.5047249713749437
Energy: 0.5015521605696178
Energy: 0.4686876429951982
Energy: 0.46755246886206964
Energy: 0.4686876429951982
Energy: 0.46894477731570466
Energy: 0.4684734780776459
Energy: 0.4675187401922558
Energy: 0.4684734780776459
Energy: 0.4686202151001601
Energy: 0.4675659839727281
Energy: 0.5019608137616736
Energy: 0.4675659839719552
Energy: 0.48672802644560337
Energy: 0.5164353877004615
Energy: 0.4892014683068184
Energy: 0.5164353877004615
Energy: 0.5166460360236961
Energy: 0.5080465626804271
Energy: 0.4886817973139075
Energy: 0.5080465626812001
Energy: 0.48153305933402674
Energy: 0.5058929506289342
Energy: 0.4875614173825214
Energy: 0.5058929506281614
Energy: 0.4813775123961943
Energy: 0.5089876302386214
Energy: 0.5025524264040501
Energy: 0.5089876302386214
Energy: 0.4671848253295599
Energy: 0.46808205249955315
Energy: 0.45104795110722906
Energy: 0.46808205249955315
Energy: 0.4672856574372313
Energy: 0.4680537609121459
Energy: 0.48447940803323425
Energy: 0.4680537609113731
Energy: 0.45107902994507565
Energy: 0.4689897004137395
Energy: 0.5050725036253716
Energy: 0.4689897004129666

minimum gb energy = 0.4510151408598364 eV
minimum distance =  2.56080036487199 Angstroms
sigma value = 9


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

Energy: 0.6662485925161832
Energy: 0.5240860789894686
Energy: 0.5247939672279645
Energy: 0.46700716938216746
Energy: 0.4895479173631248
Energy: 0.5092639724066026
Energy: 0.48959839055575466
Energy: 0.5092639724075245
Energy: 0.5244006207384565
Energy: 0.5240582971810497
Energy: 0.4863454946042437
Energy: 0.5240582971819716
Energy: 0.4848516489500521
Energy: 0.5103345845152945
Energy: 0.489498500294762
Energy: 0.5103345845152945
Energy: 0.4884915051160166
Energy: 0.491458388392745
Energy: 0.4895107266519481
Energy: 0.49145838839366696
Energy: 0.5291461176006206
Energy: 0.4914020133664622
Energy: 0.4896883861504169
Energy: 0.4914020133673842
Energy: 0.5140234160004484
Energy: 0.5351337467392447
Energy: 0.48906561629210693
Energy: 0.5351337467383227
Energy: 0.4888613313928116
Energy: 0.5362826155179494
Energy: 0.5290946431517116
Energy: 0.5362826155170275
Energy: 0.4894031853209904
Energy: 0.491110458135971
Energy: 0.46224852403227484
Energy: 0.4911104581368929
Energy: 0.4894147794547568
Energy: 0.49185581369624776
Energy: 0.46207378133245336
Energy: 0.49185581369440384
Energy: 0.4625805468581529
Energy: 0.5239455136826114
Energy: 0.5237330819368116
Energy: 0.5239455136844553
Energy: 0.5053299378938864
Energy: 0.4908636353774
Energy: 0.4896958739186832
Energy: 0.4908636353774
Energy: 0.5247605071615239
Energy: 0.5244823788872739
Energy: 0.48478657769573374
Energy: 0.5244823788891178
Energy: 0.48500329379095547
Energy: 0.49138181650943297
Energy: 0.528212815226702
Energy: 0.49138181650943297
Energy: 0.4883452985902658
Energy: 0.48913574597196596
Energy: 0.4898719693082535
Energy: 0.48913574597196596
Energy: 0.5292454833116004
Energy: 0.49141368655499323
Energy: 0.48972443942654376
Energy: 0.4914136865559152
Energy: 0.5114069594527957
Energy: 0.5404401786049753
Energy: 0.4891923823373755
Energy: 0.5404401786058972
Energy: 0.5102062924676231
Energy: 0.5353331153086631
Energy: 0.5305155771124377
Energy: 0.5353331153086631
Energy: 0.4905202071802076
Energy: 0.4912560580839555
Energy: 0.46208319472516174
Energy: 0.49125605808487743
Energy: 0.48952957141640374
Energy: 0.4919103644716426
Energy: 0.4619575841197973
Energy: 0.4919103644716426
Energy: 0.4619794536782692
Energy: 0.4900021563297492
Energy: 0.5254151101571252
Energy: 0.4900021563288271

minimum gb energy = 0.4619575841197973 eV
minimum distance =  2.55461277209223 Angstroms
sigma value = 25


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

Energy: 0.5733712649319591
Energy: 0.5513422970374077
Energy: 0.5525177195113137
Energy: 0.4815931460752169
Energy: 0.4906225146031875
Energy: 0.510561036949436
Energy: 0.49334030690564523
Energy: 0.510561036949436
Energy: 0.5517471280722164
Energy: 0.5512722156336145
Energy: 0.4775055852928234
Energy: 0.5512722156336145
Energy: 0.4784607918249349
Energy: 0.5105870151421685
Energy: 0.4902087270128439
Energy: 0.5105870151421685
Energy: 0.48990677830729895
Energy: 0.5300711886507758
Energy: 0.49128177760980835
Energy: 0.5300711886507758
Energy: 0.4778084159100556
Energy: 0.5252845748726829
Energy: 0.48990045324234544
Energy: 0.5252845748726829
Energy: 0.4760122263412615
Energy: 0.5296498028231051
Energy: 0.516758837800271
Energy: 0.5296498028242452
Energy: 0.476054242592853
Energy: 0.5284331003259155
Energy: 0.4910916670166437
Energy: 0.5284331003259155
Energy: 0.5510989673075344
Energy: 0.551472242327551
Energy: 0.47807580132431393
Energy: 0.551472242327551
Energy: 0.4910214259919935
Energy: 0.528514728256584
Energy: 0.4757198844816639
Energy: 0.5285147282577242
Energy: 0.47730304435779125
Energy: 0.5518828369707623
Energy: 0.5556526301694713
Energy: 0.5518828369696221
Energy: 0.4783249534090899
Energy: 0.512261064977177
Energy: 0.47792035727481635
Energy: 0.5122610649760369
Energy: 0.49094699227625804
Energy: 0.5330391817117762
Energy: 0.48977108638700395
Energy: 0.5330391817117762
Energy: 0.4918652512984276
Energy: 0.5300728028850142
Energy: 0.4788197098699545
Energy: 0.5300728028850142
Energy: 0.5199220527820505
Energy: 0.5294999476784331
Energy: 0.4755952499329469
Energy: 0.5294999476784331
Energy: 0.4898227247509934
Energy: 0.5298058928323206
Energy: 0.47559089217888517
Energy: 0.5298058928323206
Energy: 0.4767737918700947
Energy: 0.47966847747369823
Energy: 0.5531599793531626
Energy: 0.47966847747255803

minimum gb energy = 0.47559089217888517 eV
minimum distance =  2.64863412032189 Angstroms
sigma value = 17


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

Energy: 0.8382796939743833
Energy: 0.6153848685825583
Energy: 0.6161053270143181
Energy: 0.5721511702981653
Energy: 0.5135253518031947
Energy: 0.5132849273247466
Energy: 0.517272887786415
Energy: 0.5132849273241008
Energy: 0.5307136753625415
Energy: 0.5294480490985165
Energy: 0.5466722147343864
Energy: 0.5294480490978707
Energy: 0.5170754104058177
Energy: 0.5387689713360477
Energy: 0.5173129515651032
Energy: 0.5387689713347563
Energy: 0.5500457231628761
Energy: 0.5586751306979636
Energy: 0.5356553439110433
Energy: 0.5586751306979636
Energy: 0.5183456406455803
Energy: 0.5587631922963725
Energy: 0.5178398251932805
Energy: 0.5587631922963725
Energy: 0.5460559932055963
Energy: 0.5287203563375062
Energy: 0.529787954274164
Energy: 0.5287203563375062
Energy: 0.5485853013486885
Energy: 0.5169442653984473
Energy: 0.5128118923734205
Energy: 0.5169442653990639
Energy: 0.6174144843874356
Energy: 0.6149410311342826
Energy: 0.5460396662090409
Energy: 0.6149410311336369
Energy: 0.5593502036728373
Energy: 0.5647635045740279
Energy: 0.5182031731797504
Energy: 0.5647635045720907
Energy: 0.5496200360285739
Energy: 0.5132693072194552
Energy: 0.49845429102186595
Energy: 0.5132693072188094
Energy: 0.5508086476431019
Energy: 0.5138396676512125
Energy: 0.5123825700535226
Energy: 0.5138396676518583
Energy: 0.54595510692234
Energy: 0.5148974859575934
Energy: 0.5141494187090987
Energy: 0.5148974859582391
Energy: 0.5463661934970377
Energy: 0.5140495183519063
Energy: 0.49760639881884494
Energy: 0.5140495183506149
Energy: 0.6175503964012354
Energy: 0.5686832525034194
Energy: 0.5493630169744099
Energy: 0.5686832525046818
Energy: 0.6150611887112973
Energy: 0.5468405025697944
Energy: 0.545156221484724
Energy: 0.546840502557525
Energy: 0.5476147892251084
Energy: 0.5170119653291869
Energy: 0.5286500762512996
Energy: 0.5170119653298326
Energy: 0.5475392308296537
Energy: 0.5169869696762686
Energy: 0.529838100074198
Energy: 0.5169869696762686
Energy: 0.5210921806661518
Energy: 0.5584396568699075
Energy: 0.5484631057682349
Energy: 0.5584396568705533
Energy: 0.5399862303521317
Energy: 0.5595125796553451
Energy: 0.5481612330408927
Energy: 0.5595125796553451
Energy: 0.5193084437195358
Energy: 0.5178460055718842
Energy: 0.5466319220494659
Energy: 0.5178460055731758
Energy: 0.5289900437567469
Energy: 0.529089270092215
Energy: 0.5459494152293041
Energy: 0.5290892700928608
Energy: 0.5181500196778401
Energy: 0.5445351496573989
Energy: 0.5171905975060034
Energy: 0.5445351496580447
Energy: 0.5460442329026781
Energy: 0.6152639974593341
Energy: 0.6150489948188855
Energy: 0.6152639974593341
Energy: 0.5123970469806439
Energy: 0.5142663475981476
Energy: 0.5487077499939457
Energy: 0.5142663475987934
Energy: 0.5123139644729624
Energy: 0.5138543302406889
Energy: 0.5488293470955302
Energy: 0.5138543302393974
Energy: 0.4971239097995971
Energy: 0.5388942744742002
Energy: 0.5471011639936146
Energy: 0.5388942744735544
Energy: 0.5148363276813831
Energy: 0.5136395202028216
Energy: 0.5461352538770444
Energy: 0.5136395202028216
Energy: 0.5124301455990533
Energy: 0.5133339495832809
Energy: 0.5459772727131927
Energy: 0.5133339495839268
Energy: 0.5452909501348708
Energy: 0.6153460099891347
Energy: 0.6156045685295081
Energy: 0.6153460099897804

minimum gb energy = 0.4971239097995971 eV
minimum distance =  2.6103454573614 Angstroms
sigma value = 53


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

Energy: 0.749060999507647
Energy: 0.561459929881537
Energy: 0.5636955336794541
Energy: 0.4637359503451599
Energy: 0.5522739372543843
Energy: 0.48440869391040625
Energy: 0.5514515744710551
Energy: 0.48440869390891955
Energy: 0.5622278362628094
Energy: 0.5607886506362275
Energy: 0.5622210817043414
Energy: 0.5607886506362275
Energy: 0.5510027186567049
Energy: 0.48478272056150906
Energy: 0.5509688200376803
Energy: 0.4847827205629957
Energy: 0.5634590181522138
Energy: 0.48462943886655346
Energy: 0.45405799805430574
Energy: 0.4846294388650668
Energy: 0.5504422909689511
Energy: 0.48589877890711175
Energy: 0.4544687309253102
Energy: 0.48589877891008504
Energy: 0.6447073415104159
Energy: 0.5606860534269947
Energy: 0.5606920918190835
Energy: 0.560686053425508
Energy: 0.6440136588829388
Energy: 0.48587475022070364
Energy: 0.5630523431840257
Energy: 0.4858747502281369
Energy: 0.5621485350903386
Energy: 0.5628102315010622
Energy: 0.5626130891215279
Energy: 0.5628102314995754
Energy: 0.5514357986454999
Energy: 0.48579754934322017
Energy: 0.5552320365169257
Energy: 0.4857975493417336
Energy: 0.5636347042160393
Energy: 0.48578307219181416
Energy: 0.46435968068053357
Energy: 0.48578307219032757
Energy: 0.5555614420466212
Energy: 0.48448251741031656
Energy: 0.45582412764539715
Energy: 0.4844825174088299
Energy: 0.6439416803937169
Energy: 0.48634920721774044
Energy: 0.5626702053234999
Energy: 0.48634920721625374

minimum gb energy = 0.45405799805430574 eV
minimum distance =  2.63130512713295 Angstroms
sigma value = 9


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

Energy: 0.7227648425547532
Energy: 0.6345206675360436
Energy: 0.6400827567232584
Energy: 0.5829124784089944
Energy: 0.5076819113694284
Energy: 0.5074215993908331
Energy: 0.6667470451786464
Energy: 0.5074215993902828
Energy: 0.5120733668534043
Energy: 0.507541835337771
Energy: 0.6365624138982447
Energy: 0.5075418353366705
Energy: 0.5099014949218739
Energy: 0.5067770492058111
Energy: 0.658355403582034
Energy: 0.5067770492052608
Energy: 0.5086784256182056
Energy: 0.5071296708989118
Energy: 0.6751140012820096
Energy: 0.5071296708983617
Energy: 0.5071703139021128
Energy: 0.5068993506134564
Energy: 0.6728702616869848
Energy: 0.506899350612906
Energy: 0.6346008008505095
Energy: 0.6309803799333127
Energy: 0.6365430954734352
Energy: 0.6309803799333127
Energy: 0.6337666912275021
Energy: 0.5631325412095348
Energy: 0.6303797859895894
Energy: 0.5631325412106354
Energy: 0.5440192893121747
Energy: 0.5721790712204676
Energy: 0.550004115785323
Energy: 0.5721790712193671
Energy: 0.5050423958811258
Energy: 0.5546766293551764
Energy: 0.6251810197207117
Energy: 0.5546766293557267
Energy: 0.5439239547297281
Energy: 0.5431313933835107
Energy: 0.5996128509462549
Energy: 0.5431313933840609
Energy: 0.5465178130377207
Energy: 0.5517779113087038
Energy: 0.6779928060453966
Energy: 0.5517779113103544
Energy: 0.6312370741714971
Energy: 0.5435169455578216
Energy: 0.549415291087008
Energy: 0.543516945556721
Energy: 0.6332078821376402
Energy: 0.5445438318474094
Energy: 0.5460817016548539
Energy: 0.5445438318474094
Energy: 0.6218411921519794
Energy: 0.5712916844939915
Energy: 0.5469839559799694
Energy: 0.571291684492891
Energy: 0.5953600515143859
Energy: 0.5721172474178784
Energy: 0.5504809398096716
Energy: 0.5721172474162277
Energy: 0.6273893068950177
Energy: 0.5107695878595144
Energy: 0.5507456213577461
Energy: 0.5107695878595144
Energy: 0.6381858461565609
Energy: 0.6322893917260399
Energy: 0.6712993141123148
Energy: 0.6322893917293413
Energy: 0.6645672103496034
Energy: 0.507968501410451
Energy: 0.5052594439831973
Energy: 0.5079685014099008
Energy: 0.625182790629547
Energy: 0.5074129400756481
Energy: 0.5139403221606235
Energy: 0.5074129400756481
Energy: 0.6611922852497443
Energy: 0.5072472923205142
Energy: 0.5110394612254037
Energy: 0.5072472923216148
Energy: 0.6730377529201983
Energy: 0.5068476936287962
Energy: 0.5074880007669007
Energy: 0.5068476936287962
Energy: 0.6746921133697089
Energy: 0.507355989099312
Energy: 0.5071353671306996
Energy: 0.5073559890976612
Energy: 0.6376731389975528
Energy: 0.6217153479050234
Energy: 0.6349675713020079
Energy: 0.6217153479055737
Energy: 0.6311137305379534
Energy: 0.5652527817524934
Energy: 0.6346764243512677
Energy: 0.5652527817524934
Energy: 0.5492027721306811
Energy: 0.5741998163415128
Energy: 0.5432138006358875
Energy: 0.5741998163415128
Energy: 0.6254862842083854
Energy: 0.5547234313355689
Energy: 0.5047142277493061
Energy: 0.5547234313361191
Energy: 0.5990723103374759
Energy: 0.5432766879082364
Energy: 0.5436852128844669
Energy: 0.543276687909887
Energy: 0.67940942343191
Energy: 0.5433973153450999
Energy: 0.5435737008653275
Energy: 0.5433973153445497
Energy: 0.5504515114192999
Energy: 0.531055477099461
Energy: 0.6639475429163462
Energy: 0.5310554771000112
Energy: 0.5471541473646937
Energy: 0.5446612586187709
Energy: 0.6332784107499333
Energy: 0.5446612586198715
Energy: 0.5554128051926595
Energy: 0.5300959766673876
Energy: 0.6220536047167762
Energy: 0.5300959766684881
Energy: 0.5504102757497181
Energy: 0.5714355412215327
Energy: 0.5922913526656002
Energy: 0.5714355412215327
Energy: 0.5497945502145614
Energy: 0.5106718808140691
Energy: 0.5793672662102352
Energy: 0.5106718808146193
Energy: 0.6781737685772103
Energy: 0.631422548989585
Energy: 0.6364332427308907
Energy: 0.631422548989585

minimum gb energy = 0.5047142277493061 eV
minimum distance =  2.60423708261949 Angstroms
sigma value = 73


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

Energy: 0.7686297706567911
Energy: 0.6037674277125604
Energy: 0.6032981314499054
Energy: 0.5526329474185527
Energy: 0.5190574209184238
Energy: 0.5173812290327845
Energy: 0.5881524921869621
Energy: 0.5173812290336378
Energy: 0.5166168109730119
Energy: 0.5179449869281391
Energy: 0.6113908197911168
Energy: 0.5179449869281391
Energy: 0.5165565308605998
Energy: 0.5179366793904664
Energy: 0.6640528873398882
Energy: 0.5179366793904664
Energy: 0.521602967480171
Energy: 0.5188444513442748
Energy: 0.6479446861307125
Energy: 0.5188444513460209
Energy: 0.5508076923501112
Energy: 0.5193764467314357
Energy: 0.6482829601213447
Energy: 0.5193764467305626
Energy: 0.575507014033908
Energy: 0.6131629945574029
Energy: 0.6202507190127946
Energy: 0.6131629945582759
Energy: 0.5752118631239482
Energy: 0.5672212402543332
Energy: 0.6135386000848724
Energy: 0.5672212402543332
Energy: 0.5478420317348587
Energy: 0.5032688413433845
Energy: 0.6066583399671137
Energy: 0.5032688413416385
Energy: 0.545041600718979
Energy: 0.571185662783728
Energy: 0.6061331623292143
Energy: 0.5711856627846009
Energy: 0.5421438217770107
Energy: 0.5083849548749163
Energy: 0.5027999928040885
Energy: 0.5083849548749163
Energy: 0.5388795191420886
Energy: 0.509045839075394
Energy: 0.6416020401445135
Energy: 0.509045839075394
Energy: 0.6112064828100677
Energy: 0.5419623844732584
Energy: 0.5368677099067136
Energy: 0.5419623844750044
Energy: 0.6129025327745345
Energy: 0.5469429489131812
Energy: 0.542210603948013
Energy: 0.5469429489131812
Energy: 0.6168628434598218
Energy: 0.5544341199570294
Energy: 0.5360998905068546
Energy: 0.5544341199570294
Energy: 0.647703017331062
Energy: 0.5368498915910843
Energy: 0.5361256133719496
Energy: 0.5368498915902113
Energy: 0.649958990864946
Energy: 0.5542666746028707
Energy: 0.5430945606852147
Energy: 0.5542666746028707
Energy: 0.6051131495487435
Energy: 0.6059044102130804
Energy: 0.5754745301696537
Energy: 0.6059044102130804
Energy: 0.5933242397300736
Energy: 0.5505224095278504
Energy: 0.5741155989324604
Energy: 0.5505224095278504
Energy: 0.5881875710388063
Energy: 0.5477395862683121
Energy: 0.5891779435410122
Energy: 0.5477395862683121
Energy: 0.5906295652558975
Energy: 0.5513073607872929
Energy: 0.5435917486154453
Energy: 0.5513073607890389
Energy: 0.6548145443304464
Energy: 0.5874405490218073
Energy: 0.5960601450117847
Energy: 0.5874405490218073

minimum gb energy = 0.5027999928040885 eV
minimum distance =  2.52886381696355 Angstroms
sigma value = 7


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

Energy: 0.9012303678796615
Energy: 0.5980172953599263
Energy: 0.5989534933017714
Energy: 0.5223080179189196
Energy: 0.5286493795295888
Energy: 0.5211034469058407
Energy: 0.5794714524180392
Energy: 0.5211034469052233
Energy: 0.523936124748796
Energy: 0.5204159781266734
Energy: 0.5740412625572834
Energy: 0.5204159781272906
Energy: 0.5217229573451814
Energy: 0.5201190398555009
Energy: 0.6374488663093782
Energy: 0.5201190398555009
Energy: 0.5278104675788206
Energy: 0.5259156184316882
Energy: 0.6236040489003903
Energy: 0.525915618431071
Energy: 0.5195657039193606
Energy: 0.5257770674704955
Energy: 0.6232302612937441
Energy: 0.5257770674686435
Energy: 0.6399632673455259
Energy: 0.5247969143811702
Energy: 0.5191730136197881
Energy: 0.524796914378701
Energy: 0.6353015491457313
Energy: 0.5257762288368345
Energy: 0.5265088224398915
Energy: 0.5257762288380691
Energy: 0.5796255582574608
Energy: 0.5186964676079889
Energy: 0.5187820640982261
Energy: 0.5186964676086063
Energy: 0.6293082331184612
Energy: 0.5226906525214376
Energy: 0.5263577543069144
Energy: 0.5226906525220549
Energy: 0.5820157929756608
Energy: 0.5501703966821055
Energy: 0.5194198889263504
Energy: 0.5501703966814883
Energy: 0.5974150323752734
Energy: 0.578753937001165
Energy: 0.6402361455710093
Energy: 0.578753936999313
Energy: 0.5805724266124285
Energy: 0.5449714947343003
Energy: 0.5933783768555974
Energy: 0.544971494731831
Energy: 0.5752121688922458
Energy: 0.5439501206300765
Energy: 0.5235800633498855
Energy: 0.5439501206331631
Energy: 0.5933978753349523
Energy: 0.5447099012761569
Energy: 0.5304989207161227
Energy: 0.5447099012761569
Energy: 0.5205365569771426
Energy: 0.5871415603637813
Energy: 0.5965191790069032
Energy: 0.5871415603613122
Energy: 0.6424412514046851
Energy: 0.5503993440893141
Energy: 0.5825459883623066
Energy: 0.5503993440893141
Energy: 0.527247833693913
Energy: 0.522695059705227
Energy: 0.5751977458550818
Energy: 0.5226950597027578
Energy: 0.5193803275210842
Energy: 0.5188125849752994
Energy: 0.6376409703008464
Energy: 0.5188125849783858
Energy: 0.5261967444870849
Energy: 0.5255044166309983
Energy: 0.6434969144110825
Energy: 0.5255044166328501
Energy: 0.5198211606536244
Energy: 0.5254182409215306
Energy: 0.6255213017470288
Energy: 0.5254182409209134
Energy: 0.6374447931018673
Energy: 0.5270732978183544
Energy: 0.5192985563101156
Energy: 0.5270732978220581
Energy: 0.6386276280626287
Energy: 0.5262475292168787
Energy: 0.5265833082104037
Energy: 0.5262475292193479
Energy: 0.6376099469429963
Energy: 0.519861384994328
Energy: 0.5214418448804106
Energy: 0.5198613849930934
Energy: 0.6275622292333647
Energy: 0.5205085143157959
Energy: 0.5236218263000041
Energy: 0.5205085143182651
Energy: 0.6324877832016623
Energy: 0.5190329532122786
Energy: 0.5280559535253407
Energy: 0.5190329532135133
Energy: 0.6040093331440916
Energy: 0.5915618999494798
Energy: 0.7721882114126682
Energy: 0.5915618999500971
Energy: 0.5855904138953478
Energy: 0.5477759162222909
Energy: 0.5283042362124121
Energy: 0.5477759162192044
Energy: 0.5745047521933013
Energy: 0.5444422112743555
Energy: 0.580050028063686
Energy: 0.5444422112755902
Energy: 0.5878523915355092
Energy: 0.5459902522003353
Energy: 0.5235117475894213
Energy: 0.5459902522015698
Energy: 0.6369519602857582
Energy: 0.5863082560690454
Energy: 0.5960899600367894
Energy: 0.5863082560708972

minimum gb energy = 0.5186964676079889 eV
minimum distance =  2.57327343445705 Angstroms
sigma value = 29


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

Energy: 0.47353506592895295
Energy: 0.5591418148572636
Energy: 0.5380691897947558
Energy: 0.47453005566699824
Energy: 18.908112660066458
Energy: 0.5148901424402048
Energy: 0.4865920529735442
Energy: 0.5148901424399898
Energy: 0.47960826440534293
Energy: 0.5026643255789918
Energy: 0.4762522704286216
Energy: 0.5026643255800429
Energy: 0.47463444492948104
Energy: 0.4800174353242433
Energy: 0.47970184989433484
Energy: 0.480017435323192
Energy: 0.47861055730321783
Energy: 0.48067422313680913
Energy: 0.47621078326619903
Energy: 0.48067422313869657
Energy: 0.4827060024967479
Energy: 0.5033408439498632
Energy: 0.4770240744348343
Energy: 0.5033408439500784
Energy: 0.47587790577109945
Energy: 0.5015625517460734
Energy: 0.4793164366806092
Energy: 0.5015625517462884
Energy: 0.4853242449573847
Energy: 0.4805612696727531
Energy: 0.47463756036980476
Energy: 0.48056126967318313
Energy: 0.47453117900966363
Energy: 0.4798724916113786
Energy: 0.5064466274058615
Energy: 0.47987249161180867

minimum gb energy = 0.47353506592895295 eV
minimum distance =  2.60946274735759 Angstroms
sigma value = 5


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

Energy: 0.6767655800944539
Energy: 0.4921789783106668
Energy: 0.5740682203667219
Energy: 0.4818791561468182
Energy: 0.586911127753079
Energy: 0.49151534327757
Energy: 0.5711330192105991
Energy: 0.49151534327757
Energy: 0.5710389866468454
Energy: 0.526592673621316
Energy: 0.5741268899181456
Energy: 0.5265926736195666
Energy: 0.5038010615996195
Energy: 0.4913106303786572
Energy: 0.5988731024256816
Energy: 0.4913106303786572
Energy: 0.5508213751560846
Energy: 0.49461308424351413
Energy: 0.5753016999905863
Energy: 0.49461308424468037
Energy: 0.506220755323024
Energy: 0.510198789931644
Energy: 0.5750613268642951
Energy: 0.510198789931644
Energy: 0.4909758497799117
Energy: 0.490938199587127
Energy: 0.5997029553208701
Energy: 0.490938199587127
Energy: 0.49720759850078555
Energy: 0.4918698835425793
Energy: 0.6459431264970235
Energy: 0.4918698835425793
Energy: 0.55475099301681
Energy: 0.503421039271734
Energy: 0.6310994819442761
Energy: 0.503421039271734
Energy: 0.5759776171878919
Energy: 0.4779511525214802
Energy: 0.48644662067424765
Energy: 0.4779511525214802
Energy: 0.5534848239984196
Energy: 0.4778732681566464
Energy: 0.4794085753752785
Energy: 0.4778732681566464
Energy: 0.6384146378996441
Energy: 0.48107466405614385
Energy: 0.47792429489323224
Energy: 0.48107466405556076
Energy: 0.642596779021538
Energy: 0.4778045350978678
Energy: 0.5999013190365117
Energy: 0.4778045350984509
Energy: 0.5712975577426617
Energy: 0.49827454883530975
Energy: 0.5734453520732864
Energy: 0.4982745488335604
Energy: 0.49228096937619426
Energy: 0.4909588811009622
Energy: 0.5741312616425706
Energy: 0.4909588811003791
Energy: 0.49364907539197705
Energy: 0.4911161681896496
Energy: 0.5851021322167305
Energy: 0.49111616818906645
Energy: 0.4927265054735589
Energy: 0.4910480740533082
Energy: 0.5037694285140396
Energy: 0.49104807405447437
Energy: 0.5846022586520795
Energy: 0.4917976310804668
Energy: 0.5777761852195528
Energy: 0.4917976310804668
Energy: 0.5758626034445253
Energy: 0.5276005685030565
Energy: 0.57187202743389
Energy: 0.5276005685036396
Energy: 0.5806983431081517
Energy: 0.4908222272865349
Energy: 0.5026343704373608
Energy: 0.490822227287118
Energy: 0.575220179009899
Energy: 0.4923997551244997
Energy: 0.5655208643436758
Energy: 0.4923997551256659
Energy: 0.5750953437320402
Energy: 0.49076441266837534
Energy: 0.49114262794350144
Energy: 0.49076441266837534
Energy: 0.6000397494644998
Energy: 0.49095144121649886
Energy: 0.4917284417479589
Energy: 0.49095144121705553
Energy: 0.6431183390609909
Energy: 0.4915204086912459
Energy: 0.4947554861549295
Energy: 0.4915204086906628
Energy: 0.6386103114736514
Energy: 0.5023123487242489
Energy: 0.5532666241958298
Energy: 0.5023123487254152
Energy: 0.4895163244157374
Energy: 0.4785740254587434
Energy: 0.5759759988199632
Energy: 0.4785740254599097
Energy: 0.4805356576770232
Energy: 0.4779419369863392
Energy: 0.5559161626813752
Energy: 0.47794193698808857
Energy: 0.47833305034332063
Energy: 0.47820382411157586
Energy: 0.5235324897193775
Energy: 0.47820382411215895
Energy: 0.4927942721906229
Energy: 0.4778774444233251
Energy: 0.6452802753290848
Energy: 0.4778774444233251
Energy: 0.5740243204746115
Energy: 0.49843276891636823
Energy: 0.57206791559677
Energy: 0.498432768915202
Energy: 0.573759502319049
Energy: 0.4912767558964588
Energy: 0.49389757701198383
Energy: 0.4912767558958757
Energy: 0.5841155095153601
Energy: 0.4913053830693674
Energy: 0.49285257307226044
Energy: 0.49130538306995053
Energy: 0.5039355821441827
Energy: 0.4911279046774332
Energy: 0.49154252079049776
Energy: 0.4911279046791825

minimum gb energy = 0.4778045350978678 eV
minimum distance =  2.58920157218592 Angstroms
sigma value = 1


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

Energy: 0.806945338009475
Energy: 0.4782817909885152
Energy: 0.5694136234282338
Energy: 0.46960939222931586
Energy: 0.5684476384366172
Energy: 0.4768556060857054
Energy: 0.56589266000404
Energy: 0.4768556060857054
Energy: 0.5745240958888763
Energy: 0.5221876904048859
Energy: 0.5827445192509544
Energy: 0.5221876904073046
Energy: 0.5352421939393798
Energy: 0.5224976513076399
Energy: 0.5753324132172682
Energy: 0.5224976513076399
Energy: 0.5350914357084628
Energy: 0.47859710819277107
Energy: 0.5338301649925641
Energy: 0.47859710819196477
Energy: 0.47862017718850725
Energy: 0.4946264677962111
Energy: 0.5457530939778318
Energy: 0.49462646779701736
Energy: 0.4783660969760416
Energy: 0.4785455802520059
Energy: 0.5750213731009852
Energy: 0.47854558025281213
Energy: 0.4785560321531926
Energy: 0.47954216855602877
Energy: 0.6007312558863064
Energy: 0.4795421685552226
Energy: 0.5118983099421178
Energy: 0.5003031796595873
Energy: 0.5987435868698617
Energy: 0.5003031796587809
Energy: 0.6208340255381188
Energy: 0.45314242002174904
Energy: 0.4984288609480891
Energy: 0.45314242002174904
Energy: 0.5137536248112369
Energy: 0.4569921574789579
Energy: 0.5090743718221096
Energy: 0.4569921574797641
Energy: 0.6174025972064044
Energy: 0.45599385830962125
Energy: 0.49500097009904753
Energy: 0.4559938583112154
Energy: 0.616530271630685
Energy: 0.4528080420127606
Energy: 0.5072622522691691
Energy: 0.4528080420119543
Energy: 0.5097120598132447
Energy: 0.45279882969118734
Energy: 0.5912470495264582
Energy: 0.4527988296895748
Energy: 0.5351880604530694
Energy: 0.4970692085240268
Energy: 0.6105695232769106
Energy: 0.497069208523239
Energy: 0.5368523772162676
Energy: 0.47881256256905363
Energy: 0.5762773343418012
Energy: 0.4788125625706662
Energy: 0.5129335382676883
Energy: 0.479730014212655
Energy: 0.5330523320649696
Energy: 0.47973001421346123
Energy: 0.49906377201179847
Energy: 0.4793794405566984
Energy: 0.5443069855559661
Energy: 0.4793794405566984
Energy: 0.48403520628108127
Energy: 0.47932185928189996
Energy: 0.5975662829810614
Energy: 0.47932185928189996
Energy: 0.49422701417223747
Energy: 0.5476596178254581
Energy: 0.6007350709789361
Energy: 0.5476596178254581
Energy: 0.623638440923358
Energy: 0.5009429050200874
Energy: 0.578210247305829
Energy: 0.5009429050224877
Energy: 0.6244466634445024
Energy: 0.4773831825995618
Energy: 0.4795844900574497
Energy: 0.4773831825995618
Energy: 0.624809073901486
Energy: 0.4763905208508867
Energy: 0.4777640806125861
Energy: 0.4763905208516929
Energy: 0.6160608593403814
Energy: 0.4770278028298914
Energy: 0.4778335623459731
Energy: 0.47702780281618506

minimum gb energy = 0.4527988296895748 eV
minimum distance =  2.58009382960846 Angstroms
sigma value = 17


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

Energy: 0.7784702793451574
Energy: 0.473682102938913
Energy: 0.57347475334047
Energy: 0.4683636325850976
Energy: 0.4892797885733936
Energy: 0.47087596599655873
Energy: 0.5369377073364489
Energy: 0.47087596599705706
Energy: 0.598629374608576
Energy: 0.4758382610872553
Energy: 0.5421054853472054
Energy: 0.47583826110270355
Energy: 0.6035709699773716
Energy: 0.4913933423584984
Energy: 0.5413700313025294
Energy: 0.49139334235750176
Energy: 0.5150926991433106
Energy: 0.4610866613592559
Energy: 0.6310588988906003
Energy: 0.46108666135975424
Energy: 0.46201030669733906
Energy: 0.4610531042380991
Energy: 0.6367600663926039
Energy: 0.46105310423959406
Energy: 0.46186080734140145
Energy: 0.46137632132673834
Energy: 0.5148497831727874
Energy: 0.46137632132723666
Energy: 0.4675557379511858
Energy: 0.46183621496268307
Energy: 0.6668882253331164
Energy: 0.4618362149616864
Energy: 0.612199332579754
Energy: 0.4617008645987686
Energy: 0.5855714793500345
Energy: 0.4617008645987686
Energy: 0.5473394982523421
Energy: 0.49359998911893593
Energy: 0.5479227737460599
Energy: 0.49359998912092934
Energy: 0.6097499945986694
Energy: 0.4713817930118792
Energy: 0.47793605765935754
Energy: 0.4713817930073943
Energy: 0.6226389523001395
Energy: 0.47213755770670623
Energy: 0.5351586450985968
Energy: 0.4721375577077029
Energy: 0.6433134961562165
Energy: 0.47044533301669916
Energy: 0.4711234603638243
Energy: 0.47044533302417413
Energy: 0.5577555159095535
Energy: 0.4709049727225959
Energy: 0.4715327476816993
Energy: 0.4709049727235926
Energy: 0.5999425808933257
Energy: 0.4713276853766388
Energy: 0.47583159838169176
Energy: 0.4713276853776355
Energy: 0.6612066992349066
Energy: 0.4752271286018562
Energy: 0.592531342095717
Energy: 0.4752271286028528
Energy: 0.4911800008307083
Energy: 0.4718279747307085
Energy: 0.6371452458126456
Energy: 0.4718279747307085
Energy: 0.47055211623544624
Energy: 0.4713708172582034
Energy: 0.6210812962752843
Energy: 0.4713708172592
Energy: 0.4879203547691176
Energy: 0.4719332030592723
Energy: 0.5854970048786919
Energy: 0.4719332030587739
Energy: 0.47747135721715417
Energy: 0.5223546593417453
Energy: 0.6633799249960126
Energy: 0.5223546593392536
Energy: 0.543319684429513
Energy: 0.47060650083224737
Energy: 0.48622586272047497
Energy: 0.4706065008327458
Energy: 0.542100754556781
Energy: 0.47454330351202634
Energy: 0.5982892258924561
Energy: 0.474543303511528
Energy: 0.5422830432346499
Energy: 0.4908418270882803
Energy: 0.6004640111559191
Energy: 0.49084182708972995
Energy: 0.632516831915585
Energy: 0.4616849139264408
Energy: 0.5224313981463212
Energy: 0.46168491392693917
Energy: 0.623091507552227
Energy: 0.4638404429443442
Energy: 0.46122010183735845
Energy: 0.46384044294583915
Energy: 0.5102835377978172
Energy: 0.46177766335761683
Energy: 0.4638883056173298
Energy: 0.46177766335811515
Energy: 0.6574546446173547
Energy: 0.46254588390087725
Energy: 0.4677893901665015
Energy: 0.4625458839033689
Energy: 0.6356317284690896
Energy: 0.4617254633382983
Energy: 0.6224919027758586
Energy: 0.46172546333879666
Energy: 0.53896960664932
Energy: 0.4919643165629322
Energy: 0.5422156929345976
Energy: 0.49196431656343054
Energy: 0.4786913812386415
Energy: 0.47055740258971884
Energy: 0.5838516922236503
Energy: 0.47055740259221046
Energy: 0.5226816910292141
Energy: 0.470543487080884
Energy: 0.6372165439686841
Energy: 0.470543487080884
Energy: 0.4705956514630418
Energy: 0.4706872868242041
Energy: 0.6381047973293031
Energy: 0.4706872868247024
Energy: 0.47049530340362977
Energy: 0.470711523496495
Energy: 0.5591980811448345
Energy: 0.470711523496495
Energy: 0.4760430080889799
Energy: 0.47167699710657146
Energy: 0.6027388683895816
Energy: 0.4716769971035815
Energy: 0.6461468037765687
Energy: 0.4820423442422772
Energy: 0.6591795538660635
Energy: 0.48204234424377224
Energy: 0.6406473738178153
Energy: 0.4722926779168943
Energy: 0.48941408695600186
Energy: 0.4722926779168943
Energy: 0.6455876232327291
Energy: 0.47068870713108585
Energy: 0.47092416415481
Energy: 0.47068870713108585
Energy: 0.5854185610267527
Energy: 0.47212811253855996
Energy: 0.4896038746583979
Energy: 0.4721281125380617

minimum gb energy = 0.4610531042380991 eV
minimum distance =  2.59263651016754 Angstroms
sigma value = 89


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

Energy: 0.8195701477756737
Energy: 0.4282676779074822
Energy: 0.42746870841889323
Energy: 0.45002720717651673
Energy: 0.467325424618474
Energy: 0.46537717888543284
Energy: 0.4398199516059715
Energy: 0.4653771788867367
Energy: 0.42446811170344156
Energy: 0.4653920826777064
Energy: 0.4654235563976236
Energy: 0.4653920826777064
Energy: 0.42600713430851134
Energy: 0.46602189412429434
Energy: 0.4395764028714235
Energy: 0.46602189412429434
Energy: 0.4280192863466724
Energy: 0.4275206242192274
Energy: 0.46416089698208896
Energy: 0.4275206242192274
Energy: 0.42849973090904425
Energy: 0.4278127813192351
Energy: 0.46442407310080275
Energy: 0.4278127813192351
Energy: 0.42814690450518655
Energy: 0.4269743700389777
Energy: 0.4664191850207727
Energy: 0.4269743700402816
Energy: 0.42830707995088374
Energy: 0.4288952751987561
Energy: 0.42460519023517396
Energy: 0.42889527520005993
Energy: 0.4281647773767373
Energy: 0.4283869749686216
Energy: 0.42484807605797253
Energy: 0.4283869749686216
Energy: 0.46527533774819546
Energy: 0.46694828365821034
Energy: 0.4661232966854889
Energy: 0.46694828365821034
Energy: 0.4399315062995247
Energy: 0.4657300908084165
Energy: 0.4241184546763543
Energy: 0.4657300908071126
Energy: 0.4643899300232578
Energy: 0.42828506596688065
Energy: 0.43149862741439476
Energy: 0.42828506596688065
Energy: 0.4642805877815503
Energy: 0.42813852316372436
Energy: 0.4296089639610102
Energy: 0.42813852316242046
Energy: 0.4654743106420436
Energy: 0.4269534424413023
Energy: 0.42697936987471063
Energy: 0.4269534424426062
Energy: 0.4245984736632016
Energy: 0.4280057433312999
Energy: 0.4305728423675364
Energy: 0.4280057433312999

minimum gb energy = 0.4241184546763543 eV
minimum distance =  2.61782390560775 Angstroms
sigma value = 13


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

Energy: 0.7240045987763564
Energy: 0.41535922267090547
Energy: 0.5402438855375391
Energy: 0.4238755231736309
Energy: 0.596163501842149
Energy: 0.4122972897683873
Energy: 0.48935528081767354
Energy: 0.4122972897656548
Energy: 0.6414736960242587
Energy: 0.41175815070715943
Energy: 0.4842228401809036
Energy: 0.41175815070770594
Energy: 0.5529293600957733
Energy: 0.4123206740363527
Energy: 0.48613141243692803
Energy: 0.4123206740368992
Energy: 0.5506572175918188
Energy: 0.4121496511584356
Energy: 0.5982144924493583
Energy: 0.41214965115788915
Energy: 0.4854314530460272
Energy: 0.4122317056751461
Energy: 0.5960954723390145
Energy: 0.4122317056751461
Energy: 0.4849085734606112
Energy: 0.4119370654625968
Energy: 0.5649951064372724
Energy: 0.4119370654625968
Energy: 0.47468500409556486
Energy: 0.4131281579468557
Energy: 0.5919798344386802
Energy: 0.4131281579435766
Energy: 0.4212597611416843
Energy: 0.4129713758036607
Energy: 0.5884737548734378
Energy: 0.4129713758036607
Energy: 0.4141657589019076
Energy: 0.41252407149926124
Energy: 0.587628183885652
Energy: 0.41252407149980774
Energy: 0.4194146253085557
Energy: 0.4131884670127021
Energy: 0.7240331827892099
Energy: 0.4131884670198067
Energy: 0.5965537340226528
Energy: 0.4120149000873607
Energy: 0.5889353104596439
Energy: 0.41201490008681424
Energy: 0.5981718651448094
Energy: 0.43037412727080043
Energy: 0.5958877072807552
Energy: 0.4303741272751725
Energy: 0.6005826336548932
Energy: 0.4321003871746655
Energy: 0.5517537206619146
Energy: 0.43210038717083993
Energy: 0.5937746182093386
Energy: 0.41322391186629304
Energy: 0.5485404157188178
Energy: 0.4132239118739442
Energy: 0.5915456854413275
Energy: 0.4127002001817673
Energy: 0.41585727324417265
Energy: 0.4127002001855432
Energy: 0.5984775966430397
Energy: 0.412164143563075
Energy: 0.41451473782582465
Energy: 0.4121641435592496
Energy: 0.6374525162388306
Energy: 0.41304896526670787
Energy: 0.4173612260174069
Energy: 0.4130489652634288
Energy: 0.5322458277729926
Energy: 0.4130493231522127
Energy: 0.47958322457669533
Energy: 0.41304932315603826
Energy: 0.587035681761572
Energy: 0.4116675738824861
Energy: 0.4845837733666503
Energy: 0.4116675738824861
Energy: 0.5554450866168094
Energy: 0.4132579048528784
Energy: 0.4958653868563298
Energy: 0.4132579048545179
Energy: 0.587579012868982
Energy: 0.43703539181968626
Energy: 0.5957076671649358
Energy: 0.4370353918229653
Energy: 0.4867514567624484
Energy: 0.41264549756174373
Energy: 0.5985842612708782
Energy: 0.4126454975606507
Energy: 0.41553420493890403
Energy: 0.41157329882366556
Energy: 0.5667007906730646
Energy: 0.41157329885208394
Energy: 0.4721260616563018
Energy: 0.41247981140195444
Energy: 0.5908331221719891
Energy: 0.412479811402501
Energy: 0.41291593679605504
Energy: 0.4200224555564461
Energy: 0.5899984614452142
Energy: 0.42002245556027157
Energy: 0.4121959362373936
Energy: 0.4122928633498745
Energy: 0.5855331114978151
Energy: 0.4122928633493281
Energy: 0.42185853745294455
Energy: 0.4133126711727431
Energy: 0.6377399508130817
Energy: 0.41331267117165016
Energy: 0.5840214121811589
Energy: 0.4123795025837291
Energy: 0.5332387683287023
Energy: 0.4123795025837291
Energy: 0.4851406517118007
Energy: 0.4319982233410923
Energy: 0.5968418164669256
Energy: 0.4319982233438248
Energy: 0.5977640426348905
Energy: 0.43438777980656706
Energy: 0.5554608120662299
Energy: 0.4343877798136717
Energy: 0.5906383205680178
Energy: 0.41265961406011403
Energy: 0.584400210891121
Energy: 0.4126596140639396
Energy: 0.5908791738363945
Energy: 0.41273433295843753
Energy: 0.41845617779004035
Energy: 0.41273433295515854
Energy: 0.5666313995303061
Energy: 0.4120834061832926
Energy: 0.41231078820272105
Energy: 0.4120834061832926
Energy: 0.5242723109226692
Energy: 0.41237094481174635
Energy: 0.41573386219857494
Energy: 0.4123709448128393

minimum gb energy = 0.41157329882366556 eV
minimum distance =  2.60937488257424 Angstroms
sigma value = 37


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

Energy: 0.7080295793739056
Energy: 0.38593763604120307
Energy: 0.385898082557876
Energy: 0.39387726456835054
Energy: 0.6033214327795655
Energy: 0.3852058891273575
Energy: 0.4945632454165015
Energy: 0.3852058891273575
Energy: 0.625976519156761
Energy: 0.38503157360491935
Energy: 0.49276689808110263
Energy: 0.38503157360491935
Energy: 0.6233261110097761
Energy: 0.4250332892496817
Energy: 0.47735503381091376
Energy: 0.4250332892496817
Energy: 0.5837751072265492
Energy: 0.4253418615829487
Energy: 0.5396917148738402
Energy: 0.42534186158386755
Energy: 0.4968924429737809
Energy: 0.3751726269915729
Energy: 0.5920545150971908
Energy: 0.3751726269915729
Energy: 0.4352939868133805
Energy: 0.37500854015772733
Energy: 0.5746514021578752
Energy: 0.37500854015772733
Energy: 0.4775906891968013
Energy: 0.3691533230995269
Energy: 0.626466654642491
Energy: 0.3691533230985867
Energy: 0.43188593413187687
Energy: 0.3758487495785533
Energy: 0.624679464273596
Energy: 0.37584874957949355
Energy: 0.42526538762363775
Energy: 0.36877094409174654
Energy: 0.5730362368075925
Energy: 0.3687709440926868
Energy: 0.4261227951276351
Energy: 0.4264928860327194
Energy: 0.61880516896557
Energy: 0.42649288600827306
Energy: 0.5306482574418404
Energy: 0.3686936779247412
Energy: 0.5731224959222595
Energy: 0.36869367792662167
Energy: 0.5272579186867391
Energy: 0.37510225471802167
Energy: 0.625880252448175
Energy: 0.37510225471710285
Energy: 0.5831175081815915
Energy: 0.4085335111248638
Energy: 0.6233682991085447
Energy: 0.4085335111267443
Energy: 0.5396917148738402
Energy: 0.41714957514585504
Energy: 0.574509364513048
Energy: 0.41714957514773554
Energy: 0.6022307379396875
Energy: 0.4149280012836342
Energy: 0.4901532035096789
Energy: 0.4149280012836342
Energy: 0.5837942030291626
Energy: 0.38485786090347796
Energy: 0.4352934035257783
Energy: 0.3848578609044182
Energy: 0.6264666546415507
Energy: 0.3860223603981785
Energy: 0.36866899229513594
Energy: 0.3860223603981785
Energy: 0.6246794642726559
Energy: 0.38602913584599535
Energy: 0.38595822735333707
Energy: 0.38602913584599535
Energy: 0.6038443896323579
Energy: 0.3856561383485351
Energy: 0.39024240586068054
Energy: 0.3856561383475949

minimum gb energy = 0.36866899229513594 eV
minimum distance =  2.60556910928889 Angstroms
sigma value = 25


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

Energy: 0.8396295477572702
Energy: 0.3441685048162941
Energy: 0.34416125146155324
Energy: 0.3629436944024504
Energy: 0.6644074524908825
Energy: 0.34219862468202605
Energy: 0.4284540843483586
Energy: 0.34219862468276024
Energy: 0.6203965005895156
Energy: 0.3422537359808102
Energy: 0.42909339570142835
Energy: 0.3422537359815444
Energy: 0.5534671917962843
Energy: 0.3425520389112417
Energy: 0.5123886662653474
Energy: 0.34255203890977326
Energy: 0.6626551279634811
Energy: 0.3752736053922281
Energy: 0.5859471554967081
Energy: 0.3752736053929623
Energy: 0.5436775513839508
Energy: 0.3720026219167742
Energy: 0.5883135738622944
Energy: 0.3720026219167742
Energy: 0.5464821780680155
Energy: 0.33997485972614255
Energy: 0.5823932443997131
Energy: 0.33997485972540836
Energy: 0.5095698321051244
Energy: 0.33803027445207334
Energy: 0.617764343940228
Energy: 0.3380302744498707
Energy: 0.43051769556519076
Energy: 0.3376093874226852
Energy: 0.5838456502709573
Energy: 0.33760938742048263
Energy: 0.43081311959406
Energy: 0.3378370670751993
Energy: 0.6545013714176845
Energy: 0.3378370670759335
Energy: 0.37847664505648665
Energy: 0.3350851215342006
Energy: 0.7050364698368381
Energy: 0.3350851215503532
Energy: 0.37908431435917844
Energy: 0.33811434839104737
Energy: 0.6547694891503161
Energy: 0.33811434839178156
Energy: 0.3812387764235228
Energy: 0.334045626648755
Energy: 0.65345795229479
Energy: 0.33404562664948917
Energy: 0.462416316553554
Energy: 0.33518118694059534
Energy: 0.6526325090971472
Energy: 0.33518118694279797
Energy: 0.46674524478164137
Energy: 0.33350729999203227
Energy: 0.6591951479929496
Energy: 0.33350729999203227
Energy: 0.4626360564588856
Energy: 0.334057535169784
Energy: 0.6202005493139678
Energy: 0.334057535169784
Energy: 0.5803785236603138
Energy: 0.333765280482383
Energy: 0.6208317809632942
Energy: 0.33376528048164883
Energy: 0.4720300072779774
Energy: 0.3697590651003973
Energy: 0.5063237255290283
Energy: 0.3697590651025999
Energy: 0.5901547592452353
Energy: 0.3684523841324665
Energy: 0.5465900664929667
Energy: 0.3684523841332007
Energy: 0.6647701992335526
Energy: 0.3705581698590161
Energy: 0.5441871858942758
Energy: 0.3705581698575477
Energy: 0.7056891452327619
Energy: 0.36948657764439274
Energy: 0.42880804316625215
Energy: 0.36948657764439274
Energy: 0.6643468897145863
Energy: 0.34167944449393767
Energy: 0.3818250353854113
Energy: 0.3416794444932035
Energy: 0.6238516527567683
Energy: 0.3427449272259518
Energy: 0.4297623358942883
Energy: 0.3427449272274202
Energy: 0.6177880238096106
Energy: 0.3433064997482556
Energy: 0.34235571200592146
Energy: 0.3433064997482556
Energy: 0.6624725167668502
Energy: 0.3419112413297374
Energy: 0.3432870676921004
Energy: 0.3419112413297374
Energy: 0.6195533807486501
Energy: 0.3460461086951613
Energy: 0.3444288307884783
Energy: 0.34604610869589547

minimum gb energy = 0.33350729999203227 eV
minimum distance =  2.61090067025049 Angstroms
sigma value = 41


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

Energy: 0.8619784601995133
Energy: 0.31178097114678294
Energy: 0.31159569836320855
Energy: 0.3194277137562552
Energy: 0.709617873654057
Energy: 0.30998017729751054
Energy: 0.3819545345801898
Energy: 0.3099801772957047
Energy: 0.7072258871935085
Energy: 0.30978538785666365
Energy: 0.381460404573063
Energy: 0.3097853878560617
Energy: 0.5857470399494087
Energy: 0.3104413945378428
Energy: 0.5203469397342084
Energy: 0.3104413945348331
Energy: 0.7069473412826572
Energy: 0.3093295934768806
Energy: 0.5188206458685096
Energy: 0.30932959347627875
Energy: 0.5807639073091203
Energy: 0.3340194083820558
Energy: 0.515590806004009
Energy: 0.3340194083916867
Energy: 0.5854778922492109
Energy: 0.33462766738630245
Energy: 0.6431469777844091
Energy: 0.3346276673850986
Energy: 0.585963002085088
Energy: 0.33713543604151147
Energy: 0.5210023211439834
Energy: 0.33713543604211343
Energy: 0.45003778147757756
Energy: 0.3092502190389853
Energy: 0.6438488275014892
Energy: 0.30925021903778144
Energy: 0.4491833605579845
Energy: 0.3096184102944625
Energy: 0.7104532743910726
Energy: 0.3096184102944625
Energy: 0.38268801422236387
Energy: 0.31070273540420484
Energy: 0.641769547051818
Energy: 0.31070273540360294
Energy: 0.38109016592769296
Energy: 0.3097228461134947
Energy: 0.7094202129323873
Energy: 0.3097228461146986
Energy: 0.3839205560130707
Energy: 0.3104944615380649
Energy: 0.7118872145672722
Energy: 0.31049446153565724
Energy: 0.3096921638348696
Energy: 0.3107843906064531
Energy: 0.6417899216146625
Energy: 0.3107843906088608
Energy: 0.3111322146799059
Energy: 0.31007270077903265
Energy: 0.7073018857701766
Energy: 0.31007270077963456
Energy: 0.3141744780730959
Energy: 0.31042813224732113
Energy: 0.7093418793654228
Energy: 0.310428132248525
Energy: 0.3851654393776375
Energy: 0.31056789365899967
Energy: 0.703455701935889
Energy: 0.31056789365599
Energy: 0.3819101122607167
Energy: 0.30984895232011633
Energy: 0.7065715418248815
Energy: 0.30984895232071824
Energy: 0.3858352668320663
Energy: 0.3105875682715738
Energy: 0.5832828864868695
Energy: 0.3105875682721757
Energy: 0.5165402191429824
Energy: 0.3098078631069759
Energy: 0.5815717510149266
Energy: 0.30980786310757785
Energy: 0.5233087882755199
Energy: 0.3095149291697968
Energy: 0.6443201522951908
Energy: 0.30951492917039874
Energy: 0.5175254640120099
Energy: 0.3363309049218904
Energy: 0.5860619953728845
Energy: 0.3363309049224923
Energy: 0.6441671027497505
Energy: 0.3334866611342036
Energy: 0.5793763144725568
Energy: 0.3334866611348055
Energy: 0.5206161384554517
Energy: 0.33722907439527555
Energy: 0.5177960406796833
Energy: 0.33722907439407174
Energy: 0.6440799696293054
Energy: 0.3093786825626092
Energy: 0.45262801277771486
Energy: 0.30937868256020146
Energy: 0.6460931713104685
Energy: 0.3096074852133372
Energy: 0.5161246053802102
Energy: 0.3096074852133372
Energy: 0.6487981430206046
Energy: 0.31017173980459173
Energy: 0.3865109875853075
Energy: 0.3101717398057956
Energy: 0.7063708084793177
Energy: 0.3092806787351941
Energy: 0.3825471687875308
Energy: 0.3092806787345922
Energy: 0.6473982483742734
Energy: 0.31070401188987257
Energy: 0.38435543345946244
Energy: 0.31070401188987257
Energy: 0.646518188291274
Energy: 0.3105621515473791
Energy: 0.315069115655365
Energy: 0.3105621515467772
Energy: 0.7069335808718982
Energy: 0.31040588656956497
Energy: 0.31086287763639997
Energy: 0.31040588657137075
Energy: 0.7035031846955486
Energy: 0.3105470982574232
Energy: 0.30985097085063107
Energy: 0.31054709825802523

minimum gb energy = 0.30925021903778144 eV
minimum distance =  2.62538225672673 Angstroms
sigma value = 15


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

Energy: 0.7382460817925972
Energy: 0.29334926702272224
Energy: 0.4512806726897022
Energy: 0.300637073236145
Energy: 0.7450088063523511
Energy: 0.2900869731466459
Energy: 0.35263551197558546
Energy: 0.29008697314511617
Energy: 0.7435400289680808
Energy: 0.28997748503174714
Energy: 0.3522685184935009
Energy: 0.289977485032767
Energy: 0.6390086600371044
Energy: 0.2909857355482583
Energy: 0.4746489977663229
Energy: 0.29098573554366897
Energy: 0.6928528244901907
Energy: 0.29240580695040885
Energy: 0.46854169189748585
Energy: 0.2924058069509188
Energy: 0.6325040716600779
Energy: 0.2944971660900676
Energy: 0.46615228236794837
Energy: 0.29449716608955767
Energy: 0.524677775268927
Energy: 0.3140534972185628
Energy: 0.5799218631757553
Energy: 0.3140534972216223
Energy: 0.5851366963264061
Energy: 0.3177097920412927
Energy: 0.46857499985114764
Energy: 0.3177097920316042
Energy: 0.52356093475452
Energy: 0.3110047899862507
Energy: 0.5769818650346672
Energy: 0.31100478998523085
Energy: 0.5224647506573531
Energy: 0.29306246995302465
Energy: 0.6862202591987979
Energy: 0.2930624699565941
Energy: 0.4728326199696421
Energy: 0.2912985123650157
Energy: 0.5857027967579661
Energy: 0.29129851237419424
Energy: 0.41076751556821894
Energy: 0.29390399334375955
Energy: 0.6863500498628267
Energy: 0.29390399334426953
Energy: 0.46639766725402987
Energy: 0.29315464473938907
Energy: 0.6878518164884286
Energy: 0.29315464473887914
Energy: 0.36121637023581016
Energy: 0.29105576711808456
Energy: 0.5828877881789952
Energy: 0.29105576711808456
Energy: 0.3502814698978629
Energy: 0.2898214972664101
Energy: 0.7434388205859853
Energy: 0.2898214972648804
Energy: 0.354515059916004
Energy: 0.2910531595529437
Energy: 0.6895110146260802
Energy: 0.2910531595549834
Energy: 0.29913112804108005
Energy: 0.2910961548217658
Energy: 0.6926312722776992
Energy: 0.29109615482227574
Energy: 0.29026771367479354
Energy: 0.29009408766050254
Energy: 0.7417072799792161
Energy: 0.2900940876620323
Energy: 0.29857329714105063
Energy: 0.29116307044337914
Energy: 0.6360789347382263
Energy: 0.29116307044439893
Energy: 0.35456161935904995
Energy: 0.29097088573981045
Energy: 0.7477047476355775
Energy: 0.2909708857408303
Energy: 0.34878457312394073
Energy: 0.2898895398963523
Energy: 0.7420690113205277
Energy: 0.2898895398994118
Energy: 0.359868895352579
Energy: 0.29081182614638645
Energy: 0.6382299073739096
Energy: 0.29081182614638645
Energy: 0.4668953759067538
Energy: 0.29041165509035044
Energy: 0.6312002707827894
Energy: 0.29041165509035044
Energy: 0.4696205888719696
Energy: 0.29293887672809305
Energy: 0.687161722154754
Energy: 0.29293887673013275
Energy: 0.47265612123541895
Energy: 0.2923207912307174
Energy: 0.5291319230434319
Energy: 0.2923207912312274
Energy: 0.5779185634228517
Energy: 0.2926927307212545
Energy: 0.6873600015365486
Energy: 0.2926927307222743
Energy: 0.46932367109369794
Energy: 0.3111717421315773
Energy: 0.5776014981084187
Energy: 0.311171742139226
Energy: 0.5828942803679407
Energy: 0.3152498214361655
Energy: 0.5295367450838742
Energy: 0.31524982143157626
Energy: 0.5799664729448836
Energy: 0.31382738107579705
Energy: 0.5793895623538405
Energy: 0.31382738104065894
Energy: 0.5788513426915197
Energy: 0.29514962233099934
Energy: 0.4662566150118059
Energy: 0.2951496223320192
Energy: 0.6924516225841146
Energy: 0.29005769851935903
Energy: 0.4107471365533513
Energy: 0.2900576985254781
Energy: 0.5831132573779156
Energy: 0.2902523422618379
Energy: 0.47294592744146924
Energy: 0.29025234226081803
Energy: 0.6882509493497236
Energy: 0.29031280825154177
Energy: 0.3529279670461648
Energy: 0.29031280825205164
Energy: 0.7446621784913918
Energy: 0.2902527810258673
Energy: 0.3527403760616042
Energy: 0.2902527810258673
Energy: 0.6848988141999933
Energy: 0.2908880260558487
Energy: 0.30412104576464294
Energy: 0.2908880260532991
Energy: 0.7451319223177293
Energy: 0.2908264009145036
Energy: 0.2934991827493507
Energy: 0.2908264009134838
Energy: 0.7425135645726946
Energy: 0.29093291449468606
Energy: 0.2921782340337283
Energy: 0.2909329144936662

minimum gb energy = 0.2898214972648804 eV
minimum distance =  2.62422215752068 Angstroms
sigma value = 85


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

Energy: 0.8353150569511748
Energy: 0.26204284256444127
Energy: 0.26198480652007994
Energy: 0.28442123146394743
Energy: 0.7596283388767628
Energy: 0.2624960760582988
Energy: 0.31626240344128204
Energy: 0.2624960760582988
Energy: 0.6825830977403997
Energy: 0.2621158094504352
Energy: 0.3151332756957445
Energy: 0.26211580945176205
Energy: 0.5835263660423754
Energy: 0.26255577304849254
Energy: 0.4160633406533065
Energy: 0.26255577304760813
Energy: 0.6862590876471312
Energy: 0.2619912131007523
Energy: 0.41780376619505555
Energy: 0.2619912130989833
Energy: 0.585141592430574
Energy: 0.26230467324590806
Energy: 0.41681133643173573
Energy: 0.2623046732463503
Energy: 0.5837859640110377
Energy: 0.2632242611982836
Energy: 0.5137522947476783
Energy: 0.2632242611969569
Energy: 0.6106809370695444
Energy: 0.2623318469055105
Energy: 0.4438927571356102
Energy: 0.26233184690727945
Energy: 0.5872411536961427
Energy: 0.2628267510112641
Energy: 0.5147940858390491
Energy: 0.2628267510236272
Energy: 0.5868860024771027
Energy: 0.4080050469808323
Energy: 0.6101509777833768
Energy: 0.40800504698215906
Energy: 0.5143201528237864
Energy: 0.2997069553947846
Energy: 0.535932682184798
Energy: 0.2997069553877286
Energy: 0.4914402955832048
Energy: 0.261691231254826
Energy: 0.6107860940848239
Energy: 0.2616912312552683
Energy: 0.5142962085878992
Energy: 0.2615882186214506
Energy: 0.6332802314450279
Energy: 0.2615882186059716
Energy: 0.41433335917209824
Energy: 0.2617621962457251
Energy: 0.5356387263398994
Energy: 0.2617621962532434
Energy: 0.3908596829198977
Energy: 0.2615584775369561
Energy: 0.7072061630034432
Energy: 0.2615584775418209
Energy: 0.4147678127182798
Energy: 0.2617373000010031
Energy: 0.6345086107424164
Energy: 0.2617373000005609
Energy: 0.3154790918626687
Energy: 0.261832638307953
Energy: 0.6319976359838599
Energy: 0.261832638307953
Energy: 0.3153344551568393
Energy: 0.2625445259978033
Energy: 0.7329905176568255
Energy: 0.26254452599736106
Energy: 0.3120649607903782
Energy: 0.2608241491246949
Energy: 0.7283107498507463
Energy: 0.26082414912513724
Energy: 0.2867896730561377
Energy: 0.2607565757092651
Energy: 0.7282778907646285
Energy: 0.2607565757110341
Energy: 0.2865043313530816
Energy: 0.2605050323508852
Energy: 0.7560372892577432
Energy: 0.2605050323491162
Energy: 0.28714433806607037
Energy: 0.2627124146526588
Energy: 0.6552362949744774
Energy: 0.2627124146517743
Energy: 0.33884072889468814
Energy: 0.26120037248297806
Energy: 0.7518048632614357
Energy: 0.2612003724843048
Energy: 0.33961580421323084
Energy: 0.2616194151022364
Energy: 0.7548371742278622
Energy: 0.2616194151031209
Energy: 0.33882491062495107
Energy: 0.2612113304612552
Energy: 0.5834800514950884
Energy: 0.2612113304550637
Energy: 0.41786728600609974
Energy: 0.26174989806041177
Energy: 0.7575864714142866
Energy: 0.26174989806041177
Energy: 0.41749007262198434
Energy: 0.2618108158272263
Energy: 0.6822236056560159
Energy: 0.2618108158276686
Energy: 0.5130351567535161
Energy: 0.260492353087607
Energy: 0.5837218788425953
Energy: 0.26049235310706625
Energy: 0.5142617381469266
Energy: 0.2622382045748262
Energy: 0.683676795081359
Energy: 0.262238204576153
Energy: 0.5127811983158499
Energy: 0.2617653686545378
Energy: 0.5849178443311971
Energy: 0.26176536855507077
Energy: 0.6130142294191038
Energy: 0.2990317850450888
Energy: 0.49118356444182537
Energy: 0.29903178504331984
Energy: 0.5359740075002309
Energy: 0.29931400706048655
Energy: 0.5953864769110734
Energy: 0.2993140070697739
Energy: 0.6108712774045497
Energy: 0.3274500927546558
Energy: 0.48914689259447425
Energy: 0.32745009275509807
Energy: 0.7075680551484935
Energy: 0.26338488418909434
Energy: 0.4899558474818861
Energy: 0.2633848841921901
Energy: 0.5357463713258805
Energy: 0.2631057993142237
Energy: 0.41603320102824887
Energy: 0.26310579931466593
Energy: 0.7085717389408358
Energy: 0.2621068902087986
Energy: 0.4177723129722067
Energy: 0.2621068902048183
Energy: 0.7319635082379745
Energy: 0.2621838512224263
Energy: 0.41638514215521993
Energy: 0.26218385122023513
Energy: 0.6319555542141624
Energy: 0.26297784378175826
Energy: 0.31421920038528794
Energy: 0.2629778437822005
Energy: 0.7577126990306279
Energy: 0.26210553616313803
Energy: 0.3143822479096797
Energy: 0.26210553616358023
Energy: 0.7281187032262422
Energy: 0.26284573211263274
Energy: 0.31617519922196274
Energy: 0.2628457321117483
Energy: 0.6318319053702389
Energy: 0.2637852603471518
Energy: 0.2620745097053913
Energy: 0.2637852603467095
Energy: 0.7564963333658807
Energy: 0.26227613713714687
Energy: 0.26261979295857013
Energy: 0.2622761371389159
Energy: 0.680167448105469
Energy: 0.2632175692726204
Energy: 0.2624088752883633
Energy: 0.2632175692757161

minimum gb energy = 0.260492353087607 eV
minimum distance =  2.62918650007583 Angstroms
sigma value = 113


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

Energy: 0.012423751206381456
Energy: 0.22967283814652525
Energy: 0.5983780939754078
Energy: 0.014102574835306655
Energy: 28.383806406889093
Energy: 0.05728053832821152
Energy: 0.42628794786476176
Energy: 0.05728053832789042
Energy: 0.012786851955818575
Energy: 0.056533504377744445
Energy: 0.4248411043281692
Energy: 0.056533504382069784
Energy: 0.013773118311733551
Energy: 0.05628318773854704
Energy: 0.4257968735587396
Energy: 0.05628318773854704
Energy: 0.42564642375774325
Energy: 0.05759679881913148
Energy: 0.42757363581040575
Energy: 0.05759679881913148
Energy: 0.01277939982044041
Energy: 0.05634750012237548
Energy: 0.42427750699516037
Energy: 0.05634750012205439

minimum gb energy = 0.012423751206381456 eV
minimum distance =  2.88142183511568 Angstroms
sigma value = 1