Model name: model_name=EAM_MagneticCubic_DudarevDerlet_2005_Fe__MO_135034229282_002
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.608116634190083
cohesive_energy=4.229961104259564
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[3.8353705353009e-21, 2.3689303057333798e-20, 4.1711066489556e-20, 6.480932658660719e-20, 9.74046488993568e-20, 1.3667880472859879e-19, 1.7437770049129197e-19, 2.05963010653968e-19, 4.904679242598839e-19, 5.27521463274402e-19, 5.601978557248319e-19, 5.8758225875316e-19, 6.0942793715775e-19, 6.26374159415568e-19, 6.394879751648579e-19, 6.49692238146804e-19, 6.57642238604712e-19, 6.6379299470263795e-19, 6.68495383123428e-19, 6.7201696736496e-19, 6.74569234742922e-19, 6.763108007440799e-19, 6.773281829066699e-19, 6.776614356465419e-19, 6.77302548080526e-19, 6.76139367844242e-19, 6.740244946873619e-19, 6.70778484826878e-19, 6.6620907706671e-19, 6.601656668032619e-19, 6.52488036373134e-19, 6.430255811727299e-19, 6.323855261463359e-19, 6.22182865341024e-19, 6.13479841865136e-19, 6.079250954750579e-19, 6.01774339377132e-19, 5.832083165423399e-19, 5.358591904777379e-19, 4.3828342911387e-19, 2.6200394495801997e-19, -3.0512652906213e-20, -4.88357857632906e-19, -1.176612885183456e-18, -2.1641400883755e-18, -3.3543810880077597e-18, -4.537668641048459e-18, -5.61743956176642e-18, -6.890176636283339e-18, -8.75619971837046e-18, -1.1612464090867619e-17, -1.6314163575705e-17, -2.5074865410416998e-17, -4.210039541161799e-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: 0.016375437202618835
Energy: 1.4526296517269621
Energy: 0.01671126202204915
Energy: 0.016632927035173332
Energy: 1.4923788247207024
Energy: 0.0168182105981472
Energy: 1.452628504704841
Energy: 0.12585853271213726
Energy: 0.6098360810544934
Energy: 0.5852878336543431
Energy: 0.4467157276028526
Energy: 0.6021138262259714
Energy: 0.016711262022643784
Energy: 0.611205423811511
Energy: 0.451016657797335
Energy: 0.01679029165397619
Energy: 0.5989979052002472
Energy: 0.4866932734265564
Energy: 0.016632927035453157
Energy: 0.59724748491543
Energy: 0.01679029165397619
Energy: 0.016664587475060083
Energy: 0.496286341115965
Energy: 0.016733387417039298
Energy: 1.4924187243905969
Energy: 0.26862199929553054
Energy: 0.5989741980357565
Energy: 0.5977733059412004
Energy: 0.6982863123513466
Energy: 0.5952898591971522
Energy: 0.01681821059877681
Energy: 0.5949473330845145
Energy: 0.4863399645456677
Energy: 0.016733387416444666
Energy: 0.5953064416634432
Energy: 0.01664785534192528

minimum gb energy = 0.016375437202618835 eV
minimum distance =  2.54913677209372 Angstroms
sigma value = 1


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

Energy: 1.7972114851755199
Energy: 0.9026992232378528
Energy: 1.5612302940729623
Energy: 0.947383550476066
Energy: 1.6021496347682955
Energy: 0.9475226931126015
Energy: 1.6769066639956252
Energy: 0.8357835421309893
Energy: 0.8503961717434472
Energy: 0.980836551637812
Energy: 0.9284524602836574
Energy: 0.8392896642989779
Energy: 1.7655900635027255
Energy: 0.8655820454620434
Energy: 0.8375116365009679
Energy: 0.9003379331058496
Energy: 0.8645037004710349
Energy: 0.8068320720786559
Energy: 1.7956826554432006
Energy: 0.9053328660728709
Energy: 0.8768323918012809
Energy: 0.8737028277120183
Energy: 0.9232410307599958
Energy: 0.8638974282240529
Energy: 1.7226288359779038
Energy: 0.8245883642888499
Energy: 0.8844890070463165
Energy: 0.8807523607014035
Energy: 0.8333973401503572
Energy: 0.8340637989424108
Energy: 1.5756085655312422
Energy: 0.8182004955268177
Energy: 0.8143978209904363
Energy: 0.8259649835691517
Energy: 0.8163948404058725
Energy: 0.8190944986301405
Energy: 1.5862776068450515
Energy: 0.8343946737030532
Energy: 0.8093878414142722
Energy: 0.8454872668165994
Energy: 0.8310866424030785
Energy: 0.8114348226193118
Energy: 1.4807001210210202
Energy: 0.7770156294936919
Energy: 0.828863908021927
Energy: 0.8591281456643325
Energy: 0.785859701637395
Energy: 0.8410652653972073
Energy: 1.1723012001587858
Energy: 0.7960783240762297
Energy: 0.8159972891078666
Energy: 0.8477020042271403
Energy: 0.8107828587563193
Energy: 0.8098996578495684
Energy: 1.1882109705989194
Energy: 0.8440467794704514
Energy: 0.8452768855189473
Energy: 0.8578117654113168
Energy: 0.9004071532089207
Energy: 0.8762172374980495
Energy: 1.2551383161401406
Energy: 0.854599028242773
Energy: 0.831542078249846
Energy: 0.9537658548362463
Energy: 0.8584564734966963
Energy: 0.8923587163566712
Energy: 0.9409677485668105
Energy: 0.8426999802662162
Energy: 0.8087797612738349
Energy: 0.9282576795979528
Energy: 0.8705361435586109
Energy: 0.8183831670912861
Energy: 1.0109380412200677
Energy: 0.8539411132155454
Energy: 0.8497801180091809
Energy: 0.9723682565007533
Energy: 0.9519622521300373
Energy: 0.8652154025896133
Energy: 1.1464190320370984
Energy: 0.9533276598017923
Energy: 0.8537653700477306
Energy: 0.9867775712508255
Energy: 0.8622910087152449
Energy: 0.978817840689082
Energy: 1.0422284287599286
Energy: 0.8691228092044453
Energy: 0.8746967266508386
Energy: 0.9185951266976158
Energy: 0.9078519428593883
Energy: 0.8589617528803405
Energy: 1.0070505383266997
Energy: 0.8320492718220988
Energy: 0.8359327793848881
Energy: 0.8623725838408127
Energy: 0.8381045836675924
Energy: 0.8445205288712595
Energy: 1.370158583281492
Energy: 0.8147237500849411
Energy: 0.7915909519468785
Energy: 0.8931734369282466
Energy: 0.8358828009196576
Energy: 0.8570515859892036
Energy: 1.3950431628401996
Energy: 0.8319293969800539
Energy: 0.8290554233233399
Energy: 0.8073528826792907
Energy: 0.838808433275157
Energy: 0.8268147488769755
Energy: 1.4095623824358263
Energy: 0.8278328802355069
Energy: 0.8251164646491661
Energy: 0.8519636337988292
Energy: 0.8160122130312909
Energy: 0.8268440134245585
Energy: 1.6501495586020616
Energy: 0.8260411194634041
Energy: 0.8540160638117558
Energy: 0.9090349015151965
Energy: 0.8167438993719851
Energy: 0.8576437613343362
Energy: 1.6783140982333682
Energy: 0.8908105790173235
Energy: 0.8720042926927419
Energy: 0.8634431519611501
Energy: 0.923933244996958
Energy: 0.8332209282552872
Energy: 1.7057030530834796
Energy: 0.8460901677644023
Energy: 0.8320253384338308
Energy: 0.8245812091059828
Energy: 0.850871910411075
Energy: 0.8008272832335389
Energy: 1.6780970609230925
Energy: 0.9180129708711763
Energy: 0.8531537979945006
Energy: 0.7981559922049508
Energy: 0.925621817414608
Energy: 0.8402966538612472

minimum gb energy = 0.7770156294936919 eV
minimum distance =  2.25641537341897 Angstroms
sigma value = 33


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

Energy: 2.0591921425508426
Energy: 1.6517945543525874
Energy: 0.8904201300399821
Energy: 1.1779635148081666
Energy: 1.3958720982644224
Energy: 0.9474447491253193
Energy: 1.8447985079923965
Energy: 0.911506455036716
Energy: 0.8804689336932482
Energy: 0.8843572073680379
Energy: 0.9004075453077951
Energy: 0.896077631026799
Energy: 1.6596677538710924
Energy: 0.984724476265181
Energy: 0.8927897348230309
Energy: 1.0094548528006995
Energy: 0.9301863582623675
Energy: 0.9753358917894073
Energy: 1.637126107084446
Energy: 1.0775637503258986
Energy: 0.8952245345683192
Energy: 0.9371057845028199
Energy: 0.916845945477042
Energy: 0.9399679179368424
Energy: 1.7724782224459346
Energy: 0.91022806886237
Energy: 0.9121380061929641
Energy: 0.9446346570438913
Energy: 0.9520608098125516
Energy: 1.0024503337964068
Energy: 1.6451176218268466
Energy: 0.9940766915222357
Energy: 0.9389371651207791
Energy: 0.9454111362308018
Energy: 0.9764237373480289
Energy: 0.9903534207596715
Energy: 1.6563063440366534
Energy: 0.9614161823791432
Energy: 0.9690518172459839
Energy: 0.9635224446235848
Energy: 0.9824575711724742
Energy: 0.9527497127864307
Energy: 1.536773225606674
Energy: 0.8932233108305164
Energy: 0.9014293103126793
Energy: 0.9891928726905433
Energy: 0.9056439182809882
Energy: 0.8776625853900198
Energy: 1.2408912319618421
Energy: 0.9065045996725334
Energy: 0.9413638540965454
Energy: 0.9495811721509202
Energy: 0.924659686282752
Energy: 0.9769144291290272
Energy: 1.2549831317981366
Energy: 1.0147340886888014
Energy: 0.9841074787941184
Energy: 0.9905833401180001
Energy: 0.9622798805782318
Energy: 0.9875367051556945
Energy: 1.3477393449573416
Energy: 0.8400070628486107
Energy: 0.8335996350744376
Energy: 1.0695289857820596
Energy: 0.9175945163833903
Energy: 0.8758157633759711
Energy: 1.0369651903374053
Energy: 0.8602992635681607
Energy: 0.9832828404891828
Energy: 1.0072329480436444
Energy: 0.890640774435342
Energy: 0.9860348842494404
Energy: 1.0494757078834307
Energy: 0.9939577469193511
Energy: 0.9711812327092012
Energy: 1.0247189111441162
Energy: 0.9968971646510281
Energy: 0.9733466727238916
Energy: 1.2567359126909037
Energy: 0.9729113086176961
Energy: 0.9629430427533873
Energy: 1.0351343420637251
Energy: 0.942986455228991
Energy: 0.9661819290592398
Energy: 1.2258481167693915
Energy: 0.9894498592821044
Energy: 0.9903464277781243
Energy: 1.0557695599322454
Energy: 0.9773522741958187
Energy: 0.9865901337436461
Energy: 1.2130610938080555
Energy: 0.9814009802717313
Energy: 0.9719307481777866
Energy: 1.0221483434479819
Energy: 0.9643876598022648
Energy: 0.9654659916840584
Energy: 1.5219297473271907
Energy: 0.9642814162080491
Energy: 0.945523692386909
Energy: 0.9739022823693249
Energy: 1.0299713061995683
Energy: 0.9567515122478751
Energy: 1.4053019408885057
Energy: 0.9685911463190545
Energy: 0.9698638132362747
Energy: 0.8990137068150678
Energy: 0.982784043148682
Energy: 0.8705961210691803
Energy: 1.4251346007240724
Energy: 0.9471971680636969
Energy: 0.9462100274289887
Energy: 0.9204289043518361
Energy: 0.9535096667225429
Energy: 0.9417927727523242
Energy: 1.6466807601030575
Energy: 0.9429414770206006
Energy: 0.950724905966463
Energy: 1.0527500192269055
Energy: 0.9796995821671515
Energy: 0.9762842462913154
Energy: 1.833068006294913
Energy: 1.062525430311098
Energy: 0.8605938152653754
Energy: 0.9146664798958378
Energy: 1.0343810325239766
Energy: 0.8498093330699544
Energy: 1.7660581538371622
Energy: 0.9967916632892779
Energy: 0.9922810974830887
Energy: 0.9294124670090383
Energy: 0.9884400566763859
Energy: 0.9790386046110142
Energy: 1.6453724740161804
Energy: 0.9796496245096885
Energy: 0.9862386277807365
Energy: 1.1307387738263113
Energy: 0.9932607095755388
Energy: 0.9810535085767508
Energy: 1.726650515052776
Energy: 1.0564113147412115
Energy: 1.0465626944405877
Energy: 0.9574718030737517
Energy: 1.10700902500205
Energy: 0.9487326548875481
Energy: 1.6608509883393974
Energy: 0.9974017923004659
Energy: 0.9796871460318005
Energy: 1.033814652090941
Energy: 1.0116824925253434
Energy: 0.9899632155406932
Energy: 1.6519371037973942
Energy: 0.9973467397095045
Energy: 0.9763771606249921
Energy: 0.9752102251775474
Energy: 1.0119437792968717
Energy: 0.9594368471390474
Energy: 1.642230062757404
Energy: 0.9757842288409185
Energy: 0.9480378051944349
Energy: 1.0170607095543949
Energy: 0.9915857305303175
Energy: 0.9417608904125804
Energy: 1.5394644969940963
Energy: 0.8869643457886692
Energy: 0.878245712644538
Energy: 1.0699178986565694
Energy: 0.9047361466999644
Energy: 0.957487070861044
Energy: 1.247808146138866
Energy: 0.8971485334907887
Energy: 0.8800387833625093
Energy: 0.9698336123598231
Energy: 0.9016214502769575
Energy: 0.942330440758624
Energy: 1.2310261379595735
Energy: 0.977880894442019
Energy: 0.9569264141045448
Energy: 0.9455552853421773
Energy: 0.9868407343294562
Energy: 0.940780127789995
Energy: 1.329330534066753
Energy: 0.840010320897205
Energy: 0.8554259021368068
Energy: 1.0216718372711433
Energy: 0.9449703740435983
Energy: 0.8458002422312199
Energy: 1.0623899397922543
Energy: 0.8555035523178306
Energy: 0.8699888075024261
Energy: 1.0091397995961229
Energy: 0.8777231056553855
Energy: 0.9717032399234216
Energy: 1.0359102134467706
Energy: 0.9760139168056443
Energy: 0.9548548719582521
Energy: 1.0059118676856407
Energy: 1.0383739211687306
Energy: 0.9704159320996247
Energy: 1.0574578167363038
Energy: 0.9915917730862203
Energy: 0.9625725664993542
Energy: 1.041087348579051
Energy: 0.9334020616677259
Energy: 0.9848066881030876
Energy: 1.223599670759326
Energy: 1.005107065902982
Energy: 0.9700540887697147
Energy: 1.0306774820545774
Energy: 1.0416304864526702
Energy: 0.9622819396245146
Energy: 1.2214191794146743
Energy: 0.9439919193692657
Energy: 0.9613510089162858
Energy: 1.042534393450042
Energy: 0.9570943818602444
Energy: 0.9797774365284352
Energy: 1.5074609069352543
Energy: 0.9826252011731649
Energy: 0.9083264033831888
Energy: 0.9278388977895867
Energy: 0.9001326389554675
Energy: 0.9821286768382006
Energy: 1.4256362705774954
Energy: 0.9883926111213397
Energy: 0.8692422571628466
Energy: 0.9110703282417034
Energy: 0.849614038019931
Energy: 0.9602209138203033
Energy: 1.4068990320884178
Energy: 0.9679554507137673
Energy: 0.8764849285808018
Energy: 0.9240491778282498
Energy: 0.8780586575128313
Energy: 0.8781437003518777
Energy: 1.7520657822716283
Energy: 0.8835495393440403
Energy: 0.8340065699333231
Energy: 0.8495134390084572
Energy: 0.8625812955417516
Energy: 0.9600953109767543
Energy: 1.8530863614708033
Energy: 0.9777770769657004
Energy: 0.8533849243614233
Energy: 0.9266662174460738
Energy: 0.9361748669720641
Energy: 0.9118381177535073

minimum gb energy = 0.8335996350744376 eV
minimum distance =  2.24495278982579 Angstroms
sigma value = 51


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

Energy: 1.850070187387555
Energy: 1.628307781823865
Energy: 0.9755650230185777
Energy: 1.0111649853943525
Energy: 1.0998011588082481
Energy: 0.9417998674259532
Energy: 1.8179521055326389
Energy: 0.9689116427450251
Energy: 0.9348794639508293
Energy: 0.8891834165312816
Energy: 0.9925351759662726
Energy: 0.8696599568002004
Energy: 1.605203354723012
Energy: 0.9344954369013162
Energy: 0.9313382687417203
Energy: 0.9055122121920339
Energy: 0.9539846167955245
Energy: 0.9931643986982697
Energy: 1.6018049342843668
Energy: 1.1173258001277284
Energy: 0.9053801922302411
Energy: 0.9100942885776525
Energy: 0.9794698253310522
Energy: 0.9526658133138783
Energy: 1.6061604211167266
Energy: 0.9112553477113351
Energy: 0.9041622962428247
Energy: 0.8884393989908547
Energy: 0.8915961093705111
Energy: 0.8914413775244254
Energy: 1.3443602946994468
Energy: 0.8916551675478755
Energy: 0.8968475616272379
Energy: 0.9227761828812824
Energy: 0.9219826230852719
Energy: 0.9249936739235246
Energy: 1.3415537660816672
Energy: 0.8779468544082042
Energy: 0.9040415652028029
Energy: 0.9617216291400676
Energy: 0.8371890807503382
Energy: 0.925933499181417
Energy: 1.3649016369296052
Energy: 0.9235324298121421
Energy: 0.8918358025272191
Energy: 0.9399840437231202
Energy: 0.9408632652202968
Energy: 0.9091419068049712
Energy: 0.983676106362511
Energy: 0.8858014118234451
Energy: 0.905889363273181
Energy: 0.979821434073306
Energy: 0.9345229197144561
Energy: 0.9509173308176709
Energy: 1.0643140703939373
Energy: 0.8861155169665823
Energy: 0.9238777307974314
Energy: 0.9862960827975709
Energy: 0.9472040939387525
Energy: 0.9265415406043046
Energy: 1.1196312293517594
Energy: 0.9719413423052495
Energy: 0.9216644180431215
Energy: 1.0930937836034058
Energy: 0.9648531245149526
Energy: 0.9393604859023508
Energy: 1.1541771929122462
Energy: 0.8857494534474101
Energy: 0.8832706437063907
Energy: 1.0061097646831705
Energy: 0.9550430707471915
Energy: 0.9296777219669005
Energy: 1.0962249941685969
Energy: 0.9093754594342975
Energy: 0.8766931191031422
Energy: 0.9611908827328263
Energy: 0.9226962132289727
Energy: 0.8774112113766909
Energy: 1.5089680485238348
Energy: 0.9272725753091874
Energy: 0.8954685828127761
Energy: 1.1219501089328736
Energy: 0.934197746611431
Energy: 0.8962374823523247
Energy: 1.4634405919678077
Energy: 0.8910346547309593
Energy: 0.9264132479312354
Energy: 0.9741196302335713
Energy: 0.911688954501807
Energy: 0.8997239247008759
Energy: 1.4526919088524464
Energy: 0.9080789532580308
Energy: 0.924702079998414
Energy: 0.9077144228146163
Energy: 0.8850280148087504
Energy: 0.8999313545097705
Energy: 1.6928182540751284
Energy: 0.8490934382882228
Energy: 0.849572035832225
Energy: 0.8809908874329405
Energy: 0.9307506136247051
Energy: 0.8826911837198987
Energy: 1.730273626349119
Energy: 1.1165656622851619
Energy: 0.9701891997917454
Energy: 0.946062252969256
Energy: 0.9857317863326731
Energy: 1.0633247184836996

minimum gb energy = 0.8371890807503382 eV
minimum distance =  2.2559877318016 Angstroms
sigma value = 19


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

Energy: 1.6114963435831202
Energy: 1.717422263396533
Energy: 0.9552494526501937
Energy: 1.007281994554382
Energy: 1.79664258622346
Energy: 0.957599437901008
Energy: 1.613408924833297
Energy: 0.9589812287451469
Energy: 0.9771022986443186
Energy: 0.9983756820345244
Energy: 0.9895574902324121
Energy: 0.9831201300073671
Energy: 1.6245030043606916
Energy: 1.0196795015872069
Energy: 0.9842032832442397
Energy: 1.0537212338808746
Energy: 1.0207965522256404
Energy: 0.9962706393622561
Energy: 1.3160185054292826
Energy: 1.026688246755621
Energy: 1.0147579311308397
Energy: 0.9762876737084951
Energy: 1.0303837017697242
Energy: 1.1389119932768366
Energy: 1.621197927056552
Energy: 0.9880396458401801
Energy: 0.9837492100087863
Energy: 0.9820238349117906
Energy: 0.9794467150758374
Energy: 0.9743897185633074
Energy: 1.2886197460110924
Energy: 0.9437801875009992
Energy: 0.9707609421293094
Energy: 0.9803891858268928
Energy: 0.9895316014739206
Energy: 0.9698683872202336
Energy: 1.3025296971095721
Energy: 0.9708346226823452
Energy: 0.9612513297984799
Energy: 0.9764951232316634
Energy: 0.9814243800067436
Energy: 0.9703985918231575
Energy: 1.2016900445091954
Energy: 0.9926159457415885
Energy: 0.9934625629301205
Energy: 0.9720057861836668
Energy: 0.9431446723061729
Energy: 0.9301295645428637
Energy: 1.007955837958062
Energy: 0.9448038119784248
Energy: 0.9571526005594749
Energy: 0.990479908094064
Energy: 0.9484783764947132
Energy: 0.9405562501712921
Energy: 1.0575903121285917
Energy: 1.0015481009612615
Energy: 0.9783070854350415
Energy: 1.001935675075163
Energy: 1.0427409578081517
Energy: 0.9702741521567565
Energy: 1.0739417283326718
Energy: 0.9699718160892078
Energy: 0.9793530753430171
Energy: 1.0223293174176769
Energy: 0.9907830540064161
Energy: 1.0279224727407803
Energy: 1.3450052503890852
Energy: 0.9899034037045806
Energy: 0.9806021577761468
Energy: 1.0592771250831423
Energy: 0.9792305630358265
Energy: 0.9764202781920658
Energy: 0.9685165912271041
Energy: 0.9784727371403324
Energy: 0.9868852242338144
Energy: 0.9865729139357798
Energy: 0.9664920824619564
Energy: 0.948334223941746
Energy: 1.3708725872383478
Energy: 0.9734263305406446
Energy: 1.0291453704312312
Energy: 0.9876958089680143
Energy: 1.0324878608461254
Energy: 0.9974989639774355
Energy: 1.5277164207124962
Energy: 0.968198996310667
Energy: 0.978999357765862
Energy: 0.9499163484892097
Energy: 0.9636367342570332
Energy: 0.9434338800234059
Energy: 1.5134880757706544
Energy: 1.0228200931748417
Energy: 0.9391452028187508
Energy: 1.0232943100567837
Energy: 0.9676939184555007
Energy: 0.9932088170898067
Energy: 1.654323670792765
Energy: 0.974707312359848
Energy: 0.9617011596466066
Energy: 1.0053836419774373
Energy: 0.9713749906066399
Energy: 0.9846833218868264
Energy: 1.2686761328648832
Energy: 0.981829530491124
Energy: 0.9953682124692788
Energy: 0.9909026645339136
Energy: 1.005627984106275
Energy: 0.9951897467444657
Energy: 1.2561702551081768
Energy: 0.987853786552849
Energy: 0.9845923610318321
Energy: 1.02857344115888
Energy: 1.06633786297185
Energy: 1.0051065467453626
Energy: 1.4545352849550357
Energy: 0.9485445059036599
Energy: 1.0075922644526856
Energy: 1.000509121576833
Energy: 0.9625974164832247
Energy: 0.9967144103932484
Energy: 1.2897973079808887
Energy: 0.9862106560081404
Energy: 0.9801614415301138
Energy: 1.0509177918262176
Energy: 0.9633641432088763
Energy: 1.0278136397836901
Energy: 1.3680709240880635
Energy: 1.083750347342874
Energy: 0.9776324304611407
Energy: 0.9784936800938927
Energy: 0.9843726802068925
Energy: 0.9681416768520354
Energy: 1.154258040010518
Energy: 1.0435768514672874
Energy: 1.0582154011065692
Energy: 1.1546526794385825
Energy: 1.0281301446516566
Energy: 0.9793790364298885
Energy: 1.0414420404556322
Energy: 1.0929161398776484
Energy: 0.9712202634573809
Energy: 0.9994058212090328
Energy: 0.9611362315902579
Energy: 0.9740998953855647
Energy: 1.0586178183229307
Energy: 0.9950508042141023
Energy: 0.9999000312869749
Energy: 1.0197298915463937
Energy: 0.988342879897782
Energy: 0.9943171166946357
Energy: 1.2387096292546638
Energy: 0.9716920614633012
Energy: 0.9869869687318218
Energy: 1.0915185245743497
Energy: 0.979795472647718
Energy: 1.1461899900832218
Energy: 1.3402200705953604
Energy: 0.9681099710072434
Energy: 1.0188198677344549
Energy: 1.0064782853721312
Energy: 1.0004895470051025
Energy: 0.9663824499394625
Energy: 0.9925653158005191
Energy: 0.9772961217245263
Energy: 0.9766242309175358
Energy: 0.9911072045159312
Energy: 0.9796889046347111
Energy: 0.9642408316073579
Energy: 1.472686941025687
Energy: 0.9793963699873608
Energy: 0.9732511293467643
Energy: 0.9820286986659423
Energy: 1.0092075296711103
Energy: 0.9457618629076058
Energy: 1.5138542870950376
Energy: 0.9734181411022068
Energy: 0.9300253975814019
Energy: 0.9519293875220233
Energy: 0.9717817640498706
Energy: 0.937436847843495

minimum gb energy = 0.9300253975814019 eV
minimum distance =  2.25600291197338 Angstroms
sigma value = 27


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

Energy: 1.3332603412494557
Energy: 1.9794191721276657
Energy: 1.5642804588022543
Energy: 1.0108674818747656
Energy: 1.8019242896786292
Energy: 1.189736198309013
Energy: 1.3083850091739422
Energy: 0.850246832080529
Energy: 0.795699097750221
Energy: 0.8831404441560454
Energy: 0.868728606260117
Energy: 0.861890585480953
Energy: 1.7079161985997633
Energy: 0.8756012678826933
Energy: 0.8969950028181686
Energy: 0.885136142524541
Energy: 0.8299964980188197
Energy: 0.906483042121755
Energy: 1.6671048407975257
Energy: 0.8185582481796702
Energy: 0.8682430657138003
Energy: 0.9805031293387488
Energy: 0.9118277162166234
Energy: 0.8898588612927706
Energy: 1.3105546719391659
Energy: 0.7783561767123248
Energy: 0.8176452849225373
Energy: 0.927174777262276
Energy: 0.807638197332606
Energy: 0.8384497873828487
Energy: 1.0459170663447068
Energy: 0.8237952784472038
Energy: 0.807021837770461
Energy: 0.9945520566794749
Energy: 0.8819377069447947
Energy: 0.7964389381819026
Energy: 0.980865872893506
Energy: 0.8459279199490173
Energy: 0.8483406540174458
Energy: 0.9907605104822952
Energy: 0.8562686133743205
Energy: 0.8443889181470405
Energy: 1.1887967595670594
Energy: 0.9997455752883124
Energy: 0.8387578657937204
Energy: 1.133218681677548
Energy: 1.1191512912518762
Energy: 0.8218589724332899
Energy: 1.2257745844082493
Energy: 0.8699400252509439
Energy: 0.8586953622763815
Energy: 0.8773193471890209
Energy: 0.8343623672734845
Energy: 0.8739994213713242
Energy: 1.1349860751076284
Energy: 0.8085810206874464
Energy: 0.7931221782226152
Energy: 0.8708494287981873
Energy: 0.8335199744341854
Energy: 0.8006392432825725
Energy: 1.216904045467319
Energy: 0.8081696884389101
Energy: 0.815614194624774
Energy: 0.8101344768831763
Energy: 0.8597068261121629
Energy: 0.8398461047815027
Energy: 1.4863495938423372
Energy: 0.8288733978721674
Energy: 0.8771988797395364
Energy: 0.8307591651962863
Energy: 0.83681175530638
Energy: 0.8847861314814149

minimum gb energy = 0.7783561767123248 eV
minimum distance =  2.25734053817912 Angstroms
sigma value = 9


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

Energy: 2.235434002463842
Energy: 2.2169282648307767
Energy: 1.1845123475492496
Energy: 1.5465276659789806
Energy: 1.2268316848525953
Energy: 1.1025237574590108
Energy: 1.1863631114801467
Energy: 0.7315476296213573
Energy: 0.7371840283512728
Energy: 0.7173558242593173
Energy: 0.7471327963213814
Energy: 0.7349577045663394
Energy: 1.3101839073511496
Energy: 0.6501877843302444
Energy: 0.6870906786643708
Energy: 0.6989014392720272
Energy: 0.7432700101471952
Energy: 0.7084173812046155
Energy: 1.2911495887338582
Energy: 0.773770317896046
Energy: 0.7531933274056687
Energy: 0.880561240070025
Energy: 0.7674965044032575
Energy: 0.7552722784277918
Energy: 1.3276509085974475
Energy: 0.7046770084826199
Energy: 0.72473929686245
Energy: 0.743922533120411
Energy: 0.7346992042514202
Energy: 0.7428488698102604
Energy: 1.1528896812336162
Energy: 0.7417615279083136
Energy: 0.8300365248592625
Energy: 0.9764928549003927
Energy: 0.7480417226560432
Energy: 0.8116190637121299
Energy: 0.8985367706572723
Energy: 0.724237453755604
Energy: 0.703974122522991
Energy: 0.8981504854219965
Energy: 0.6806570245925919
Energy: 0.6831082064022564
Energy: 1.0619255249010953
Energy: 0.7874986244794369
Energy: 0.8126981615685008
Energy: 0.8052225262435393
Energy: 0.8196723401737869
Energy: 0.8418576457646281
Energy: 1.2763166547010363
Energy: 0.6876531468118742
Energy: 0.6940920561700931
Energy: 0.678599491506464
Energy: 0.7182437762650864
Energy: 0.6882973674321596
Energy: 1.4535182132387674
Energy: 0.7526327600883436
Energy: 0.8554614025478612
Energy: 0.7036908680337612
Energy: 0.8786879083416967
Energy: 0.8226760348313522
Energy: 1.470980694953092
Energy: 0.6737637739226078
Energy: 0.6757046304279191
Energy: 0.7552990822209233
Energy: 0.688948597195707
Energy: 0.7230699033273887
Energy: 1.2590400243227597
Energy: 0.7114868037699149
Energy: 0.701219607921499
Energy: 0.7389468277295425
Energy: 0.7070592808951857
Energy: 0.6852036174113045
Energy: 1.9238907120504074
Energy: 1.1185283860980786
Energy: 1.0299094794179329
Energy: 0.932719068713973
Energy: 1.0912867734244704
Energy: 0.8840212709714246
Energy: 1.213964141829566
Energy: 0.6835155049083298
Energy: 0.687880274542893
Energy: 0.6848327628790037
Energy: 0.7030207609054316
Energy: 0.6728096779055693
Energy: 0.9013546497301091
Energy: 0.6932875616934667
Energy: 0.6772089693262698
Energy: 0.8118607235369463
Energy: 0.7642128975358479
Energy: 0.8275617745242918
Energy: 0.8732491908603143
Energy: 0.6623166680823357
Energy: 0.685312858887249
Energy: 0.8082941138365634
Energy: 0.6853964592427253
Energy: 0.6905672413977326
Energy: 1.0923730487913508
Energy: 0.7037399258675779
Energy: 0.7204937842758127
Energy: 0.8253823176166981
Energy: 0.7147267012289144
Energy: 0.7273446143295758
Energy: 1.331338951600702
Energy: 0.7575765403302305
Energy: 0.7548368810934393
Energy: 1.0299975025607135
Energy: 0.762834766899421
Energy: 0.7804161449244575
Energy: 0.9841925479613547
Energy: 0.6915248650738424
Energy: 0.6818070211745272
Energy: 0.741653842313175
Energy: 0.715756461781975
Energy: 0.6838170972858751
Energy: 0.9573883565995623
Energy: 0.7165473124504935
Energy: 0.718540572345099
Energy: 0.7959326072785187
Energy: 0.7143557343548715
Energy: 0.7282874411481883
Energy: 1.1650330335919301
Energy: 0.6835102523588108
Energy: 0.6977008153236658
Energy: 0.7062596977133991
Energy: 0.7879292786190392
Energy: 0.6981729464598351
Energy: 1.7443745752407342
Energy: 0.7762400402089789
Energy: 0.7789817295969931
Energy: 0.7474860413448279
Energy: 0.9383522716038776
Energy: 0.8351327858622953
Energy: 1.3185275658426021
Energy: 0.7762416456082141
Energy: 0.7587589067015958
Energy: 0.6890088461335794
Energy: 0.7826282510789287
Energy: 0.7527342418918638
Energy: 1.1610362891776846
Energy: 0.6791846131477175
Energy: 0.6766051430637828
Energy: 0.7137236768469893
Energy: 0.7383855535486992
Energy: 0.661247266197422
Energy: 1.3813958831908053
Energy: 0.7929048051791812
Energy: 0.8768031833288619
Energy: 0.8045011457261333
Energy: 0.7934372220975984
Energy: 0.8678977669087962
Energy: 1.1619672014928177
Energy: 0.7050727114880804
Energy: 0.6950995435961854
Energy: 0.7325935732459337
Energy: 0.664522959797965
Energy: 0.6956288494807806
Energy: 1.1928203703238758
Energy: 0.9384510742606162
Energy: 1.0533605732167093
Energy: 1.0347192964133332
Energy: 0.7985075773939261
Energy: 1.0161908725981712
Energy: 0.915793513062096
Energy: 0.7229755429542769
Energy: 0.7123835404213975
Energy: 0.7454976472706181
Energy: 0.6900945590667401
Energy: 0.711942303953647
Energy: 0.935516579260546
Energy: 0.6812807364346752
Energy: 0.7022569547011084
Energy: 0.8107629323131008
Energy: 0.6951929018895848
Energy: 0.6911654025516746
Energy: 1.1649822230415674
Energy: 0.7032797930758918
Energy: 0.72702920819467
Energy: 0.986009791314414
Energy: 0.7210476857253243
Energy: 0.8151481973106058
Energy: 1.470022196276977
Energy: 0.6640442040854889
Energy: 0.7013179491570387
Energy: 0.7499605184341753
Energy: 0.7201142759339473
Energy: 0.6893471764978439
Energy: 1.4720475630364682
Energy: 0.8719070085236782
Energy: 0.7511413431224173
Energy: 0.7201309688748664
Energy: 0.8528497249863672
Energy: 0.841938535180333
Energy: 1.1830809958958999
Energy: 0.7127857852576264
Energy: 0.6769355208772861
Energy: 0.740360383354892
Energy: 0.7397484033014708
Energy: 0.7015952347367903
Energy: 1.5989189280554443
Energy: 0.8483481078482089
Energy: 0.7663888334893318
Energy: 0.7375053666230001
Energy: 0.939081631556568
Energy: 0.8383880309430052
Energy: 1.4029475407139387
Energy: 0.7498111036398523
Energy: 0.7107375462958492
Energy: 0.6979940364866778
Energy: 0.7225549169406218
Energy: 0.6957180248363407
Energy: 1.108014644121557
Energy: 0.6784855380737623
Energy: 0.6799610257677696
Energy: 0.7757775098276749
Energy: 0.7819471627928405
Energy: 0.7514602351859755
Energy: 0.8740385171008799
Energy: 0.6725138165032853
Energy: 0.7039063936296643
Energy: 0.8408867758721187
Energy: 0.6728915728045417
Energy: 0.6530431563914825
Energy: 0.9188532343747554
Energy: 0.7140985607659042
Energy: 0.7166445774634977
Energy: 0.7929237331521869
Energy: 0.7278963701702587
Energy: 0.7105183244042828
Energy: 1.2803891553593385
Energy: 0.8356990849222928
Energy: 1.005945730662819
Energy: 1.163683637262117
Energy: 0.8356854139510146
Energy: 1.6238118754426722
Energy: 1.051196724409291
Energy: 0.7237482142510284
Energy: 0.6882795665748614
Energy: 0.7654859968601267
Energy: 0.7216686965514628
Energy: 0.715778241470554
Energy: 0.9941960875495286
Energy: 0.6999063483355072
Energy: 0.6863721173535816
Energy: 0.8446369373898642
Energy: 0.6748561163999931
Energy: 0.7111677012994647
Energy: 1.107557713779848
Energy: 0.692634233826015
Energy: 0.7150243411809455
Energy: 0.7092242053453833
Energy: 0.6888082076906598
Energy: 0.669033284040685
Energy: 1.3208089715279625
Energy: 0.7799660794409098
Energy: 0.7953637425629121
Energy: 0.6954344526422649
Energy: 0.8215043289555587
Energy: 0.7291582956759338

minimum gb energy = 0.6501877843302444 eV
minimum distance =  2.26503343631884 Angstroms
sigma value = 57


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

Energy: 0.8509352053516017
Energy: 1.3860983710938317
Energy: 0.6203589880013798
Energy: 0.611295346364251
Energy: 1.3852100191519559
Energy: 0.6211489315591895
Energy: 0.8888469575192356
Energy: 0.6359557855015155
Energy: 0.6684937201287127
Energy: 0.6057620914899697
Energy: 0.620481289954003
Energy: 0.6754332582562388
Energy: 1.0836118246535276
Energy: 0.658125448288669
Energy: 0.6822500622356243
Energy: 0.7092701522280492
Energy: 0.7017773474244451
Energy: 0.7215397497123218
Energy: 1.0947788762260535
Energy: 0.6875954664808915
Energy: 0.6865956310910366
Energy: 0.7127696426794193
Energy: 0.6855908374126147
Energy: 0.6895632282006038
Energy: 0.8977796600624445
Energy: 0.34187674426866654
Energy: 0.34412843890778533
Energy: 0.670661060442588
Energy: 0.354392964873118
Energy: 0.6219732728908889
Energy: 0.9224173567703501
Energy: 0.3586349530264339
Energy: 0.35469954982805896
Energy: 0.6625940957224143
Energy: 0.34438330710661424
Energy: 0.35456607116321115
Energy: 0.9330215656886885
Energy: 0.7144447571137184
Energy: 0.666356733020902
Energy: 0.69700930348639
Energy: 0.6280210105943205
Energy: 0.650141781050489
Energy: 1.6314538502736662
Energy: 0.8513729588233592
Energy: 0.8388980038546696
Energy: 1.4239172245717708
Energy: 0.8969409621498543
Energy: 0.8567264192568749
Energy: 1.1703817894315014
Energy: 0.7470175043871101
Energy: 0.7689410411983933
Energy: 0.7789928806300066
Energy: 0.8233739348868772
Energy: 0.7442729735863911
Energy: 0.5521352080610863
Energy: 0.7643451499782805
Energy: 0.35757392875970967
Energy: 0.3548122813511577
Energy: 0.7608188129123914
Energy: 0.3560462216029221
Energy: 0.5522187794898176
Energy: 0.7610697546457207
Energy: 0.7520532682798943
Energy: 0.326198727459782
Energy: 0.7769503430493251
Energy: 0.3572251495363377
Energy: 1.2140801136402513
Energy: 0.7813212633914647
Energy: 0.7754891165565326
Energy: 0.8186333927632194
Energy: 0.7887025910338801
Energy: 0.775397515410666
Energy: 1.3904092091913751
Energy: 0.8705733453882604
Energy: 1.370278726726088
Energy: 0.8657597509694148
Energy: 1.38268624397617
Energy: 1.4020235337337736
Energy: 0.9420061611118736
Energy: 0.6195474211621442
Energy: 0.62244488668648
Energy: 0.6222310931549496
Energy: 0.6419212464408358
Energy: 0.6569805126557008
Energy: 0.943311553962138
Energy: 0.33652871178205457
Energy: 0.3544657564770783
Energy: 0.6613105416494098
Energy: 0.3357049933104312
Energy: 0.35644106366422995
Energy: 0.8840469884983828
Energy: 0.6252850717552401
Energy: 0.6342699951387767
Energy: 0.6288749102595089
Energy: 0.3582367290609053
Energy: 0.6470692149064003
Energy: 1.0352770001172478
Energy: 0.682896287667418
Energy: 0.7061394073370603
Energy: 0.749877654002481
Energy: 0.7315231036537068
Energy: 0.6738606900598566
Energy: 1.1546277635904398
Energy: 0.663528231860613
Energy: 0.7107975617722845
Energy: 0.7385424176230301
Energy: 0.6622051165194774
Energy: 0.710367489685388
Energy: 0.8522162013736105
Energy: 0.6456288541867314
Energy: 0.5680922650508722
Energy: 0.5882511422964156
Energy: 0.6150619764962788
Energy: 0.6572813276584996

minimum gb energy = 0.326198727459782 eV
minimum distance =  2.25157980100507 Angstroms
sigma value = 11


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

Energy: 1.7129807844093605
Energy: 1.0246430144976086
Energy: 1.59882289279797
Energy: 1.4823287332198665
Energy: 2.0569865609926854
Energy: 1.581264796519887
Energy: 0.9761197257591584
Energy: 0.6008516128217887
Energy: 0.5845688705367279
Energy: 0.5078474447441025
Energy: 0.7154877110714447
Energy: 0.5495167205975046
Energy: 0.8033219935736622
Energy: 0.579625993459486
Energy: 0.5283188528897017
Energy: 0.6490216967446726
Energy: 0.635069952243056
Energy: 0.5429533540911337
Energy: 0.7751915183359426
Energy: 0.5110632654377337
Energy: 0.5060000788522445
Energy: 0.6200884096449109
Energy: 0.5615193442956661
Energy: 0.5014323250071698
Energy: 0.8957092176221492
Energy: 0.7712867296122332
Energy: 0.7850186082741499
Energy: 0.6189727152115976
Energy: 0.840390300904475
Energy: 0.6486158248182682
Energy: 1.2041257762209938
Energy: 0.8218343782973199
Energy: 0.8248097191878796
Energy: 1.1799164879445845
Energy: 0.8846089163428063
Energy: 0.7780866495358996
Energy: 0.9770885510951144
Energy: 0.6373559483843243
Energy: 0.6241753610887744
Energy: 0.6761459738655058
Energy: 0.6454352400701979
Energy: 0.6329728115302908
Energy: 0.8145323336654816
Energy: 0.7024796961620627
Energy: 0.7210755216214205
Energy: 0.6669133659823089
Energy: 0.7305690528166836
Energy: 0.7311551283716067
Energy: 0.976951974423347
Energy: 0.672357488937681
Energy: 0.6789952202014231
Energy: 0.6292573317716607
Energy: 0.7273572125232153
Energy: 0.6213449839874253
Energy: 1.407604956032269
Energy: 0.7563627332197806
Energy: 0.7560911359987846
Energy: 0.9651404724744178
Energy: 1.025328629314029
Energy: 0.8140774756921779
Energy: 1.4411310420054517
Energy: 0.7517729974131779
Energy: 0.7427743760231654
Energy: 0.7904673198407074
Energy: 0.7660857214672051
Energy: 0.7818619460840981
Energy: 1.118638531883114
Energy: 0.773849028050703
Energy: 0.7693905684596131
Energy: 0.7972379645133074
Energy: 0.7460902498063338
Energy: 0.7694438840107023
Energy: 1.042528676183091
Energy: 0.7633359396824907
Energy: 0.7518936377358043
Energy: 0.907982475717212
Energy: 0.745324551514335
Energy: 0.7870175241678317
Energy: 1.0242102552038148
Energy: 0.7821198412157814
Energy: 0.7681587255779027
Energy: 0.8535610009910176
Energy: 0.7883474629760242
Energy: 0.7779640156753056
Energy: 1.2302731027644074
Energy: 1.1761353409220334
Energy: 1.1513227771188461
Energy: 1.1539677727864204
Energy: 1.0919922450999873
Energy: 1.193888632230297
Energy: 1.33334948944758
Energy: 0.7753721743398722
Energy: 0.7701257974558355
Energy: 0.8080896348451353
Energy: 0.7939483616534079
Energy: 0.7902335010028168
Energy: 1.2743312011970778
Energy: 0.9621165859767441
Energy: 0.9554367292576768
Energy: 1.058248983609544
Energy: 1.1697913781101084
Energy: 0.9544134141547868
Energy: 1.3613885684705596
Energy: 0.7778077395409927
Energy: 0.7832386398797967
Energy: 0.8094885990326697
Energy: 0.8400690725551657
Energy: 0.8008151323292263
Energy: 1.2841395524776504
Energy: 0.7843340670897799
Energy: 0.7796772674472174
Energy: 0.8072299540510477
Energy: 0.7876408671646019
Energy: 0.7712934676232643
Energy: 1.0291701263069197
Energy: 0.9694866943447099
Energy: 0.8405587314451455
Energy: 0.8746652285999562
Energy: 0.9399280226337233
Energy: 0.8222010328714061
Energy: 1.3309663484757734
Energy: 0.8146507059183387
Energy: 0.7598765194630378
Energy: 0.7514636910104499
Energy: 0.8108469395725421
Energy: 0.7525049816198734
Energy: 1.4141016265210078
Energy: 1.3620351282431453
Energy: 1.3252814475724932
Energy: 1.4024428184917304
Energy: 1.4120490969062454
Energy: 1.280087102982032
Energy: 1.0081944914522996
Energy: 0.6757163413127502
Energy: 0.646917962365354
Energy: 0.8306087683243338
Energy: 0.6418997519578037
Energy: 0.6602901062905688
Energy: 0.8791121926316686
Energy: 0.6593780749860709
Energy: 0.6956018049758387
Energy: 0.768480617149945
Energy: 0.6434364875222484
Energy: 0.6373874023688699
Energy: 0.894122847866222
Energy: 0.667633133480342
Energy: 0.6630454790174319
Energy: 0.6689079150603796
Energy: 0.6131577034561562
Energy: 0.6858508399412573
Energy: 1.4780809096588245
Energy: 0.6216599831459254
Energy: 0.6156157671050774
Energy: 0.8027446105407118
Energy: 0.6139584623880079
Energy: 0.7778204391410014

minimum gb energy = 0.5014323250071698 eV
minimum distance =  2.25250830210972 Angstroms
sigma value = 41


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

Energy: 1.6504326753057519
Energy: 1.370532082634132
Energy: 1.4489958917540238
Energy: 1.160235569109994
Energy: 1.9352513027430849
Energy: 1.1542317271364886
Energy: 1.1491558005061702
Energy: 0.6736822154579624
Energy: 0.7207618203626133
Energy: 0.8040817912881054
Energy: 0.760895262758373
Energy: 0.7452416458794366
Energy: 0.8229083168525254
Energy: 0.6186392288418316
Energy: 0.5885933753466209
Energy: 0.5495704542011454
Energy: 0.6580347758999748
Energy: 0.5779530862267209
Energy: 0.8259184690400215
Energy: 0.546193973505212
Energy: 0.5555756466173493
Energy: 0.5657566605838045
Energy: 0.5678597769462052
Energy: 0.5737910744862263
Energy: 0.9468600010608219
Energy: 0.9445668256204073
Energy: 0.9538412195940602
Energy: 0.6541394167176602
Energy: 0.6961001658967643
Energy: 0.7129954807171444
Energy: 1.3176145553367251
Energy: 1.006383647527845
Energy: 1.0172710227481896
Energy: 1.169747962321961
Energy: 0.9848106486085261
Energy: 1.005762900808825
Energy: 1.145681625624083
Energy: 0.7248511881632401
Energy: 0.7000613974554106
Energy: 0.6804010446433693
Energy: 0.7282008775267217
Energy: 0.7192872257282279
Energy: 0.9599818982803033
Energy: 0.8047273998727071
Energy: 0.8425596270392948
Energy: 0.5737832390363734
Energy: 0.8576840604959322
Energy: 0.601535112104234
Energy: 1.1434036640946545
Energy: 0.7614519384275866
Energy: 0.7818800067074239
Energy: 0.8902838120000641
Energy: 0.8331422386387602
Energy: 0.7653886946862661
Energy: 1.2383918845851576
Energy: 1.0341643927592157
Energy: 1.0406277603017218
Energy: 0.8170331481393103
Energy: 0.9381501574742556
Energy: 0.9922985715346452
Energy: 1.181853842743156
Energy: 0.8723202091218702
Energy: 0.9194734354128495
Energy: 0.5309035641024814
Energy: 0.9200087170927529
Energy: 0.9076213074917766
Energy: 1.3769683459985822
Energy: 0.9354883921548625
Energy: 0.9234790040009322
Energy: 0.9898450680220862
Energy: 0.9293012824967832
Energy: 0.9784211167608838
Energy: 1.2516223045137407
Energy: 0.9389473849489834
Energy: 0.9617821535998949
Energy: 1.1715567128382378
Energy: 0.9443421144584466
Energy: 0.9567175103216594
Energy: 1.0299663720127854
Energy: 0.7336723965997409
Energy: 0.6926320422021552
Energy: 0.8654034965138435
Energy: 0.7358052017857643
Energy: 0.7445623079084548
Energy: 1.0231544279784466
Energy: 0.8702368767512348
Energy: 0.8862631279392765
Energy: 0.9471217591518882
Energy: 1.0197488088197768
Energy: 0.8819598439537814
Energy: 1.0084656259721154
Energy: 0.7381460955712256
Energy: 0.7186627308860857
Energy: 0.7053207930269247
Energy: 0.7348244128061427
Energy: 0.7600779573017994
Energy: 1.5810471016503325
Energy: 0.7763765447158706
Energy: 0.8842181813895347
Energy: 1.1340797892725167
Energy: 1.1814121985250774
Energy: 1.203798224929804
Energy: 1.440464384105602
Energy: 0.7233639908821441
Energy: 0.7153010280017538
Energy: 1.010622041405149
Energy: 0.7704436277877585
Energy: 0.8881055554408462
Energy: 0.8205246203318157
Energy: 0.4858499625022527
Energy: 0.5661045280245164
Energy: 0.5582006542009774
Energy: 0.5725610400272737
Energy: 0.6058839597918365
Energy: 0.823676206199452
Energy: 0.5938117660218484
Energy: 0.5855518251342208
Energy: 0.6185355225447338
Energy: 0.5692689557744479
Energy: 0.6069047253856937
Energy: 0.9532142522583434
Energy: 0.5093538995170086
Energy: 0.5229887049736027
Energy: 0.7861892332322387
Energy: 0.5127433093012311
Energy: 0.7215356004303646
Energy: 1.2919215864526228
Energy: 1.5157597822623197
Energy: 1.5241826319753484
Energy: 1.3182373557748395
Energy: 1.5633484355112097
Energy: 1.4684208451003982
Energy: 1.1304786223082557
Energy: 0.7044621371396387
Energy: 0.7109863531831013
Energy: 0.6290034225600877
Energy: 0.7233234016793706
Energy: 0.7176817037318209
Energy: 0.9121525834790479
Energy: 0.8133821862022773
Energy: 0.8248712446166353
Energy: 0.6107780183435964
Energy: 0.8743935639247604
Energy: 0.59434833312854
Energy: 1.147477606334104
Energy: 0.7323930476568248
Energy: 0.7444198151492586
Energy: 0.7469649052904247
Energy: 0.8405506970360128
Energy: 0.7383641572678914
Energy: 1.1845163805357815
Energy: 0.9142929794098913
Energy: 0.8974871651314564
Energy: 0.48786202100907106
Energy: 0.9674821460717281
Energy: 0.8971169779967476
Energy: 1.1861661938904502
Energy: 0.9377617687281241
Energy: 0.989485251293442
Energy: 0.949125716443215
Energy: 1.1168044101671697
Energy: 0.9084177327739164
Energy: 1.3770231740189
Energy: 0.8701396462690512
Energy: 0.9487061768830887
Energy: 0.9043664225839795
Energy: 0.8119107525415343
Energy: 0.9492012747564658
Energy: 1.2609650005501791
Energy: 1.1797692950844583
Energy: 1.1548302556108097
Energy: 1.2049629534599149
Energy: 1.2226775503290062
Energy: 0.9948019693599106
Energy: 1.1181149259204708
Energy: 0.6732167978457118
Energy: 0.6363202428016801
Energy: 1.0121572404593093
Energy: 0.7101181573615815
Energy: 0.6831576914354126
Energy: 0.9498457984930784
Energy: 0.8872655446781436
Energy: 0.7700976919948372
Energy: 0.8699538069306653
Energy: 0.8076970496011495
Energy: 0.8270677643657953
Energy: 1.0259765828465988
Energy: 0.7536197125102835
Energy: 0.7306193882994831
Energy: 0.7802818012831907
Energy: 0.7380789137424183
Energy: 0.7820021611104506
Energy: 1.5770640328873309
Energy: 0.6748907530020007
Energy: 0.8873566404923754
Energy: 0.7751983706469011
Energy: 0.7106689539514847
Energy: 0.836129728593019

minimum gb energy = 0.4858499625022527 eV
minimum distance =  2.24707412007565 Angstroms
sigma value = 33


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

Energy: 1.2459443061757336
Energy: 1.685126801140001
Energy: 1.4770813938393932
Energy: 0.5714008843261789
Energy: 1.6707691258093007
Energy: 1.6220958993669983
Energy: 1.4833461710674702
Energy: 0.8309601946960422
Energy: 0.9752464652499813
Energy: 1.0036374160400403
Energy: 1.0212180403294022
Energy: 0.7192577936050578
Energy: 1.0004655859662053
Energy: 0.8086927198008818
Energy: 0.6398828203009463
Energy: 0.8400592301958327
Energy: 0.8952731637169185
Energy: 0.796109548265968
Energy: 1.0277557115500793
Energy: 0.6251909293740275
Energy: 0.8382220804027568
Energy: 0.8891977496907981
Energy: 0.6108820320836764
Energy: 0.6139260851389555
Energy: 1.1286599416119985
Energy: 1.0188119333560814
Energy: 0.9041819931567787
Energy: 0.8386925981628857
Energy: 0.9127921203889028
Energy: 0.7134779354398019
Energy: 1.4166122232821403
Energy: 1.11715693908629
Energy: 1.1286538129743227
Energy: 0.6965745162419126
Energy: 1.0145963063935952
Energy: 1.1809045422090865
Energy: 1.2244189447533662
Energy: 0.7375589077611368
Energy: 0.7160819164646518
Energy: 0.8139834255038837
Energy: 0.7728051595542206
Energy: 0.7862516324042413
Energy: 1.133858387558311
Energy: 1.07348780505584
Energy: 0.7815579648814432
Energy: 0.7982524575383493
Energy: 1.1019862079244154
Energy: 0.7744407618366871
Energy: 1.2038472672129716
Energy: 0.9189510665965045
Energy: 0.8739286365421091
Energy: 0.8759157706145686
Energy: 0.9710116972986068
Energy: 0.8411476119783429
Energy: 1.6361054290156705
Energy: 1.067369823350309
Energy: 1.1525648656662606
Energy: 1.1475128427531036
Energy: 1.1345364418913775
Energy: 1.1224466400938087
Energy: 1.5242435544156818
Energy: 1.0918308600712308
Energy: 1.1093609563192262
Energy: 1.1035117060637825
Energy: 1.101671439827539
Energy: 1.0638117452400468
Energy: 1.5726654890883671
Energy: 1.1139234878541444
Energy: 1.1172053685757046
Energy: 1.1830908890971898
Energy: 1.152670641249166
Energy: 1.1103829662690479
Energy: 1.4316221248598764
Energy: 1.1259151678975419
Energy: 1.1113750283692319
Energy: 1.2556289849131619
Energy: 1.1395902084127705
Energy: 1.1603962371727066
Energy: 1.0560462511746045
Energy: 0.8534551022808536
Energy: 0.8129290112288675
Energy: 0.870897662667946
Energy: 0.8387482613910928
Energy: 0.8700068794331351
Energy: 0.9416870556438615
Energy: 0.8764583615327716
Energy: 0.8807019631312414
Energy: 0.9434124281800113
Energy: 0.9207883223396957
Energy: 0.8753076199146066
Energy: 1.1488153303116824
Energy: 0.8611471289081136
Energy: 0.800774045516867
Energy: 0.8656962431411741
Energy: 0.8739288012071045
Energy: 0.8369540564193093
Energy: 1.563669282898956
Energy: 0.9642341109005945
Energy: 1.1869371240480797
Energy: 1.2449449119587854
Energy: 0.9379191239449702
Energy: 1.1817311451530879
Energy: 1.502985160940752
Energy: 0.7174607543237668
Energy: 0.7573331937423644
Energy: 0.9351552059197359
Energy: 0.7141851115367744
Energy: 0.7027171090790089
Energy: 1.2533127206125567
Energy: 0.7622049513416548
Energy: 0.7500735849064953
Energy: 0.9362624545860738
Energy: 0.7843803893587609
Energy: 0.7577700398261796
Energy: 1.1522440304277866
Energy: 0.7890803865456021
Energy: 0.7807146681345809
Energy: 0.8438941065811174
Energy: 0.7404763060545841
Energy: 0.9698561161790109
Energy: 1.2750796204063333
Energy: 0.9712239830461672
Energy: 0.8028516689721117
Energy: 0.9104279277915355
Energy: 0.8449508926325049
Energy: 1.0410872993460116
Energy: 1.3959235336417104
Energy: 1.2527043619067384
Energy: 1.2304240476488522
Energy: 1.2274185118343384
Energy: 1.2630393097499961
Energy: 1.2560635277252996
Energy: 1.2838763528454071
Energy: 0.9153979402263709
Energy: 0.8397381818312735
Energy: 1.0273024866282825
Energy: 0.8173737178255097
Energy: 1.02365762888923
Energy: 1.1365970253043043
Energy: 1.1623909180883476
Energy: 1.336935541561886
Energy: 1.3465540203750972
Energy: 1.1482879886952282
Energy: 1.4741796328467562
Energy: 1.6770189517050298
Energy: 0.9250482371578769
Energy: 0.8375570437599926
Energy: 1.083277308219071
Energy: 1.0264948298611996
Energy: 0.587697309162314
Energy: 0.8689908246057585
Energy: 0.6274388963019315
Energy: 0.8112613872897932
Energy: 0.81369543372201
Energy: 0.8780124711777142
Energy: 0.6324774698707594
Energy: 1.057344877366001
Energy: 0.8292203069727027
Energy: 0.6233977633149304
Energy: 0.8483245584136989
Energy: 0.6465876689780108
Energy: 0.8755038206237382
Energy: 1.121105262756803
Energy: 0.9249380586114319
Energy: 0.7244489211840213
Energy: 0.7385659893184833
Energy: 0.7080346504104971
Energy: 0.9021248478730074
Energy: 1.4927706518080672
Energy: 1.2333535589596603
Energy: 1.1817190062928167
Energy: 1.432222893728439
Energy: 1.2472214666435426
Energy: 1.176431103046995
Energy: 1.2341147393397578
Energy: 0.7527168403620567
Energy: 0.7133801867492151
Energy: 0.9153106803114639
Energy: 0.7578423179864274
Energy: 0.7134720555252448
Energy: 1.1622737645431762
Energy: 1.0987780290665972
Energy: 0.7657818856951012
Energy: 0.794327375957378
Energy: 1.1168917994288385
Energy: 0.7658349708803465
Energy: 1.200628057656773
Energy: 0.9541322277264905
Energy: 0.9391587085292527
Energy: 0.8476189003806789
Energy: 0.9208115152478412
Energy: 0.8613534112416352
Energy: 1.6260837394830872
Energy: 1.0720212706759644
Energy: 1.0565982936044727
Energy: 1.0827297799881386
Energy: 1.1659445270698177
Energy: 1.0921754885355153
Energy: 1.5309347185102475
Energy: 1.01380177091484
Energy: 1.0761674798623362
Energy: 1.2014915315750867
Energy: 1.1110440025426562
Energy: 1.0749819303883248
Energy: 1.5759061506964787
Energy: 0.9792498540536293
Energy: 1.011587190401947
Energy: 0.7461396395062249
Energy: 1.1110261823825525
Energy: 1.1698917154868382
Energy: 1.4355053067256487
Energy: 1.1275538056376548
Energy: 1.074121320275106
Energy: 1.2250264233713684
Energy: 1.0808514363015118
Energy: 1.0665757612399223
Energy: 1.0791526769440467
Energy: 0.8212170924577673
Energy: 0.8179702661232788
Energy: 0.936690484209648
Energy: 0.810882340860871
Energy: 0.8283063869355229
Energy: 0.9376554580190006
Energy: 0.9026556733294139
Energy: 0.900828440117631
Energy: 0.8665878591871325
Energy: 0.8744965804174446
Energy: 0.8928143167934821
Energy: 1.142221916520206
Energy: 0.8568170548122689
Energy: 0.8059635016989793
Energy: 0.8735379601854303
Energy: 0.9127182864065438
Energy: 0.8104344666283629
Energy: 1.554434423262337
Energy: 0.9352024788517398
Energy: 0.8875687419413727
Energy: 1.0397383605847232
Energy: 0.8768768952758356
Energy: 1.2292577404110312
Energy: 1.5255094861563399
Energy: 0.7112003779538966
Energy: 0.7139170430722699
Energy: 0.9326032611172
Energy: 0.7399988886019369
Energy: 0.7737612897074618
Energy: 1.1656073971088499
Energy: 0.7648068754966909
Energy: 0.784788054674847
Energy: 0.928315705596289
Energy: 0.7657210585305495
Energy: 0.9091463518337547
Energy: 1.1420108850178057
Energy: 0.7687023967679633
Energy: 0.7738732022263045
Energy: 0.8317017339911608
Energy: 0.7608419208169724
Energy: 0.7648895424785871
Energy: 1.2325352667930052
Energy: 0.8389212726393637
Energy: 0.8981742258523544
Energy: 1.1959037382304665
Energy: 1.0421778549032665
Energy: 0.7591199882555633
Energy: 1.3574970913715578
Energy: 1.2657045956103938
Energy: 1.2291116681992633
Energy: 1.255191205778985
Energy: 1.2815627546165649
Energy: 1.2262625021188913
Energy: 1.4097898470648091
Energy: 0.8522006125608079
Energy: 1.0267984140299715
Energy: 0.836305522896876
Energy: 0.8124190631964647
Energy: 1.0827239924347527
Energy: 1.6162025443053945
Energy: 1.0387555536278663
Energy: 1.124349234517268
Energy: 1.1638488771958098
Energy: 0.9915732855018936
Energy: 1.1495559436365723

minimum gb energy = 0.5714008843261789 eV
minimum distance =  2.22235826910569 Angstroms
sigma value = 67


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

Energy: 1.2793334709340314
Energy: 1.0817684957954374
Energy: 0.6761822961026311
Energy: 0.7173017380746
Energy: 1.0911769719660533
Energy: 0.7812371385088214
Energy: 1.031214955991077
Energy: 0.6590793295963735
Energy: 0.6029627587662485
Energy: 0.6875550405817761
Energy: 0.7149700579097145
Energy: 0.719473144487285
Energy: 0.9315042430977772
Energy: 0.6769254286532633
Energy: 0.6892498708785342
Energy: 0.746301497499858
Energy: 0.6698346065629754
Energy: 0.6941336619382635
Energy: 1.0925688147395343
Energy: 0.7319586100154868
Energy: 0.6945731135284424
Energy: 0.7667306828115015
Energy: 0.6938261329608514
Energy: 0.682577994665478
Energy: 0.876002959031032
Energy: 0.6340953035994266
Energy: 0.6583101407051503
Energy: 0.6800066908135473
Energy: 0.6578997909906518
Energy: 0.6232948701417537
Energy: 0.8358655429814735
Energy: 0.7173803817033785
Energy: 0.6339715994057966
Energy: 0.6396690142246055
Energy: 0.7247590155573652
Energy: 0.6539872654508123
Energy: 0.9207099925218674
Energy: 0.6022642512552546
Energy: 0.6555569933372181
Energy: 0.667275859821673
Energy: 0.6027270671924958
Energy: 0.6927898726280356

minimum gb energy = 0.6022642512552546 eV
minimum distance =  2.26737634171188 Angstroms
sigma value = 3


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

Energy: 1.531969628054396
Energy: 1.5303193874495913
Energy: 1.1608096652583946
Energy: 0.7759305244049635
Energy: 1.5377205062357873
Energy: 1.2213512530341577
Energy: 0.9389537586371826
Energy: 0.7440159421160674
Energy: 0.7311947840281429
Energy: 0.6651911647891627
Energy: 0.7478284806009845
Energy: 0.7335995258260956
Energy: 0.9674702204110214
Energy: 0.793691856259102
Energy: 0.7747680364056734
Energy: 0.7736085175652347
Energy: 0.8605417400700548
Energy: 0.824398695896047
Energy: 0.9337848015109448
Energy: 0.9026517041760498
Energy: 0.9020330830504448
Energy: 0.8420617610401995
Energy: 0.9150317480845335
Energy: 0.7030043567007563
Energy: 0.9791939179190957
Energy: 0.8635032525151838
Energy: 0.8742398050502205
Energy: 0.8515316230601747
Energy: 0.8401795774276352
Energy: 0.8071639352817327
Energy: 1.0097222242566768
Energy: 0.8291182012031645
Energy: 0.8341828251409166
Energy: 0.8653253216467353
Energy: 0.8804604298916916
Energy: 0.8224909980978616
Energy: 0.9970408676509023
Energy: 0.8669384497582981
Energy: 0.8287299494740255
Energy: 0.7813783596327127
Energy: 0.8436010793411359
Energy: 0.7787191178538986
Energy: 1.1344847948403978
Energy: 1.3106278625669026
Energy: 0.9836611784439907
Energy: 0.8543492741585563
Energy: 1.4258310997681096
Energy: 0.8965338264857516
Energy: 1.3110809992589836
Energy: 1.0122059786011615
Energy: 1.0161916926339465
Energy: 0.9792502732375552
Energy: 1.0084323686674699
Energy: 1.0288058663997244
Energy: 1.3123212749288127
Energy: 0.8348692803401688
Energy: 0.8209505533200249
Energy: 1.1440025098898488
Energy: 0.8870684366159242
Energy: 0.8830820766695686
Energy: 1.1397745875784573
Energy: 0.8310272905069552
Energy: 0.9559414971165214
Energy: 1.001482379639268
Energy: 0.8496257059918167
Energy: 0.9423811097772259
Energy: 1.0779045295658822
Energy: 0.8103583407617064
Energy: 0.8228856373865711
Energy: 0.8249003443263787
Energy: 0.8622609421487756
Energy: 0.8033323433867531
Energy: 1.052499546438208
Energy: 0.8215444350147298
Energy: 0.8198129721096686
Energy: 0.8148744683310618
Energy: 0.8481006836942947
Energy: 0.830193267561116
Energy: 1.2568793632197608
Energy: 0.8170323477606026
Energy: 0.7919060338893089
Energy: 1.0057803695687142
Energy: 0.860103369728901
Energy: 0.8100212880225178
Energy: 1.0938664913973248
Energy: 0.8127720072773793
Energy: 0.8116291373446121
Energy: 0.8315395952440211
Energy: 0.850573478121972
Energy: 0.8255185778585341
Energy: 1.12141143422451
Energy: 0.807777437543126
Energy: 0.829995786977876
Energy: 0.8917810140633186
Energy: 0.8049366155421654
Energy: 0.8198334487355726
Energy: 1.0614760772878826
Energy: 1.0481918684455709
Energy: 1.0786976845739626
Energy: 0.8847679601356091
Energy: 1.056945436614014
Energy: 0.9743396327788041
Energy: 1.191561586675624
Energy: 0.8820600774120632
Energy: 0.8907701863076357
Energy: 0.9704958296182253
Energy: 0.8448487843628742
Energy: 0.8835819011453719
Energy: 1.1631619580302448
Energy: 0.8736096200582846
Energy: 0.8413009760190904
Energy: 0.8817836498897699
Energy: 0.7937619911475572
Energy: 0.7619465768455572
Energy: 1.093317573599611
Energy: 0.893711801620458
Energy: 0.8360596001223229
Energy: 0.9624679604895862
Energy: 0.8467553915682396
Energy: 0.7706184924949214
Energy: 1.0354549418407268
Energy: 0.8162015894780816
Energy: 0.8222126217426196
Energy: 0.8506095636840146
Energy: 0.7898661965865612
Energy: 0.8108519490904869
Energy: 1.0509136919906896
Energy: 0.8394761273030332
Energy: 0.8373157048311303
Energy: 0.8725867282957759
Energy: 0.8531954453787312
Energy: 0.8231900352845554
Energy: 1.0299584778347088
Energy: 0.781444513000428
Energy: 0.8039584709370862
Energy: 0.8519577753484211
Energy: 0.8317006780659961
Energy: 0.7823462935437495
Energy: 1.140481815312275
Energy: 0.8161992769927269
Energy: 0.827957790885498
Energy: 1.0515406072024442
Energy: 0.810661545391641
Energy: 0.9314991868514153
Energy: 1.1380078163528704
Energy: 1.0466035232818733
Energy: 0.9139588991087139
Energy: 0.8854504601760459
Energy: 0.9906918029701315
Energy: 0.9287094208986864
Energy: 1.1425735881524244
Energy: 0.9843893164701959
Energy: 0.8264717743146239
Energy: 0.954386421733993
Energy: 0.9631361007683538
Energy: 0.9090090882202214
Energy: 1.3583190084890253
Energy: 0.8310950167934846
Energy: 0.7339758944768319
Energy: 0.9685759820031864
Energy: 0.967351705850695
Energy: 0.9104418824542436
Energy: 0.9427278791517322
Energy: 0.957824618787452
Energy: 0.8057143891520867
Energy: 0.8131796070413941
Energy: 0.9236870538050741
Energy: 0.7872880929786195
Energy: 1.0269623338134564
Energy: 0.7944809275499045
Energy: 0.7699930021091976
Energy: 0.8641280643952093
Energy: 0.8260860264821597
Energy: 0.8667137408374682
Energy: 1.0815171280721587
Energy: 0.895433844501168
Energy: 0.9591224718790788
Energy: 0.9337951905087528
Energy: 0.9298107005381606
Energy: 0.8843863278800866
Energy: 1.0117776338344953
Energy: 0.8502087510176112
Energy: 0.8399808525680877
Energy: 0.867053091689637
Energy: 0.8754888761671151
Energy: 0.8256214896669088
Energy: 0.9865491716843001
Energy: 0.8195414110348932
Energy: 0.799358747767712
Energy: 0.8239741309093115
Energy: 0.8079967011547539
Energy: 0.7884168348902084
Energy: 1.1686632353699138
Energy: 0.8417272531236977
Energy: 0.8510499470402796
Energy: 0.8958853831848547
Energy: 0.8439481343597968
Energy: 0.9092662196263929
Energy: 1.3136064405774646
Energy: 0.9716642418033095
Energy: 0.9767183475545572
Energy: 0.955471172338787
Energy: 1.006047403121019
Energy: 0.9620780659777916
Energy: 1.327369113331995
Energy: 0.9250689401090815
Energy: 0.9979908836423309
Energy: 0.9335532790326394
Energy: 0.9889595275237528
Energy: 0.9485684331468178
Energy: 1.0997588613539357
Energy: 0.8337915014090536
Energy: 0.8282295150498817
Energy: 0.9503865914978904
Energy: 0.8916444594959627
Energy: 0.9408097108230291
Energy: 1.024709612718996
Energy: 0.8005199467786172
Energy: 0.7979087005883182
Energy: 0.8146067712013567
Energy: 0.8347271430945625
Energy: 0.8211775894206964
Energy: 1.0593467619401917
Energy: 0.8460004545942316
Energy: 0.8412096387533352
Energy: 0.8094497907956716
Energy: 0.8491585671299694
Energy: 0.8368519306846034
Energy: 1.141859713639736
Energy: 0.847869993609698
Energy: 0.8084934303258532
Energy: 0.9108535271681759
Energy: 0.9043497759805535
Energy: 0.8725742778372588
Energy: 1.0799132626331702
Energy: 0.8008756355037526
Energy: 0.8000561587902688
Energy: 0.8658699644586254
Energy: 0.8329364344282808
Energy: 0.8082866517415715
Energy: 1.1803931810269512
Energy: 0.7748375276821077
Energy: 0.788549247557563
Energy: 0.9448281191365864
Energy: 0.8057835258081376
Energy: 0.8003076617162156
Energy: 1.1308339948016615
Energy: 0.8459509864658055
Energy: 0.9064556235034689
Energy: 0.9134781945271205
Energy: 1.0232317219883762
Energy: 0.8336726609148885
Energy: 1.15300189246249
Energy: 1.0003769247705991
Energy: 0.9306034317600304
Energy: 0.9870416637939092
Energy: 0.9638425642583297
Energy: 0.7664739109710964
Energy: 1.257904648552672
Energy: 0.8727512370554052
Energy: 0.8981930349082992
Energy: 0.9308655376842093
Energy: 0.8441549342043128
Energy: 0.8859319565419143
Energy: 1.3617899675341678
Energy: 0.9603262322250319
Energy: 0.8013313472156355
Energy: 0.8458383809389883
Energy: 1.0735599600573342
Energy: 0.8099848201767829
Energy: 0.9929618913414372
Energy: 0.862128094181429
Energy: 0.8565222828856432
Energy: 0.8441143452311649
Energy: 0.9138553646886863
Energy: 0.7625182630660141
Energy: 1.0834679437354762
Energy: 0.829357767755514
Energy: 0.8256915366537813
Energy: 0.8384198683529662
Energy: 0.8291928606303833
Energy: 0.8279677574583005
Energy: 1.0092516327238263
Energy: 0.8476228344600604
Energy: 0.8212772595530825
Energy: 0.7965486429003255
Energy: 0.8725903962876778
Energy: 0.8287163466617797
Energy: 1.010004980423726
Energy: 0.8514056105047672
Energy: 0.9695586651726664
Energy: 0.9632555667578874
Energy: 0.914410021635717
Energy: 0.8050888601670232
Energy: 1.1203844199781092
Energy: 0.8365197252631802
Energy: 0.810122692927235
Energy: 0.8989892967900839
Energy: 0.8148193986320509
Energy: 0.9707799509533318
Energy: 1.0429648447824915
Energy: 0.8567840125491364
Energy: 0.841711747206914
Energy: 0.793977493739821
Energy: 0.8962238452806514
Energy: 0.8276531278486188

minimum gb energy = 0.6651911647891627 eV
minimum distance =  2.25105525242549 Angstroms
sigma value = 81


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

Energy: 1.9183029791216615
Energy: 0.880216319666136
Energy: 0.6831324841711893
Energy: 0.6990827365651411
Energy: 0.8389649070817359
Energy: 1.024156651542879
Energy: 1.1488533993021548
Energy: 0.6506351517304662
Energy: 0.7437004984973599
Energy: 0.7015668948861653
Energy: 0.6619831661301001
Energy: 0.6327838016912054
Energy: 1.1595929436815497
Energy: 0.8898483892268872
Energy: 0.8792999746236414
Energy: 0.7340610826361512
Energy: 0.8971706210889231
Energy: 1.1395892825576885
Energy: 0.7426704819397042
Energy: 0.8958744180401946
Energy: 1.0014822407916117
Energy: 1.0986548954836464
Energy: 0.8889257282346131
Energy: 0.7168079743255227
Energy: 1.0775364707928268
Energy: 0.8622643283568319
Energy: 1.0159478022237716
Energy: 1.0709045279123284
Energy: 0.9907312997045573
Energy: 0.9822895538093728
Energy: 1.0994247768813172
Energy: 0.9898179223839365
Energy: 1.0053002575825793
Energy: 1.0177782429334712
Energy: 1.1269568753655437
Energy: 1.0133061873398677
Energy: 0.9030994561608807
Energy: 0.8971018775994735
Energy: 0.8873864373624998
Energy: 0.8048366649242024
Energy: 0.8483345910535667
Energy: 0.8897545852945106
Energy: 1.3529659939942642
Energy: 1.1379675660464799
Energy: 1.1138012694023336
Energy: 0.9877474005930963
Energy: 1.3931245852976784
Energy: 1.205213523186836
Energy: 0.8997055100468858
Energy: 0.8743777601257041
Energy: 0.9085551140503816
Energy: 0.8378906265567616
Energy: 0.896988049447863
Energy: 0.8527385980918177
Energy: 0.9099743891264586
Energy: 0.9322620042643531
Energy: 0.9106396596316887
Energy: 0.7920855607365879
Energy: 0.5658262406295833
Energy: 0.6847704672398115
Energy: 0.9302706455611037
Energy: 0.8419077730569611
Energy: 1.0037381989952634
Energy: 0.8961120237798812
Energy: 0.741060530686796
Energy: 0.8016415272271629
Energy: 0.9636656038016422
Energy: 1.065785907589508
Energy: 1.0414291543412972
Energy: 0.9211628459857818
Energy: 0.8568334380937398
Energy: 0.8372472270222003
Energy: 0.9790996898734805
Energy: 0.8857265793112366
Energy: 0.8552445534383808
Energy: 0.894398108186251
Energy: 1.0981489483648383
Energy: 0.8678837484117436
Energy: 0.9927343834308706
Energy: 1.0306303954511282
Energy: 0.8067950442172239
Energy: 1.0121223268147546
Energy: 1.013457796773507
Energy: 0.9763586387915151
Energy: 1.349028977197769
Energy: 1.02155815313304
Energy: 1.0186167977153324
Energy: 1.0719063831017894
Energy: 1.0231389031567781
Energy: 1.0192104787612561
Energy: 1.238295700919754
Energy: 1.0284835730915123
Energy: 0.8701826066625681
Energy: 1.052699471860423
Energy: 0.9301730436327962
Energy: 1.0892710081352892
Energy: 1.1960620933663175
Energy: 0.9256095788227218
Energy: 1.1961242289380698
Energy: 1.0741900284164339
Energy: 0.9641444636685742
Energy: 0.8636632967675343
Energy: 0.9972701997999752
Energy: 0.8589143426321162
Energy: 0.9031518814116366
Energy: 1.158420589597693
Energy: 0.8589818487348083
Energy: 0.8741504443216662
Energy: 1.139759970820398
Energy: 0.8277727773591619
Energy: 0.8257283661085222
Energy: 0.9145035075180644
Energy: 0.8418177360621266
Energy: 0.7314604494863719
Energy: 1.1381838173133672
Energy: 0.8149645675898594
Energy: 0.8466726455761601
Energy: 0.9817805335070751
Energy: 0.8380469104038277
Energy: 0.6417373365202911
Energy: 0.9250124481678241
Energy: 0.8713001943526221
Energy: 0.8471718268820876
Energy: 1.1047621559859206
Energy: 0.8309808965243404
Energy: 0.8721527106226302
Energy: 1.2431824312373567
Energy: 0.8903881410672049
Energy: 0.8914269138323769
Energy: 1.1010588781748623
Energy: 0.9057553825104924
Energy: 0.8918470604047152
Energy: 1.1199539191334633
Energy: 0.9942860035302871
Energy: 0.8225985466814502
Energy: 0.8322370477481771
Energy: 0.8512296209390632
Energy: 0.9782306857445968
Energy: 1.162856057302082
Energy: 1.0480659663424339
Energy: 1.0756505001093088
Energy: 1.0357445265970369
Energy: 1.043639788304612
Energy: 1.005123860939161
Energy: 1.0687616674268783
Energy: 1.0704667626085527
Energy: 0.9753515050275734
Energy: 0.9384623415759754
Energy: 1.059280821162268
Energy: 1.0083600614555928
Energy: 1.1908650256865323
Energy: 1.1150690720861582
Energy: 1.0585986438789146
Energy: 0.9191868353147091
Energy: 0.8786282719840712
Energy: 0.8978310824185202
Energy: 1.2821219630082017
Energy: 0.8933941262967533
Energy: 0.8778035877870749
Energy: 0.8675197751102929
Energy: 1.1158840324992898
Energy: 0.9602023988359926
Energy: 0.9311235890216377
Energy: 0.9834293842163684
Energy: 0.8922037398193046
Energy: 0.8523031833042772
Energy: 0.8520360115514231
Energy: 0.8300595449955037
Energy: 0.8961125909372614
Energy: 0.7448328152888419
Energy: 0.5879073842024248
Energy: 0.7766663290278589
Energy: 0.9377294188234722
Energy: 0.8999950010560913
Energy: 1.0044878638601193
Energy: 0.8120817409025056
Energy: 0.8069863139625745
Energy: 0.8255871907574907
Energy: 1.0620365812384764
Energy: 0.8015663024667444
Energy: 1.0729649944370294
Energy: 0.8777372774884519
Energy: 0.8364705275914478
Energy: 0.9079454109794182
Energy: 1.1195132644135566
Energy: 0.8836140004753998
Energy: 0.9175907569060032
Energy: 0.958461232073632
Energy: 1.0090953661193265
Energy: 0.8783365776817362
Energy: 0.8532395918971658
Energy: 0.7979547566166055
Energy: 1.2789223560345548
Energy: 1.0000257252890332
Energy: 0.9905472644940085
Energy: 1.1471545831775796
Energy: 0.9992336663774579
Energy: 0.9854523660411357
Energy: 1.2940039583873044
Energy: 0.9655780216757541
Energy: 0.996624217201641
Energy: 1.1186783919564254
Energy: 0.9970542599434257
Energy: 0.9893019189312181
Energy: 0.837019113080805
Energy: 0.741333152289695
Energy: 1.022216768515252
Energy: 1.0975853584638249
Energy: 0.9435621612297618
Energy: 0.7633208555440557
Energy: 1.1937086609097265
Energy: 0.9332703525201925
Energy: 0.9497739798173049
Energy: 0.7463024702623651
Energy: 0.9735711222239694
Energy: 1.1147927780618476
Energy: 1.2368865515531757
Energy: 0.6255755626959234
Energy: 0.6265133932020863
Energy: 0.7339419430436895
Energy: 0.6399264452050263
Energy: 0.7244384116138197
Energy: 1.2120820439456894
Energy: 0.7255538609298334
Energy: 0.6803926572869053
Energy: 0.5656083756672081
Energy: 0.6692982032565777
Energy: 1.0064437818397631

minimum gb energy = 0.5656083756672081 eV
minimum distance =  2.25606154902168 Angstroms
sigma value = 43


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

Energy: 1.2046265743400904
Energy: 1.3792299689346585
Energy: 1.1099973026628647
Energy: 0.7885536750436917
Energy: 1.4859471247860043
Energy: 0.7749441117624486
Energy: 0.8328882507584523
Energy: 0.8092551472446019
Energy: 0.790663128857034
Energy: 0.6913808887473737
Energy: 0.8213248247454918
Energy: 0.7795236791245458
Energy: 0.7912150256024485
Energy: 0.7086941629789943
Energy: 0.7242820169250624
Energy: 0.6446464197862869
Energy: 0.8666972392443497
Energy: 0.6215603070947049
Energy: 0.9762977336866793
Energy: 0.8742732094598351
Energy: 0.7044668078318884
Energy: 0.734177061916474
Energy: 0.8883571413289323
Energy: 0.7464629346317817
Energy: 0.8843585695690661
Energy: 0.705126066686987
Energy: 0.6650529648365441
Energy: 0.7189047376155344
Energy: 0.7384384097415713
Energy: 0.6695471068205618
Energy: 0.9671798338732833
Energy: 0.6931456032820003
Energy: 0.7068415893147425
Energy: 0.7061582397092968
Energy: 0.7303736458129574
Energy: 0.7055034976096062
Energy: 0.9345919175969825
Energy: 0.7037702313934354
Energy: 0.6886545344729764
Energy: 0.7597774907070884
Energy: 0.8186419477014257
Energy: 0.6256067750199517
Energy: 1.056424932894968
Energy: 0.7216906545214014
Energy: 0.6706524921947188
Energy: 0.7496533425347337
Energy: 0.7537012826122027
Energy: 0.6003340252343207
Energy: 1.1936858892547308
Energy: 0.7112553624327814
Energy: 0.6902786108234311
Energy: 0.7710020369458886
Energy: 0.6468595194061524
Energy: 0.8051797024161033
Energy: 1.0471811820800023
Energy: 0.836366298309881
Energy: 0.9098860779779214
Energy: 0.7912607530474147
Energy: 0.9598096259427162
Energy: 0.7371950000985672
Energy: 1.1211220791370529
Energy: 0.7924805012457099
Energy: 0.8322689794997051
Energy: 0.6821913846556015
Energy: 0.8283284015434516
Energy: 0.9323904842725641
Energy: 1.0594223715904465
Energy: 0.8270693062232302
Energy: 0.7910960182303506
Energy: 0.915301162239575
Energy: 0.7971164129514623
Energy: 0.8385334758450874
Energy: 1.1089368037314287
Energy: 0.7372855460678256
Energy: 0.6544680965460815
Energy: 0.8674397000963867
Energy: 0.7626091064496837
Energy: 0.6815164947259608
Energy: 0.8971399390881738
Energy: 0.663567937320458
Energy: 0.6724562182770604
Energy: 0.6754548817146379
Energy: 0.662752503945255
Energy: 0.6922259373136733
Energy: 0.9051897704877186
Energy: 0.7342182865721175
Energy: 0.7251782981934555
Energy: 0.7099881479116196
Energy: 0.7300383540799116
Energy: 0.7152453376960485
Energy: 0.8422296208862292
Energy: 0.7976167985483067
Energy: 0.7620356300180324
Energy: 0.7537855811268811
Energy: 0.790466739337645
Energy: 0.7157116063297202
Energy: 0.8584368253670258
Energy: 0.7537433054773488
Energy: 0.7307701103349971
Energy: 0.6795032141741291
Energy: 0.7310237918382775
Energy: 0.7510049902369715
Energy: 0.8925239691137791
Energy: 0.7129826237700966
Energy: 0.6888473404921701
Energy: 0.6952881747889289
Energy: 0.7635981169890994
Energy: 0.6892947571352176
Energy: 1.1053753643244866
Energy: 0.7933845170012913
Energy: 0.8738511834517031
Energy: 0.9053711352915356
Energy: 0.856537843919595
Energy: 0.8821623006901604
Energy: 1.0979110048318066
Energy: 0.7024259948234799
Energy: 0.748540456933971
Energy: 0.8135830160275356
Energy: 0.9030001967542192
Energy: 0.7710874395421896
Energy: 1.1141162852183941
Energy: 0.8100978150003495
Energy: 0.9561207108722253
Energy: 0.7262307677014186
Energy: 0.8002961470143309
Energy: 0.9559247718842692
Energy: 0.9923550174843401
Energy: 0.5817550732977808
Energy: 0.7962405468083069
Energy: 0.9343285443998129
Energy: 0.7718805323533052
Energy: 0.7801501418956257
Energy: 0.9934656517650039
Energy: 0.7022513386121786
Energy: 0.7223425098199202
Energy: 0.7017231629291484
Energy: 0.6927958408472288
Energy: 0.6350965941107634
Energy: 1.0182908122860959
Energy: 0.7542385483435736
Energy: 0.738994174207203
Energy: 0.8276181430624392
Energy: 0.672334068982992
Energy: 0.7577133821079295
Energy: 1.109976030182695
Energy: 0.6772583873611671
Energy: 0.6727375131091383
Energy: 0.8332253961280403
Energy: 0.6504240754989633
Energy: 0.7054244123234179
Energy: 0.9778262366752833
Energy: 0.6843026100726856
Energy: 0.7401009242322917
Energy: 0.7622245358105042
Energy: 0.6735996389677295
Energy: 0.7154428187520908
Energy: 0.9718348108781663
Energy: 0.6998267666232467
Energy: 0.6908531685705992
Energy: 0.727802303217346
Energy: 0.7355137799702173
Energy: 0.693822391740494
Energy: 0.8868464834408738
Energy: 0.6544090464827936
Energy: 0.6531825757832412
Energy: 0.7561837083315887
Energy: 0.6878637890122689
Energy: 0.6562047510142782
Energy: 1.0104683189660963
Energy: 0.6718479934487124
Energy: 0.7704304110853585
Energy: 0.8461107171871232
Energy: 0.7854270519204821
Energy: 0.6611325637674782
Energy: 0.9678919940873166
Energy: 0.9042859895120359
Energy: 0.8378487813227055
Energy: 0.8036139240934068
Energy: 0.9370008221371071
Energy: 0.7472582756857553
Energy: 1.1792336878808598
Energy: 0.8450104539676504
Energy: 0.8420165764693611
Energy: 0.968320107372893
Energy: 0.9005445672922644
Energy: 0.8883378389274068

minimum gb energy = 0.5817550732977808 eV
minimum distance =  2.2469405786035 Angstroms
sigma value = 57


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

Energy: 1.4511980971316714
Energy: 1.2309994444118124
Energy: 0.8118405754374175
Energy: 0.7819585698194208
Energy: 1.1544684570903294
Energy: 0.7787864883973997
Energy: 0.9583499704219085
Energy: 0.7101925819760027
Energy: 0.6820502253588558
Energy: 0.6243001276648645
Energy: 0.6287976760983892
Energy: 0.7442875487953743
Energy: 0.899612486156449
Energy: 0.7044402248473878
Energy: 0.6517759342746025
Energy: 0.741668345362547
Energy: 0.7652456369293061
Energy: 0.668297248366775
Energy: 0.8200229907063752
Energy: 0.7420698244801592
Energy: 0.7673537879993265
Energy: 0.8679058988696599
Energy: 0.7533583837326234
Energy: 0.6884084090677373
Energy: 0.8928136622245942
Energy: 0.6568232726356519
Energy: 0.7154051017626059
Energy: 0.7010801232147598
Energy: 0.8011242925851025
Energy: 0.7419463627401629
Energy: 0.8417132917997152
Energy: 0.7020992132256939
Energy: 0.7049662117536206
Energy: 0.7462943057535152
Energy: 0.7420572689652049
Energy: 0.6920584218904978
Energy: 1.0943552960689003
Energy: 0.6978335280226022
Energy: 0.682971984121631
Energy: 0.7785488124069563
Energy: 0.6886951655393795
Energy: 0.6262552475988077
Energy: 1.3479711372932948
Energy: 0.7124808236248903
Energy: 0.7605057238975481
Energy: 0.7190485681464915
Energy: 0.6178605520526103
Energy: 0.6533080765661459
Energy: 0.9917708161962308
Energy: 0.7302301453848404
Energy: 0.7557004763634789
Energy: 0.7500678764200231
Energy: 0.7655381097410434
Energy: 0.7108803987823055
Energy: 0.9063517677350958
Energy: 0.7237620446467471
Energy: 0.7524564312163879
Energy: 0.6697155883649517
Energy: 0.7441060138200936
Energy: 0.7374987892223477
Energy: 0.965970080276434
Energy: 0.8213331589741742
Energy: 0.7297957970690524
Energy: 0.7449731673860219
Energy: 0.8541437098172641
Energy: 0.7346811766002977
Energy: 1.027030178570846
Energy: 0.7568207486200396
Energy: 0.8135680712029748
Energy: 0.796532016935785
Energy: 0.7146101724341465
Energy: 0.7263366005389402
Energy: 1.1230063097183551
Energy: 0.7792760043960512
Energy: 0.7233830177578756
Energy: 0.9653045321054983
Energy: 0.5572002841891955
Energy: 0.7335683101784012
Energy: 0.8916558467668143
Energy: 0.7443152424540767
Energy: 0.7076275615176836
Energy: 0.7655390882955236
Energy: 0.6586474120215755
Energy: 0.6841054085211421
Energy: 0.9040769935897991
Energy: 0.6879450065231038
Energy: 0.6718490614205134
Energy: 0.7276016525125271
Energy: 0.7143864724690521
Energy: 0.6796704374774628
Energy: 0.8442592491184985
Energy: 0.7782895569138126
Energy: 0.731509072681518
Energy: 0.6472640067902646
Energy: 0.7743901364643879
Energy: 0.6715295811233164
Energy: 0.9037655101662879
Energy: 0.6824178585770867
Energy: 0.6811843575270199
Energy: 0.726193575567415
Energy: 0.666441370810039
Energy: 0.6745767453794741
Energy: 0.8861004357307932
Energy: 0.7389188110122298
Energy: 0.7197778784705866
Energy: 0.7709331806431861
Energy: 0.6204979838807559
Energy: 0.7912786454724563
Energy: 0.8985405163235908
Energy: 0.6924572263052013
Energy: 0.7506175749158728
Energy: 0.6313920657770254
Energy: 0.8764539410625972
Energy: 0.905985537433566
Energy: 1.1006409720637473
Energy: 0.5665726835239784
Energy: 0.7413003503800965
Energy: 0.8678386507493044
Energy: 0.7243445934650844
Energy: 0.7109317682731797
Energy: 0.9248177339367942
Energy: 0.7032331949433349
Energy: 0.8400011235626372
Energy: 0.7694397224199846
Energy: 0.6534241320020683
Energy: 0.7641997563042028
Energy: 1.1249720304451125
Energy: 0.7746275292211997
Energy: 0.7159738021634607
Energy: 1.0372308746521486
Energy: 0.7403550108632775
Energy: 0.7486735645489029
Energy: 1.0315459993823441
Energy: 0.7471162287546066
Energy: 0.7455845295790812
Energy: 0.6952120565780923
Energy: 0.6753548583936179
Energy: 0.751851200981345
Energy: 1.2403904907300494
Energy: 0.7087143870501682
Energy: 0.7448655202928257
Energy: 0.9672418052547828
Energy: 0.6795157790897659
Energy: 0.8036698270344246

minimum gb energy = 0.5572002841891955 eV
minimum distance =  2.26135854073506 Angstroms
sigma value = 17


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

Energy: 1.0330772554173326
Energy: 1.0700118169103228
Energy: 0.7960658802885683
Energy: 0.668182144366283
Energy: 1.0970698735685183
Energy: 0.6636709251204815
Energy: 0.9975981190543036
Energy: 0.6683596410913543
Energy: 0.7334619787116478
Energy: 0.7422226667343206
Energy: 0.7049580097434845
Energy: 0.7497515828987591
Energy: 0.8880208170133533
Energy: 0.7871099131262072
Energy: 0.6785690434262205
Energy: 0.6956591625437576
Energy: 0.7862000831589844
Energy: 0.6188941497059923
Energy: 0.9027401067442898
Energy: 0.8005571108992738
Energy: 0.7350033023997842
Energy: 0.9095671769153919
Energy: 0.7984178563781279
Energy: 0.6674167566222046
Energy: 0.922638166000297
Energy: 0.6375157024456609
Energy: 0.6477350565747458
Energy: 0.6306491960732727
Energy: 0.68987004610894
Energy: 0.690828132554962
Energy: 0.9110839126038676
Energy: 0.6667865491098777
Energy: 0.6593888755919219
Energy: 0.6364200223275276
Energy: 0.7082925939081028
Energy: 0.6106175251471984
Energy: 0.9368458341586504
Energy: 0.6572983194413053
Energy: 0.597758348263384
Energy: 0.7583640319432716
Energy: 0.6273798436582806
Energy: 0.6101637429761669
Energy: 0.8866226499902794
Energy: 0.6112632123384468
Energy: 0.6301932084909702
Energy: 0.6704342225890819
Energy: 0.6562167293371587
Energy: 0.6051508272948909
Energy: 0.79684318671528
Energy: 0.7135687813996893
Energy: 0.6935258414045208
Energy: 0.6497308177538015
Energy: 0.6608868167377249
Energy: 0.6483384691490985
Energy: 0.776441329514223
Energy: 0.6542737384559043
Energy: 0.6393988258517423
Energy: 0.6827457393316866
Energy: 0.6134838566013892
Energy: 0.6332647218230495
Energy: 0.8287783334326299
Energy: 0.7523963718084328
Energy: 0.6566344387917877
Energy: 0.6157126992921611
Energy: 0.724005168671002
Energy: 0.6469782506967565
Energy: 0.8905246575874126
Energy: 0.8368608865134796
Energy: 0.7193060283244209
Energy: 0.6682165509977062
Energy: 0.6001280679423899
Energy: 0.7357119380072791
Energy: 0.9498296054549115
Energy: 0.678847362107992
Energy: 0.6750572234926083
Energy: 0.7183926219949385
Energy: 0.6735983455154588
Energy: 0.7306322087571145
Energy: 0.905149888141518
Energy: 0.697000377881763
Energy: 0.7202355111486604
Energy: 0.7686455387435936
Energy: 0.7061333856468412
Energy: 0.7150302023211358
Energy: 1.0219007972325005
Energy: 0.7406155954952599
Energy: 0.73845224541138
Energy: 0.7119385308931521
Energy: 0.6765444822785033
Energy: 0.746076849042372
Energy: 0.9245567777724
Energy: 0.7522748158450676
Energy: 0.7600347585013512
Energy: 0.7156814052885344
Energy: 0.6799676462686565
Energy: 0.7637144717275011
Energy: 0.9967759022571635
Energy: 0.6896035221669474
Energy: 0.8355221749107764
Energy: 0.7994985597674872
Energy: 0.7117020116996204
Energy: 0.7413693749642865

minimum gb energy = 0.597758348263384 eV
minimum distance =  2.24138329465478 Angstroms
sigma value = 17


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

Energy: 0.9134358659511973
Energy: 0.9560239574950774
Energy: 0.6601984513550196
Energy: 0.6858479630873775
Energy: 0.9458963115932417
Energy: 0.6559662566375677
Energy: 0.9270874708525887
Energy: 0.6850185607891079
Energy: 0.693788278112732
Energy: 0.6999343538915372
Energy: 0.6516015984336008
Energy: 0.7150922627078009
Energy: 0.9167878080991368
Energy: 0.6900887154570419
Energy: 0.6839307563298379
Energy: 0.7311008192517682
Energy: 0.7070486394980541
Energy: 0.7291785804587836
Energy: 0.873958076742806
Energy: 0.650408707855417
Energy: 0.6382156193521735
Energy: 0.8735706969215717
Energy: 0.6454722595112818
Energy: 0.831674245221276
Energy: 0.8828274542031808
Energy: 0.6274366013219786
Energy: 0.6908518700977496
Energy: 0.6121579527215973
Energy: 0.6255010782368027
Energy: 0.7252208092302435
Energy: 0.9805705461720295
Energy: 0.6604693790274416
Energy: 0.6311812690876799
Energy: 0.6280644510266369
Energy: 0.6423052342413776
Energy: 0.6096178238686498
Energy: 0.8192734044562902
Energy: 0.6149009911487169
Energy: 0.6050248145268031
Energy: 0.6091111691866162
Energy: 0.6114687247671285
Energy: 0.5754193586597416
Energy: 0.8744332994580606
Energy: 0.5868801187637059
Energy: 0.5553317176734928
Energy: 0.5611044986528625
Energy: 0.6534515882908395
Energy: 0.5987855145380035
Energy: 0.7673833168568758
Energy: 0.6788698552569336
Energy: 0.6633523947291182
Energy: 0.5917205603531763
Energy: 0.675428501449813
Energy: 0.588176153750233
Energy: 0.8106169838293521
Energy: 0.5726154755737288
Energy: 0.5676121307382579
Energy: 0.6487757445626375
Energy: 0.5740167255011094
Energy: 0.6114856483671836
Energy: 0.8673029462016448
Energy: 0.6484544701471613
Energy: 0.6473325178999676
Energy: 0.6086371665057272
Energy: 0.6458925553300975
Energy: 0.6064499994600389
Energy: 0.8429838942913171
Energy: 0.5943479263098942
Energy: 0.5828740653548998
Energy: 0.6882015742541788
Energy: 0.5970975864598334
Energy: 0.6018658618636181
Energy: 0.8605638898179697
Energy: 0.5984271519774536
Energy: 0.5741870411455045
Energy: 0.705504293810492
Energy: 0.5807271897311616
Energy: 0.5937501856326755
Energy: 0.7506687116573175
Energy: 0.616682496206028
Energy: 0.6050890191748802
Energy: 0.6422708362666765
Energy: 0.6094175975166001
Energy: 0.5943037029749008
Energy: 0.9314698128341768
Energy: 0.594474253745021
Energy: 0.5909194711942198
Energy: 0.6392645876839786
Energy: 0.611520333147726
Energy: 0.6336239875072874
Energy: 0.8742680465660566
Energy: 0.6894685457184849
Energy: 0.7278185112100466
Energy: 0.6055003948476927
Energy: 0.6956091147748654
Energy: 0.7040846300597772
Energy: 0.8914009847109524
Energy: 0.7868396437022582
Energy: 0.7298642728819612
Energy: 0.7174505490593327
Energy: 0.7185218450240967
Energy: 0.7633510949735268
Energy: 0.8215450621054264
Energy: 0.719086715868348
Energy: 0.7443982406974697
Energy: 0.727651902744322
Energy: 0.7337720167042234
Energy: 0.7301857268655164
Energy: 0.8723702094340892
Energy: 0.6794592742209614
Energy: 0.7287925148219885
Energy: 0.7519135016978716
Energy: 0.5880366918399367
Energy: 0.7371446067151197
Energy: 1.002172865706213
Energy: 0.6587413653111396
Energy: 0.6365087477268302
Energy: 0.7848789250209289
Energy: 0.7765383561876059
Energy: 0.715274424844581
Energy: 0.9248216147175021
Energy: 0.7024775708951448
Energy: 0.7038781474586485
Energy: 0.7205559341747364
Energy: 0.7441039189873764
Energy: 0.699825544840507
Energy: 0.9425494037818317
Energy: 0.6497778468334756
Energy: 0.7336465715941821
Energy: 0.7679871002712402
Energy: 0.6525947203968778
Energy: 0.7065703109746384
Energy: 0.8770628952227237
Energy: 0.6432072149581208
Energy: 0.647872169564282
Energy: 0.6534677023698416
Energy: 0.7110196779105741
Energy: 0.697389273419986
Energy: 0.9293313041069354
Energy: 0.6893635945898227
Energy: 0.7414111895986415
Energy: 0.7473798656967162
Energy: 0.6783262696701111
Energy: 0.7035216325199727
Energy: 0.8894287274050244
Energy: 0.6125081978811836
Energy: 0.6279114832909617
Energy: 0.6774205474677639
Energy: 0.6157148093529395
Energy: 0.6373541482515415
Energy: 0.8853858819831175
Energy: 0.6340944258059661
Energy: 0.6901371884433193
Energy: 0.6445554179455438
Energy: 0.6393206530138194
Energy: 0.6194261942230953
Energy: 0.8604685150567661
Energy: 0.6206707888165883
Energy: 0.6288678193456616
Energy: 0.7209702901022633
Energy: 0.6296146381117662
Energy: 0.6002489152867582
Energy: 0.8319365403881441
Energy: 0.6124052826345143
Energy: 0.6425392524288841
Energy: 0.6732503556275848
Energy: 0.6351936237197184
Energy: 0.7276298649826982
Energy: 0.8680644570607314
Energy: 0.6881046938216206
Energy: 0.6043940347431535
Energy: 0.5515057300234502
Energy: 0.6886215095560893
Energy: 0.5998574581198396
Energy: 0.7639548825259448
Energy: 0.5632011453750012
Energy: 0.6147070997590488
Energy: 0.5852483603783765
Energy: 0.6773073412234563
Energy: 0.6665565714039121
Energy: 0.7826946860823872
Energy: 0.6018462665515715
Energy: 0.5804072546562025
Energy: 0.5554567568958528
Energy: 0.6336970015051598
Energy: 0.5615823482561755
Energy: 0.8092851445020826
Energy: 0.6159592957123441
Energy: 0.5870949717199266
Energy: 0.5868771675918947
Energy: 0.6623111458716209
Energy: 0.5762498877772062
Energy: 0.8351941450622568
Energy: 0.5808443626324682
Energy: 0.6746237896990297
Energy: 0.6589073006488256
Energy: 0.6776694136427416
Energy: 0.656773236873082
Energy: 0.8662986667450344
Energy: 0.5914662481344863
Energy: 0.5796531557795032
Energy: 0.6025892961482765
Energy: 0.6605204009211567
Energy: 0.5854499456247154
Energy: 0.7565163718051889
Energy: 0.5973266534387012
Energy: 0.6128529376847485
Energy: 0.6112157186729286
Energy: 0.6061881548875142
Energy: 0.557352418476165
Energy: 0.8100880007168895
Energy: 0.5939094126716189
Energy: 0.7295689803679536
Energy: 0.6430870752948609
Energy: 0.6955307561774493
Energy: 0.7286792236178616
Energy: 0.8791877428853154
Energy: 0.7508156716627352
Energy: 0.703704204002214
Energy: 0.5544301812222209
Energy: 0.7431332896495125
Energy: 0.6445412172404563
Energy: 0.8848967627022515
Energy: 0.6890546582605911
Energy: 0.718527478064933
Energy: 0.5495212661481452
Energy: 0.6713567238655492
Energy: 0.6746269626169614
Energy: 0.8876489792182874
Energy: 0.6874450073934373
Energy: 0.6209884263849206
Energy: 0.6828519562647603
Energy: 0.6798824206624424
Energy: 0.6064009743159398
Energy: 0.9135164241930158
Energy: 0.782169386051993
Energy: 0.7461116396503059
Energy: 0.6133470836999358
Energy: 0.6653704976638489
Energy: 0.7107730621102002
Energy: 1.0011106639655665
Energy: 0.6499725459151966
Energy: 0.6986665578266306
Energy: 0.9277683962821129
Energy: 0.7261943651753827
Energy: 0.7145611899649067
Energy: 0.9314277199065609
Energy: 0.7052669928201029
Energy: 0.7405943764692697
Energy: 0.7020740989776731
Energy: 0.6516540056353777
Energy: 0.7134536732993072
Energy: 0.8660296439458489
Energy: 0.6715906097077321
Energy: 0.6266595685842702
Energy: 0.6463904229112204
Energy: 0.7271371710180755
Energy: 0.7050271930778734

minimum gb energy = 0.5495212661481452 eV
minimum distance =  2.24664849020233 Angstroms
sigma value = 57


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

Energy: 1.0455839922766224
Energy: 0.8874086624979762
Energy: 0.6502789986014228
Energy: 0.6212021379802715
Energy: 0.903824162444394
Energy: 0.6667556163104861
Energy: 0.9126572568733505
Energy: 0.6463133772903508
Energy: 0.6898585699095728
Energy: 0.7123479272100108
Energy: 0.6844564760734552
Energy: 0.6700087223063061
Energy: 0.8547396917891471
Energy: 0.6838461693134077
Energy: 0.6719544299404027
Energy: 0.7122418558523731
Energy: 0.6609149348076997
Energy: 0.6877353387662563
Energy: 0.7900721918022023
Energy: 0.7763860032179942
Energy: 0.5985465028227703
Energy: 0.7622918906427693
Energy: 0.6720643560091619
Energy: 0.7079525858296822
Energy: 0.7741834904323656
Energy: 0.5916688468269662
Energy: 0.661348343032222
Energy: 0.7382404230359758
Energy: 0.6186956270895896
Energy: 0.6515047248786433
Energy: 0.7648732193717637
Energy: 0.6395408049814547
Energy: 0.6244747255666686
Energy: 0.5766595565255127
Energy: 0.6402483103477897
Energy: 0.5982883510373963
Energy: 0.8012644960799571
Energy: 0.611391094341491
Energy: 0.5683322934197373
Energy: 0.5941521190113196
Energy: 0.7068732327674574
Energy: 0.5472149744590628
Energy: 0.8092192977742204
Energy: 0.5697791535107914
Energy: 0.5520459825401464
Energy: 0.569921351396857
Energy: 0.6487155739862795
Energy: 0.5610585369648303
Energy: 0.6907294981411048
Energy: 0.5882986974530656
Energy: 0.6434610394762477
Energy: 0.6476749849531505
Energy: 0.614563641235037
Energy: 0.6051726862187718
Energy: 0.7514578138190089
Energy: 0.5371865747196648
Energy: 0.5307405598555898
Energy: 0.6580864628849334
Energy: 0.5448901046429848
Energy: 0.5649162439472238
Energy: 0.7603312576547769
Energy: 0.5907016071561602
Energy: 0.5795800256420119
Energy: 0.6613950249717526
Energy: 0.6081983282990835
Energy: 0.591995506333839
Energy: 0.7424579193916425
Energy: 0.5430426584597577
Energy: 0.5192579918776374
Energy: 0.6281039780144062
Energy: 0.5163241171969033
Energy: 0.525367691024732
Energy: 0.7592420033130751
Energy: 0.5301545176877914
Energy: 0.570745838301262
Energy: 0.6095282739604377
Energy: 0.5411048358581836
Energy: 0.5236511333699507
Energy: 0.7025515796254714
Energy: 0.5929648615023473
Energy: 0.6224450127902503
Energy: 0.6395737046618524
Energy: 0.5884309058333682
Energy: 0.5190778951837643
Energy: 0.7462590341554016
Energy: 0.541170378716042
Energy: 0.5421808930986163
Energy: 0.6086549989170945
Energy: 0.5741128975579578
Energy: 0.5480481232753027
Energy: 0.7782275015736022
Energy: 0.5751343450317932
Energy: 0.5551760606606179
Energy: 0.6344196228990996
Energy: 0.5850585413250855
Energy: 0.5848129184687638
Energy: 0.7609189400065479
Energy: 0.5590732859545882
Energy: 0.647024305120797
Energy: 0.6456657265549745
Energy: 0.578238787541438
Energy: 0.5695280726200301
Energy: 0.7778070961936927
Energy: 0.5597601704665469
Energy: 0.5681334103687241
Energy: 0.69323568775056
Energy: 0.6132231541820484
Energy: 0.5784077898625891
Energy: 0.7341536585613839
Energy: 0.5688809411370266
Energy: 0.6418788677800933
Energy: 0.7157367982073598
Energy: 0.5709946747042396
Energy: 0.6032982780223236
Energy: 0.8204919505909523
Energy: 0.5877507048620769
Energy: 0.5755516636555229
Energy: 0.629501776935282
Energy: 0.5935978037286259
Energy: 0.6276918102293196
Energy: 0.8224732865651277
Energy: 0.6476761495040262
Energy: 0.6465575472081734
Energy: 0.6084718095898796
Energy: 0.6006296160068166
Energy: 0.6672831264660704
Energy: 0.7991103234366985
Energy: 0.7135802755531215
Energy: 0.6966033398020022
Energy: 0.6686246484696022
Energy: 0.7323779177815475
Energy: 0.7137954931334416
Energy: 0.7753863074935371
Energy: 0.6692599297352051
Energy: 0.778620090480341
Energy: 0.634536131879827
Energy: 0.6858511854796518
Energy: 0.7111957705899512
Energy: 0.8427818828846558
Energy: 0.6086441206746368
Energy: 0.730580821396372
Energy: 0.6459558203912174
Energy: 0.5586169269676737
Energy: 0.6946952443590959
Energy: 0.9199801856290332
Energy: 0.728031071231785
Energy: 0.5746893864643499
Energy: 0.8028567485321355
Energy: 0.6800409201751569
Energy: 0.7359608274588298
Energy: 0.8729358954994065
Energy: 0.7118498632517353
Energy: 0.7142934992568983
Energy: 0.7081625849698763
Energy: 0.6088867714597592
Energy: 0.644862182954954
Energy: 0.8245325104021763
Energy: 0.6645828319954558
Energy: 0.6112198409943297
Energy: 0.6980208998634891
Energy: 0.6608749197303243
Energy: 0.6568427616637187

minimum gb energy = 0.5163241171969033 eV
minimum distance =  2.24646715913219 Angstroms
sigma value = 43


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

Energy: 0.703933196771968
Energy: 0.7269936706075484
Energy: 0.539027481886679
Energy: 0.5125268709893039
Energy: 0.7101255771797889
Energy: 0.515481443825457
Energy: 0.7822102774302144
Energy: 0.5557722088944239
Energy: 0.6198564520046518
Energy: 0.5895743657872528
Energy: 0.5497038289670189
Energy: 0.5380269681294749
Energy: 0.7742951325675688
Energy: 0.5780659640094442
Energy: 0.5196295150954415
Energy: 0.5879891880006834
Energy: 0.5820148593504078
Energy: 0.5584965997415564
Energy: 0.6850943204522429
Energy: 0.5769488087175172
Energy: 0.6227991059429363
Energy: 0.5938745023539089
Energy: 0.5857121959275471
Energy: 0.6749394983121748
Energy: 0.6663518523521945
Energy: 0.5075851202045052
Energy: 0.6015889205858607
Energy: 0.4143186687551614
Energy: 0.5201195694270316
Energy: 0.6055094714264836
Energy: 0.8288900764874715
Energy: 0.5307451324749178
Energy: 0.5087569664328168
Energy: 0.5169501261301992
Energy: 0.5060183166708448
Energy: 0.5055658967201716
Energy: 0.6954421714870066
Energy: 0.5616121528863857
Energy: 0.5154831130839502
Energy: 0.4767647543057453
Energy: 0.6185368756340298
Energy: 0.5486313832294021
Energy: 0.6841233859496729
Energy: 0.4889243924084646
Energy: 0.4937110475686281
Energy: 0.5306919601953672
Energy: 0.5605669723708411
Energy: 0.4923285872730307
Energy: 0.6146503911147825
Energy: 0.5379638595729382
Energy: 0.5248524459013937
Energy: 0.5715049460165021
Energy: 0.5262995923424589
Energy: 0.5491734581908132
Energy: 0.6306582080759064
Energy: 0.4695375951078633
Energy: 0.4693930686273839
Energy: 0.5921211547517865
Energy: 0.464528042944691
Energy: 0.5133213256067846
Energy: 0.6145078391885067
Energy: 0.5046497021014931
Energy: 0.5236450420299277
Energy: 0.5369481141815723
Energy: 0.5240951230285111
Energy: 0.501038534806231
Energy: 0.6191594903506675
Energy: 0.5500128185214136
Energy: 0.46292505600988054
Energy: 0.5072262381709491
Energy: 0.5658064577585794
Energy: 0.48411048256467354
Energy: 0.6431631932104385
Energy: 0.5031637633335806
Energy: 0.46603156857023675
Energy: 0.5427144384421575
Energy: 0.5042950393982539
Energy: 0.46731795800851633
Energy: 0.5736410030481564
Energy: 0.5120006035145112
Energy: 0.5229844853052947
Energy: 0.5524959259539977
Energy: 0.5118813719823987
Energy: 0.5458066933769815
Energy: 0.6181081810894201
Energy: 0.4437967561463994
Energy: 0.4509661107323876
Energy: 0.5753345676950109
Energy: 0.44692067955112613
Energy: 0.4720275353386289
Energy: 0.6042684056021199
Energy: 0.4508634718837247
Energy: 0.4746069423032809
Energy: 0.5603903492809662
Energy: 0.45344923882088584
Energy: 0.49127485083637473
Energy: 0.5917621146540492
Energy: 0.45013483647606134
Energy: 0.4630026004813085
Energy: 0.5355280775861474
Energy: 0.5322273077611198
Energy: 0.45886800357363394
Energy: 0.6193581447760933
Energy: 0.45815853639119636
Energy: 0.43851718289891956
Energy: 0.4987695016763165
Energy: 0.45718767586321335
Energy: 0.45971153520880087
Energy: 0.5639988881765919
Energy: 0.5347623296414953
Energy: 0.5080344599760233
Energy: 0.5792589610064758
Energy: 0.5128274855032245
Energy: 0.5479490118785887
Energy: 0.658914429184252
Energy: 0.46289512282804607
Energy: 0.44067742343821165
Energy: 0.4937988626224739
Energy: 0.4903613097735546
Energy: 0.4472975662068902
Energy: 0.6226236930831672
Energy: 0.5165974614257842
Energy: 0.4857138754318221
Energy: 0.5139287147201862
Energy: 0.5567465824857073
Energy: 0.4998583921573989
Energy: 0.6233208484320658
Energy: 0.46941288134082526
Energy: 0.4913955494770826
Energy: 0.551501583984086
Energy: 0.4799114962708683
Energy: 0.4717856401678771
Energy: 0.6290579762592079
Energy: 0.45470238822716796
Energy: 0.456029519403028
Energy: 0.5726871745210695
Energy: 0.4522718063151429
Energy: 0.4834517064710343
Energy: 0.5941385528375571
Energy: 0.5007580861963997
Energy: 0.5010908776108178
Energy: 0.5250717057594583
Energy: 0.5057957389034284
Energy: 0.530162273531964
Energy: 0.6971031743903584
Energy: 0.5072568120101446
Energy: 0.4923304331487233
Energy: 0.49193863460119525
Energy: 0.5100105376600099
Energy: 0.47922778706563424
Energy: 0.6495175761007024
Energy: 0.5732028230431223
Energy: 0.535813940188726
Energy: 0.4760996163048446
Energy: 0.5785557721977143
Energy: 0.5001364989040197
Energy: 0.6346059426176405
Energy: 0.5500146060379465
Energy: 0.5316362088215695
Energy: 0.5553715547549309
Energy: 0.5455457685930554
Energy: 0.47365745329283915
Energy: 0.6480059086948674
Energy: 0.49923144495572563
Energy: 0.5011248464294418
Energy: 0.4949780273066811
Energy: 0.4979078691422233
Energy: 0.5767456467257513
Energy: 0.6512209796077978
Energy: 0.5584616699694073
Energy: 0.5668200014755298
Energy: 0.6433493092919418
Energy: 0.5403953983697088
Energy: 0.6392650921842883
Energy: 0.7449368287595894
Energy: 0.5115514697150395
Energy: 0.609251464935008
Energy: 0.5064287992768415
Energy: 0.5803557780146091
Energy: 0.5223563131986206
Energy: 0.7336031065651687
Energy: 0.579088599504659
Energy: 0.5384480054787575
Energy: 0.4851798825295496
Energy: 0.5664918880825611
Energy: 0.5890744701440582
Energy: 0.672603906769083
Energy: 0.5609648128338313
Energy: 0.5554572220780327
Energy: 0.5414844156012335
Energy: 0.5545100443384886
Energy: 0.49681853433134876
Energy: 0.7316171713763322
Energy: 0.5745348991652904
Energy: 0.5820318195099967
Energy: 0.5287222355652406
Energy: 0.6073624852364617
Energy: 0.513983257199272
Energy: 0.7766151469903869
Energy: 0.6043774663002354
Energy: 0.6808903828373535
Energy: 0.46257954957410097
Energy: 0.6106399626057466
Energy: 0.6967124501030808
Energy: 0.7820978160105441
Energy: 0.6158164075216234
Energy: 0.5033948408803881
Energy: 0.5898688363873128
Energy: 0.581744409789001
Energy: 0.6075269963053039
Energy: 0.7814032873431729
Energy: 0.5107780925465907
Energy: 0.5780955089538716
Energy: 0.6057924944583344
Energy: 0.5825545125592221
Energy: 0.47711524089891005

minimum gb energy = 0.4143186687551614 eV
minimum distance =  2.24223261719813 Angstroms
sigma value = 81


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

Energy: 0.3644283380901082
Energy: 0.7310992480121955
Energy: 0.09029553172591358
Energy: 0.01957904932104414
Energy: 0.7243654637526018
Energy: 0.4164141163596306
Energy: 0.7521976893412751
Energy: 0.7512009808632345
Energy: 0.689094566377819
Energy: 0.8328360571084523
Energy: 0.7821616677434652
Energy: 0.788900155064077
Energy: 0.7374613026050205
Energy: 0.06221649848987277
Energy: 0.060458724171925056
Energy: 0.8687117644364294
Energy: 0.017669178838624868
Energy: 0.05995308839704774
Energy: 0.7801658555727983
Energy: 0.06042236882675883
Energy: 0.06021443790111984
Energy: 0.8357833723048537
Energy: 0.017764389286931824
Energy: 0.059972938666028
Energy: 0.05584585057073427
Energy: 0.8401077187893721
Energy: 0.8130066818316127
Energy: 0.05577168707323303
Energy: 0.8612431733114821
Energy: 0.8552849985621553
Energy: 0.01861034191475093
Energy: 1.0193646532523102
Energy: 0.09088187853307593
Energy: 0.019856885055951252
Energy: 0.6676665464501574
Energy: 0.06072869731754543
Energy: 0.784471155073476
Energy: 0.8683937037518441
Energy: 0.7496496512558488
Energy: 0.7732031991476158
Energy: 0.7501808041162756
Energy: 0.7708350944048556
Energy: 0.8303518893973889
Energy: 0.017696898043797062
Energy: 0.062342347245640466
Energy: 0.8635163716271848
Energy: 0.017499978701939735
Energy: 0.06006161027487023
Energy: 0.6601060162515738
Energy: 0.09381807893952114
Energy: 0.09604410401993425
Energy: 0.834965313711006
Energy: 0.09428222781783803
Energy: 0.06017910249766228
Energy: 0.4032659000410689
Energy: 0.6420875101447814
Energy: 0.756913264826824
Energy: 0.05614065772099024
Energy: 0.781500312583457
Energy: 0.8484737587376585

minimum gb energy = 0.017499978701939735 eV
minimum distance =  2.24804662970012 Angstroms
sigma value = 3


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

Energy: 0.6633137917876081
Energy: 0.8009525935391566
Energy: 0.7654555417392043
Energy: 0.7191919759643284
Energy: 0.8298933150067429
Energy: 0.6201549868379049
Energy: 0.6487320759399198
Energy: 0.6172805436916368
Energy: 0.6090740898843996
Energy: 0.630598505876724
Energy: 0.6216365111059807
Energy: 0.6029069855411591
Energy: 0.7535054549622034
Energy: 0.49886951070948643
Energy: 0.4771457846255019
Energy: 0.624106135083161
Energy: 0.5746214044822331
Energy: 0.5454847799703231
Energy: 0.6144795340461779
Energy: 0.5353341678622886
Energy: 0.4753552209449175
Energy: 0.626939023918546
Energy: 0.5598811040340125
Energy: 0.5488412837017086
Energy: 0.586306940962838
Energy: 0.5500147731908364
Energy: 0.5854309760075203
Energy: 0.5480333890375706
Energy: 0.5910790984497222
Energy: 0.5995426117005181
Energy: 0.5831298967553892
Energy: 0.7755691906196494
Energy: 0.6751501745295804
Energy: 0.5878528662352994
Energy: 0.6982523620922074
Energy: 0.6342179380469626
Energy: 0.632954390936884
Energy: 0.5759828413273775
Energy: 0.5495902444608245
Energy: 0.6036180562251037
Energy: 0.5625698064850855
Energy: 0.5415403575672538
Energy: 0.6427079545641943
Energy: 0.49320898872887725
Energy: 0.5368842011300038
Energy: 0.6498231242312694
Energy: 0.4750327078965463
Energy: 0.5190892459743636
Energy: 0.5429251141937385
Energy: 0.5432119966677441
Energy: 0.7336949134477957
Energy: 0.5171983569485576
Energy: 0.59527749699651
Energy: 0.5125516729249099
Energy: 0.5415489870057311
Energy: 0.5684672357740093
Energy: 0.5985439738562498
Energy: 0.5402195768342879
Energy: 0.5705573851902633
Energy: 0.5107853231832525
Energy: 0.5398790990684913
Energy: 0.5799032577434411
Energy: 0.4827727536497693
Energy: 0.5128179957191396
Energy: 0.5915516462139286
Energy: 0.5103908159726367
Energy: 0.5564069279313796
Energy: 0.5130281615442753
Energy: 0.4958215611872997
Energy: 0.5322904558961413
Energy: 0.5280127032070453
Energy: 0.4928090022818146
Energy: 0.6244980502202939
Energy: 0.49969251620796035
Energy: 0.5348376937044041
Energy: 0.5846529550029131
Energy: 0.5116391899975891
Energy: 0.6073052260656432
Energy: 0.5749822485520648
Energy: 0.650321037599116
Energy: 0.6685656302890797
Energy: 0.5221551111091701
Energy: 0.7048657575648231
Energy: 0.5758820979799645
Energy: 0.5256304819369048
Energy: 0.5178319386549651
Energy: 0.5065085686537873
Energy: 0.4742883578844409
Energy: 0.525956068996821
Energy: 0.4869445124441848
Energy: 0.5599315840558039
Energy: 0.4565715862844161
Energy: 0.4207282688676184
Energy: 0.514416309627986
Energy: 0.5023303263493063
Energy: 0.4862912933751959
Energy: 0.5541396361237297
Energy: 0.48272245108049877
Energy: 0.4716457114302546
Energy: 0.5082764446383441
Energy: 0.515350192130902
Energy: 0.4917794217233271
Energy: 0.6042543355421462
Energy: 0.5923508034812284
Energy: 0.5837528920577923
Energy: 0.6174818924719747
Energy: 0.5267431081245828
Energy: 0.5456655436768124
Energy: 0.5397715055724385
Energy: 0.5486865601591286
Energy: 0.5436496986076149
Energy: 0.5181399022189449
Energy: 0.5659035602624006
Energy: 0.5529761145302907
Energy: 0.521610991145821
Energy: 0.5584180331662413
Energy: 0.4506859955122781
Energy: 0.4876321809793689
Energy: 0.5106638202718248
Energy: 0.4644040881538554
Energy: 0.5236692062968008
Energy: 0.5439633124220709
Energy: 0.4947455186499629
Energy: 0.5098217372366287
Energy: 0.5160421573575918
Energy: 0.4739804046591395
Energy: 0.5496823402429407
Energy: 0.4552985558368187
Energy: 0.5256022318975934
Energy: 0.5629154290363777
Energy: 0.5208521463542872
Energy: 0.5074844994142746
Energy: 0.6595165251940809
Energy: 0.647545317057876
Energy: 0.6517681108480483
Energy: 0.5109146408538809
Energy: 0.5809848302870465
Energy: 0.6423507356500311
Energy: 0.6304458390329324
Energy: 0.5952985115912778
Energy: 0.5958333463577669
Energy: 0.6299451449458253
Energy: 0.6028306584835668
Energy: 0.5498433580390432
Energy: 0.5502497457548878
Energy: 0.5553120785411799
Energy: 0.48901644566831437
Energy: 0.49101485794760436
Energy: 0.5333321424757936
Energy: 0.4858654269336738
Energy: 0.542681211450952
Energy: 0.5241165484078545
Energy: 0.5672727387423683
Energy: 0.5083984758409315
Energy: 0.5210693131020812
Energy: 0.47572777692377344
Energy: 0.5864358737659157
Energy: 0.5022503917572542
Energy: 0.5829214039785736
Energy: 0.5830044060581056
Energy: 0.5080394556513095
Energy: 0.5785679820012543
Energy: 0.5803372587441903
Energy: 0.6034571671785274
Energy: 0.7127629049307123
Energy: 0.5382018930336067
Energy: 0.5759662161733393
Energy: 0.7318972651880614
Energy: 0.5266081579280522
Energy: 0.6865571632652301
Energy: 0.6895832621154553
Energy: 0.5520836201484678
Energy: 0.672538017068256
Energy: 0.6398552099065111
Energy: 0.5883071551453221
Energy: 0.61567424337027
Energy: 0.5603373080172328
Energy: 0.5497563509314372
Energy: 0.6037098134254195
Energy: 0.545628305222696
Energy: 0.574576722524612
Energy: 0.5932057373244246
Energy: 0.4735345563005656
Energy: 0.5641986264480496
Energy: 0.542247776210538
Energy: 0.5425350871762556
Energy: 0.7361565431250098
Energy: 0.49574330587818066
Energy: 0.581890260623652
Energy: 0.625052573662701
Energy: 0.5378828437127927
Energy: 0.5735598773235527
Energy: 0.6133923019501191
Energy: 0.5970722838808958
Energy: 0.6091030684542651
Energy: 0.5722988252130614
Energy: 0.6100298829186885
Energy: 0.5972135059831131

minimum gb energy = 0.4207282688676184 eV
minimum distance =  2.24559034403922 Angstroms
sigma value = 67


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

Energy: 0.8722690369880753
Energy: 1.0021693443494732
Energy: 0.9060446000958331
Energy: 0.8387258837841832
Energy: 0.9829126253046538
Energy: 0.9199653040074308
Energy: 0.803582803906814
Energy: 0.7360358010426863
Energy: 0.7518826993482134
Energy: 0.7218605282608076
Energy: 0.7263082995346396
Energy: 0.7546464275922776
Energy: 0.8494158597372312
Energy: 0.585804265414442
Energy: 0.6399628642150865
Energy: 0.7430321902631783
Energy: 0.639259090828804
Energy: 0.6758740134033162
Energy: 0.7763554850049916
Energy: 0.7903013277457669
Energy: 0.6215508377019917
Energy: 0.7565166253832245
Energy: 0.6950922580792892
Energy: 0.6142369057024217
Energy: 0.7864349840144421
Energy: 0.7360783703494063
Energy: 0.712295796736346
Energy: 0.740423766951705
Energy: 0.7119978007737024
Energy: 0.6951312816427112
Energy: 0.6820221762090886
Energy: 0.9208544269120171
Energy: 0.6622179873198677
Energy: 0.6745589678048964
Energy: 0.929106336103814
Energy: 0.818004115508316
Energy: 0.7840998853179849
Energy: 0.6464850554664918
Energy: 0.6404028278507748
Energy: 0.7445423131229303
Energy: 0.6512825710267212
Energy: 0.6436563714650977
Energy: 0.8057317607012129
Energy: 0.5990189731872235
Energy: 0.6134988275683683
Energy: 0.8160992014418424
Energy: 0.5862079882981261
Energy: 0.658617243541614
Energy: 0.6612580103182388
Energy: 0.8290855635502838
Energy: 0.8474100396482489
Energy: 0.5666551187459918
Energy: 0.8319094089911697
Energy: 0.6076041749461796
Energy: 0.66595267710793
Energy: 0.6807838313594277
Energy: 0.7120697102894971
Energy: 0.5851373559642316
Energy: 0.6941848221137676
Energy: 0.5836378062700286
Energy: 0.6840094804888982
Energy: 0.6111212115617399
Energy: 0.581804441717426
Energy: 0.6456464335840802
Energy: 0.6487174235869954
Energy: 0.556249382573215
Energy: 0.7069626423091324
Energy: 0.6383731192070884
Energy: 0.6760893320208192
Energy: 0.686614613452377
Energy: 0.5931723005251185
Energy: 0.6685567835729166
Energy: 0.7470168638179933
Energy: 0.6188152076598691
Energy: 0.7701909363600956
Energy: 0.7353478895993856
Energy: 0.6289594895886033
Energy: 0.7557656117366229
Energy: 0.6845674320536327
Energy: 0.702986597735162
Energy: 0.6235043407886985
Energy: 0.6419448187322402
Energy: 0.8440538971170033
Energy: 0.6820946801027711
Energy: 0.6463918220157597
Energy: 0.6729896375766699
Energy: 0.6212914172756819
Energy: 0.599350500803426
Energy: 0.6698442061748912
Energy: 0.595806003434237
Energy: 0.6695795765971199
Energy: 0.7173437832365241
Energy: 0.6734426359224501
Energy: 0.5949644825065346
Energy: 0.7410055382305348
Energy: 0.6183610923803587
Energy: 0.7617008943509869
Energy: 0.6438994270816117
Energy: 0.6392556990140006
Energy: 0.7403666142878291
Energy: 0.6091052230740145
Energy: 0.6536884672648204
Energy: 0.8213570863648596
Energy: 0.5915561349106385
Energy: 0.601391323140755
Energy: 0.6899628200640932
Energy: 0.583704852380514
Energy: 0.5832314355965553
Energy: 0.8070282607690238
Energy: 0.6918772577477882
Energy: 0.8111951509969357
Energy: 0.7216734588948105
Energy: 0.8602876643600306
Energy: 0.7655209225479478
Energy: 0.6978542148247951
Energy: 0.7038066429884418
Energy: 0.7063973181957865
Energy: 0.650467841396067
Energy: 0.7370681218775078
Energy: 0.6207261383519173
Energy: 0.684213458400521
Energy: 0.6632983619332834
Energy: 0.6061435720159335
Energy: 0.6355802084681569
Energy: 0.650159696876848
Energy: 0.5752957453243164
Energy: 0.8666030509900646
Energy: 0.5928298686611522
Energy: 0.6793090893302098
Energy: 0.7499510608508797
Energy: 0.6014712170956054
Energy: 0.6764929874978831
Energy: 0.8236641500441476
Energy: 0.7093686314419362
Energy: 0.7346776691340008
Energy: 0.7621404663730762
Energy: 0.7237608340382066
Energy: 0.6490477395826911

minimum gb energy = 0.556249382573215 eV
minimum distance =  2.24415815011116 Angstroms
sigma value = 33


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

Energy: 0.7937692770612084
Energy: 1.1361162422162385
Energy: 1.0536536375418275
Energy: 0.9848460522499459
Energy: 1.137721222678205
Energy: 0.9533004816975931
Energy: 0.9748111517469797
Energy: 0.8282022591195678
Energy: 0.8513722394697505
Energy: 0.8428497648689388
Energy: 0.785618538533822
Energy: 0.7495935955096197
Energy: 0.9768599961417059
Energy: 0.7012291882510933
Energy: 0.7705663186852428
Energy: 0.8197337831973076
Energy: 0.7429804648364692
Energy: 0.7164832789499516
Energy: 0.8778295328043436
Energy: 0.7596992138837287
Energy: 0.6400537809208339
Energy: 0.8117523585480196
Energy: 0.7216359927203699
Energy: 0.6609877053134922
Energy: 0.7941761648326133
Energy: 0.7583103842269373
Energy: 0.8176883225200021
Energy: 0.8934332073157302
Energy: 0.801875373645553
Energy: 0.7888398866154974
Energy: 0.7721255300760762
Energy: 0.9918967658931912
Energy: 1.0102013993254673
Energy: 0.6714755795801651
Energy: 1.0125670480656987
Energy: 0.7693691507203163
Energy: 0.8971966009367984
Energy: 0.6856315544277516
Energy: 0.6942065348792743
Energy: 0.8329416246749627
Energy: 0.7045517079800688
Energy: 0.700891612889088
Energy: 0.9424034712152668
Energy: 0.7720573550717929
Energy: 0.7092140580613127
Energy: 0.9009903125178078
Energy: 0.6997851820841492
Energy: 0.804776488088358
Energy: 0.8066664889072471
Energy: 0.7865310814339255
Energy: 0.6895245759867552
Energy: 0.6600460854309593
Energy: 0.8540332235455125
Energy: 0.6685765675433444
Energy: 0.750555583214803
Energy: 0.8357867045408092
Energy: 0.8077396521805401
Energy: 0.6795165644250305
Energy: 0.7757466836096464
Energy: 0.6558348479976861
Energy: 0.7712151085009075
Energy: 0.7462707883239106
Energy: 0.7516897414935616
Energy: 0.6695856750346996
Energy: 0.7477133166872683
Energy: 0.8020133157853108
Energy: 0.9653420455754702
Energy: 0.7017552765580863
Energy: 0.8860159909142373
Energy: 0.8095145314962156
Energy: 0.6943301300112926
Energy: 0.8876863715819261
Energy: 0.8889222630618393
Energy: 0.6640319284938437
Energy: 0.6954867002027754
Energy: 0.7749923013959583
Energy: 0.7282989601165784
Energy: 0.905744725372472
Energy: 0.7544707663261679
Energy: 0.6732030390156685
Energy: 0.7300824175377297
Energy: 0.7176788160252967
Energy: 0.8118038371622586
Energy: 0.6687504589523543
Energy: 0.7242024193516703
Energy: 0.7987479691223432
Energy: 0.7595644651277739
Energy: 0.6753754824599651
Energy: 0.8396124156171213
Energy: 0.6854384114422384
Energy: 0.7761422567554728
Energy: 0.7989675020792378
Energy: 0.7146232245426107
Energy: 0.741663272649808
Energy: 0.8183323584089236
Energy: 0.6853856501351958
Energy: 1.0200896128913761
Energy: 0.7047219212861936
Energy: 0.7370283524880649
Energy: 0.9451427551546151
Energy: 0.7285485934034465
Energy: 0.7898232752916395
Energy: 0.9679036610064464
Energy: 0.8137525074516319
Energy: 0.7926262589319225
Energy: 0.834251313689321
Energy: 0.7847690804777366
Energy: 0.7677739109117592
Energy: 0.8264610129912796
Energy: 0.9969437742479839
Energy: 1.0337643996115584
Energy: 0.640973616585155
Energy: 1.0171702146746087
Energy: 0.9404663722606007
Energy: 0.987783670798861
Energy: 0.7879338709508694
Energy: 0.8201984211120341
Energy: 0.8938619125345096
Energy: 0.802951832475541
Energy: 0.8751136183957953
Energy: 0.9852603032675104
Energy: 0.7620731305631969
Energy: 0.6984562354494723
Energy: 0.7973275540906187
Energy: 0.7773533501685149
Energy: 0.7383535387378413
Energy: 0.8592967796251626
Energy: 0.6761820178271845
Energy: 0.6918091331143448
Energy: 0.8131135152091049
Energy: 0.7453952213692753
Energy: 0.6818399550601328
Energy: 1.0256557906444377
Energy: 0.7843943696672835
Energy: 0.7747475670517833
Energy: 0.8665388064190818
Energy: 0.8183134086529442
Energy: 0.7571140021636156
Energy: 0.9471898288083463
Energy: 1.0040846709845146
Energy: 0.9943483634569035
Energy: 0.9086103740888755
Energy: 1.016837195017876
Energy: 0.9100478177390802
Energy: 0.8829559677223187
Energy: 0.8187967035597812
Energy: 0.8069675031037434
Energy: 0.8401571212756278
Energy: 0.7192240663842473
Energy: 0.8169863532776948
Energy: 0.9126479233947427
Energy: 0.7319305390077367
Energy: 0.7206894650188898
Energy: 0.860186702145075
Energy: 0.7568742225708336
Energy: 0.7534424001398691
Energy: 0.782451654345489
Energy: 0.7272873145895876
Energy: 0.6845671947077882
Energy: 0.6791108143286434
Energy: 0.788770435506312
Energy: 0.7304198049278016
Energy: 0.738419512513509
Energy: 0.8502116698987704
Energy: 0.8070141556200514
Energy: 0.6636474928408228
Energy: 0.7977312137801124
Energy: 0.7087095333765726
Energy: 0.7516973490382196
Energy: 0.8576517240519259
Energy: 0.8622561310633645
Energy: 0.7095342479530241
Energy: 0.7359967359678184
Energy: 0.8346480815474077
Energy: 0.8995479490110637
Energy: 0.9030397796753521
Energy: 0.8986492405065206
Energy: 0.8900480550836593
Energy: 0.8111008277609708
Energy: 0.8832479982961319
Energy: 0.9044295387687785
Energy: 0.6614515810446677
Energy: 0.6600437725548335
Energy: 0.7728523822362312
Energy: 0.6843873167083804
Energy: 0.6432958005141503
Energy: 0.7501631286200702
Energy: 0.6719404639906249
Energy: 0.6605911576242676
Energy: 0.6540872955965824
Energy: 0.6902483512866792
Energy: 0.7174238557901093
Energy: 0.7289168387492607
Energy: 0.8051034642151673
Energy: 0.736090126531366
Energy: 0.6823064034556102
Energy: 0.8423993594359412
Energy: 0.7495925964413901
Energy: 0.7826378712414757
Energy: 0.793204955944921
Energy: 0.9715456889391593
Energy: 0.7079829195685557
Energy: 0.8342835860742664
Energy: 0.6923537827919231
Energy: 1.0540805389129893
Energy: 0.827071233467393
Energy: 0.7500837362054908
Energy: 0.9960156428736943
Energy: 0.7463279609415392
Energy: 0.7972259801958296
Energy: 0.9723788604745732
Energy: 0.7853339114907537
Energy: 0.7521626164668919
Energy: 0.8283452576144833
Energy: 0.774055341939531
Energy: 0.8038429887583811
Energy: 0.7773540545246095
Energy: 0.8081288923255854
Energy: 0.9060842577958307
Energy: 0.6175638494413282
Energy: 0.8430806511822267
Energy: 0.6753321047133719

minimum gb energy = 0.6175638494413282 eV
minimum distance =  2.26418210889063 Angstroms
sigma value = 41


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

Energy: 0.9146449246108931
Energy: 1.3408483057655178
Energy: 1.1755030835661706
Energy: 1.0975635138211925
Energy: 1.3548574406956628
Energy: 1.2072661260882867
Energy: 1.0930716453373945
Energy: 0.9532819654035919
Energy: 0.9578747294736742
Energy: 0.8988394184216032
Energy: 0.8952866408413
Energy: 0.9686726476056595
Energy: 1.0919808657170955
Energy: 0.8727904970441023
Energy: 0.842854079281444
Energy: 0.9928758063235582
Energy: 0.8539191741978238
Energy: 0.8671673127698936
Energy: 1.089382079924153
Energy: 0.8415953852261525
Energy: 0.9191749178123957
Energy: 0.8545374852772162
Energy: 0.831744608427769
Energy: 0.8916017943299219
Energy: 0.9461933352206807
Energy: 0.8837698779572358
Energy: 0.9058801519592597
Energy: 0.829989563137316
Energy: 0.8766115175203917
Energy: 0.9317707777419989
Energy: 0.8961042444002908
Energy: 0.9714961293797328
Energy: 1.1029505183758788
Energy: 0.8332155446774447
Energy: 0.8283302867122103
Energy: 1.1117748889119161
Energy: 1.0545006774165502
Energy: 0.9155674103047298
Energy: 0.8945975651419951
Energy: 0.9527318582993706
Energy: 0.9062246919827525
Energy: 0.9185864139702509
Energy: 1.0471138627245462
Energy: 0.8727899760708003
Energy: 1.027541095208042
Energy: 1.01222142038692
Energy: 0.8759560876421131
Energy: 1.0148753757237545
Energy: 0.9339262475815685
Energy: 0.8128654077962532
Energy: 0.8086263573501663
Energy: 0.879296163960802
Energy: 0.8777126383552306
Energy: 0.9104527771778611
Energy: 0.941940636075152
Energy: 0.9877882800896876
Energy: 1.0214495617730035
Energy: 0.8462143250807591
Energy: 0.988881261527253
Energy: 0.8465269692723956
Energy: 0.8933953709312121
Energy: 0.9825127885955617
Energy: 0.9980280276767588
Energy: 0.8090849858341079
Energy: 0.8963358217230086
Energy: 0.8729024188676083
Energy: 1.1597587522736998
Energy: 1.0569265203530138
Energy: 1.0338658875777587
Energy: 1.1077678659269692
Energy: 1.0502944544800037
Energy: 1.040326516953846
Energy: 1.131421362352676
Energy: 0.9229776618977408
Energy: 0.9004076782141066
Energy: 0.907286694996269
Energy: 0.8962434843602343
Energy: 0.8990054504640266
Energy: 0.8986539949930294
Energy: 0.8782423067781115
Energy: 1.0203820449955106
Energy: 0.8871478772753536
Energy: 0.888636013152372
Energy: 1.023137661917516

minimum gb energy = 0.8086263573501663 eV
minimum distance =  2.24652081200429 Angstroms
sigma value = 11


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

Energy: 1.5589660796888496
Energy: 0.9734499693753634
Energy: 1.3789699231297787
Energy: 1.2669364708351396
Energy: 1.6621535333356976
Energy: 1.2623576432763195
Energy: 1.3030716953764612
Energy: 0.993898752272827
Energy: 0.9416452206428607
Energy: 0.9692620084687807
Energy: 0.9558298280380495
Energy: 0.9558075021821861
Energy: 1.3244463805082174
Energy: 0.9630051091149566
Energy: 1.109899691376957
Energy: 1.1565103330517312
Energy: 0.9617768071824034
Energy: 1.1233508050520462
Energy: 1.084994041496933
Energy: 0.9555947971782509
Energy: 0.9732581100731946
Energy: 0.9418017905567602
Energy: 0.8937754607708194
Energy: 0.9523546285231788
Energy: 1.0673149790601295
Energy: 1.0357992522866741
Energy: 1.03192267712816
Energy: 0.9480997697444237
Energy: 0.9788185707846472
Energy: 0.9754575313690572
Energy: 1.0706400258604245
Energy: 1.0327724821257285
Energy: 1.095933609908395
Energy: 0.9509570371236008
Energy: 1.0426061113673701
Energy: 1.0954995126988691
Energy: 1.1860378256882473
Energy: 1.11852009600235
Energy: 1.0997921362041576
Energy: 0.9720649847737322
Energy: 1.0379483350965366
Energy: 1.0760623980027801
Energy: 1.1885463205792852
Energy: 0.9359674674131875
Energy: 0.9505506448406601
Energy: 0.9785695040969121
Energy: 0.9288144753321879
Energy: 0.9502206267435912
Energy: 1.0597970207299008
Energy: 0.9389751627657346
Energy: 0.9721791315893119
Energy: 0.9587569722566577
Energy: 0.9577554116290087
Energy: 0.9673688949025321
Energy: 1.0549624192373313
Energy: 1.0621734047677391
Energy: 1.033713554880364
Energy: 0.8875188728643164
Energy: 1.0550701122469601
Energy: 1.0443893308675558
Energy: 1.114031861603091
Energy: 0.9585343869705194
Energy: 0.952824855128485
Energy: 0.9976830197585052
Energy: 0.9194881035810647
Energy: 0.9377030364907213
Energy: 1.1975106593865745
Energy: 1.320196791559085
Energy: 1.3137453783568902
Energy: 0.915969572471459
Energy: 1.1652710302042228
Energy: 1.4253924868263903
Energy: 1.094875260297166
Energy: 0.9682131169628643
Energy: 1.0105150378186736
Energy: 0.9333529955517446
Energy: 0.9270734274554309
Energy: 0.9760652312469289
Energy: 1.0642983880907886
Energy: 1.2132372023071398
Energy: 1.2141368250225701
Energy: 1.0246109062107103
Energy: 1.205487688279398
Energy: 1.2073011186957072
Energy: 1.0701111936240544
Energy: 0.9452907000572108
Energy: 0.948858474304305
Energy: 0.9827907138391255
Energy: 0.9385365081168264
Energy: 0.9544807945966396
Energy: 1.1754284320853692
Energy: 0.9268086780883347
Energy: 0.9877718019701879
Energy: 0.9574778286366964
Energy: 0.9215585590821173
Energy: 1.058088582552962
Energy: 1.1241419217475799
Energy: 1.0358707732641381
Energy: 0.9664633454734958
Energy: 0.9558330041637706
Energy: 0.9324107552955977
Energy: 0.998279592394796
Energy: 1.2636828038458467
Energy: 1.1421856567458624
Energy: 1.1557838403163978
Energy: 1.179052308638921
Energy: 1.0739567583832212
Energy: 1.1664964140598912
Energy: 1.1461494042529121
Energy: 0.9345088045311686
Energy: 0.9527779081236808
Energy: 0.9407686670153957
Energy: 1.00548667062831
Energy: 0.9314210846762867
Energy: 1.054423040322912
Energy: 1.0876086799442402
Energy: 1.1138093346251332
Energy: 0.9250168811351679
Energy: 0.9850035641643898
Energy: 0.9524341368990912
Energy: 1.1814669688720385
Energy: 0.9654095428011593
Energy: 1.0114110351379861
Energy: 1.0841354061397885
Energy: 0.9420705130097854
Energy: 0.9502906490969862
Energy: 1.1045530971467241
Energy: 0.9680233275626888
Energy: 0.9081564073213553
Energy: 0.9392351442033763
Energy: 0.997201360187732
Energy: 0.9425452442208292
Energy: 1.079130052408348
Energy: 0.955127059531423
Energy: 1.0441069824510616
Energy: 0.9428829019588657
Energy: 0.9189327292391694
Energy: 1.0323302430684567
Energy: 1.2338083278316474
Energy: 0.9660770971119387
Energy: 0.927357433527856
Energy: 1.000352861530915
Energy: 0.9241407159735058
Energy: 0.9189068414261824
Energy: 1.2517289457080178
Energy: 1.1884872034058567
Energy: 1.1749573964258508
Energy: 1.136145135647271
Energy: 1.1122727658157283
Energy: 1.1716005765022233
Energy: 1.0685990428026013
Energy: 0.9999451899399178
Energy: 0.9930290560223946
Energy: 0.9357351630247882
Energy: 1.0032818031964543
Energy: 0.985515253316157
Energy: 1.0698637877078336
Energy: 1.0041036312643368
Energy: 1.0300329533613768
Energy: 0.9129731125482823
Energy: 0.9765506890031495
Energy: 1.0238829245069492
Energy: 1.0714180393649029
Energy: 1.0173038029022479
Energy: 0.9859177194844227
Energy: 0.9597568936054133
Energy: 0.994624077658788
Energy: 0.9488592001596071
Energy: 1.3367491560062046
Energy: 1.197915802810485
Energy: 1.2035421305318221
Energy: 1.1976751402187578
Energy: 0.9668153628961837
Energy: 1.199617859792724
Energy: 1.311502651693643
Energy: 0.9334947625026125
Energy: 0.9566280077953797
Energy: 0.9006676586143879
Energy: 0.9371446337676789
Energy: 0.9995776747733299
Energy: 1.1201690606023063
Energy: 0.9647672412126399
Energy: 0.9889535750458083
Energy: 0.9963521087780213
Energy: 0.9533199038542842
Energy: 1.004573869266036

minimum gb energy = 0.8875188728643164 eV
minimum distance =  2.24103190201563 Angstroms
sigma value = 57


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

Energy: 1.7756503264554349
Energy: 1.721528329581884
Energy: 1.2560046896569421
Energy: 1.2649223742373428
Energy: 1.7175284279667051
Energy: 1.2604032702059342
Energy: 1.416671482676653
Energy: 1.1596325471219424
Energy: 1.0843332624187436
Energy: 1.072698767391294
Energy: 1.1233607818372353
Energy: 1.0609102919250448
Energy: 1.3207570087030915
Energy: 1.1628718902728543
Energy: 1.2371304721463217
Energy: 1.1601658914765078
Energy: 1.1475298798115479
Energy: 1.1517836492612648
Energy: 1.1309181475804508
Energy: 1.1248967142925346
Energy: 1.1061242045530788
Energy: 1.0382384156613966
Energy: 1.0148068660497493
Energy: 1.09283366171899
Energy: 1.1093105337224016
Energy: 1.1838119656906878
Energy: 1.1797811902591482
Energy: 0.990219761789947
Energy: 1.099746697179601
Energy: 1.102226225352548
Energy: 1.137105015102599
Energy: 1.068592234498559
Energy: 1.0909667988318168
Energy: 1.0011443428250646
Energy: 1.1590772823983746
Energy: 1.1719156333642002
Energy: 1.3627227316149182
Energy: 1.1025317966414725
Energy: 1.0893372008025162
Energy: 1.1746012567596513
Energy: 1.117891420169134
Energy: 1.151331721054889
Energy: 1.3035144072106142
Energy: 1.0342003912191995
Energy: 1.0875252436385787
Energy: 1.002214613892283
Energy: 1.127461786834944
Energy: 1.042820160439264
Energy: 1.1586779437767007
Energy: 1.0164038124487877
Energy: 1.1482200736729282
Energy: 1.0111480302497413
Energy: 1.0683113051535549
Energy: 1.1533130382025973
Energy: 1.1532103710404653
Energy: 1.1000247906542955
Energy: 1.129064462445429
Energy: 1.0124551077410835
Energy: 1.087140158088815
Energy: 1.1237577858455594
Energy: 1.2610763276201835
Energy: 1.1126882453019142
Energy: 1.0958230741312067
Energy: 1.038924826741106
Energy: 1.1266978647352577
Energy: 1.0822601801873928
Energy: 1.3016619119987862
Energy: 1.2178718635398904
Energy: 1.1856665721649906
Energy: 1.2258745688700776
Energy: 1.1639723340658132
Energy: 1.1932638906264639
Energy: 1.1184914411564326
Energy: 1.0525319411968446
Energy: 1.08440064348972
Energy: 1.007801358467049
Energy: 1.1441263054177275
Energy: 1.0830418210854988
Energy: 1.1453248687544755
Energy: 1.160446119963708
Energy: 1.2032307868977012
Energy: 1.1363350646820136
Energy: 1.1647799790397062
Energy: 1.2337027202040547
Energy: 1.219948682463182
Energy: 1.004184143634058
Energy: 1.0574220718345515
Energy: 1.0589063590477874
Energy: 0.9940990504433036
Energy: 1.046127376147796
Energy: 1.321795860347226
Energy: 1.1137736191199124
Energy: 1.0977992540329764
Energy: 1.1369908936168605
Energy: 0.9989426479213067
Energy: 1.1793302674982116
Energy: 1.2336398122760386
Energy: 1.0369006553235856
Energy: 1.0998454007339622
Energy: 1.0711420719714355
Energy: 1.0240264901634162
Energy: 1.073262292971546

minimum gb energy = 0.990219761789947 eV
minimum distance =  2.25063979743113 Angstroms
sigma value = 9


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

Energy: 1.95428708050381
Energy: 1.6390537507658354
Energy: 1.5882559679580648
Energy: 1.4612328651108901
Energy: 1.6628719574324313
Energy: 1.0975614302167207
Energy: 1.466114142196642
Energy: 1.0418036852202806
Energy: 1.0464716744397953
Energy: 1.0297232348400915
Energy: 1.0326654167608655
Energy: 1.0638013705576959
Energy: 1.3673465369970788
Energy: 1.1424347429480934
Energy: 1.0690155413239408
Energy: 1.086849826806873
Energy: 1.0494649110757854
Energy: 1.166653082474135
Energy: 1.1642984509069785
Energy: 1.0307401285942452
Energy: 1.0051382874814192
Energy: 0.947732265728272
Energy: 1.018344304719177
Energy: 0.9832522953571327
Energy: 1.2429850033599954
Energy: 1.0648358264777007
Energy: 1.0913850590216896
Energy: 1.0156788735949511
Energy: 1.1430689627551
Energy: 1.065147767970902
Energy: 1.1162790988903093
Energy: 1.0155829979314657
Energy: 1.044080464895457
Energy: 0.9863272203460453
Energy: 1.0172476296224082
Energy: 1.002936829289211
Energy: 1.3143777992997736
Energy: 1.2463621287037134
Energy: 1.047301911551409
Energy: 1.0336632952061116
Energy: 1.2529148894064457
Energy: 1.0214137308298479
Energy: 1.2845165193428398
Energy: 1.0065875717154253
Energy: 1.042680095368961
Energy: 0.9747123754347973
Energy: 0.99628076352899
Energy: 1.0089876578238333
Energy: 1.222133960367592
Energy: 1.0402436916176498
Energy: 1.073161330832923
Energy: 1.0089067443626794
Energy: 1.0432608045796825
Energy: 1.0628377942957088
Energy: 1.2252267281087874
Energy: 1.0327499188467817
Energy: 1.0547829419535086
Energy: 1.0383665026027966
Energy: 1.0188351965799418
Energy: 1.0869316400160358
Energy: 1.352491602384766
Energy: 1.0271535334489312
Energy: 1.0057387496260464
Energy: 1.0597734621215453
Energy: 1.015388907043836
Energy: 1.1073704105650963
Energy: 1.2805161794977078
Energy: 1.0062169397964882
Energy: 1.0214582713090088
Energy: 1.079285848535442
Energy: 0.9959574779298096
Energy: 1.0340043790372695
Energy: 1.428461677134449
Energy: 1.0378710865922052
Energy: 1.1082671441270717
Energy: 1.0197533738577358
Energy: 1.0466921970133252
Energy: 1.06946720072538
Energy: 1.2266092085229887
Energy: 1.0841407116762818
Energy: 1.021931602178796
Energy: 1.0405733710699048
Energy: 1.0263354143653654
Energy: 1.0748302453603358
Energy: 1.2262448832706543
Energy: 1.0788187075922475
Energy: 1.0622619392189883
Energy: 1.0361442753979826
Energy: 1.0607208351430408
Energy: 1.1153962957753538
Energy: 1.2753766626807492
Energy: 1.0699794237974058
Energy: 1.0861584280308345
Energy: 1.0918045567592147
Energy: 1.0458415956111191
Energy: 1.0690310948004504
Energy: 1.1946824274288357
Energy: 1.0840507925116138
Energy: 1.0464092572349035
Energy: 1.030200805481449
Energy: 1.050046217986596
Energy: 1.086260425033211
Energy: 1.3846848966349548
Energy: 1.1475403550574317
Energy: 1.2213913907472778
Energy: 1.096150952010563
Energy: 1.0723306506645796
Energy: 1.2131662268013457
Energy: 1.2701163913736775
Energy: 1.0145345781570856
Energy: 1.0568839551123477
Energy: 1.0045247970911413
Energy: 1.0607063096250686
Energy: 1.0594020775315989
Energy: 1.433345387654812
Energy: 1.0225057740829546
Energy: 1.1114176336530457
Energy: 1.0797599482268279
Energy: 1.0516055347188225
Energy: 1.1160318760366579
Energy: 1.2054021360439042
Energy: 1.056378210218751
Energy: 1.0587532901909682
Energy: 1.0028985293270036
Energy: 1.0709998412294968
Energy: 1.1152828898661324

minimum gb energy = 0.947732265728272 eV
minimum distance =  2.23861849446939 Angstroms
sigma value = 27


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

Energy: 2.0290965329794353
Energy: 1.7730675686162112
Energy: 0.980813212892845
Energy: 1.6412705308211482
Energy: 1.7883493432721216
Energy: 1.1800639649263829
Energy: 1.4816762745133507
Energy: 1.1313961200865177
Energy: 1.0210240027988553
Energy: 1.0170107512246191
Energy: 1.13874873490134
Energy: 1.0476960273921032
Energy: 1.3134058796496262
Energy: 1.1651690106870252
Energy: 1.1885690458526574
Energy: 1.2222244839218321
Energy: 1.20925353938438
Energy: 1.2437559836935337
Energy: 1.2948937611554214
Energy: 1.0946706264232708
Energy: 1.0300645123009404
Energy: 1.040236268686108
Energy: 1.130055028903509
Energy: 1.058079668953079
Energy: 1.2234242064013892
Energy: 1.1655409152792549
Energy: 1.1093324543621328
Energy: 1.137073048121553
Energy: 1.1660538892148675
Energy: 1.246055960464465
Energy: 1.1732122148713973
Energy: 1.1012369548116452
Energy: 1.034383317797599
Energy: 1.0459041136340728
Energy: 1.1069316815176857
Energy: 0.9964918020067115
Energy: 1.248479871536647
Energy: 1.0633139231206348
Energy: 1.0449652335472557
Energy: 1.0660933395988317
Energy: 1.0645761298269398
Energy: 1.0280969429001885
Energy: 1.314503214343466
Energy: 1.019518593907211
Energy: 1.0330720231415074
Energy: 1.030187092003179
Energy: 0.9983991873793852
Energy: 0.9929299857550888
Energy: 1.4775483285375892
Energy: 1.0996614984168158
Energy: 1.0945814975346568
Energy: 1.2468719130943269
Energy: 1.094423684056129
Energy: 1.0658686077424984
Energy: 1.4279393163046612
Energy: 1.0354368112732069
Energy: 1.08009557358676
Energy: 1.1221592049133011
Energy: 1.0074462716092256
Energy: 1.0338567220117605
Energy: 1.5635801732463879
Energy: 1.2329630341901807
Energy: 1.2226753163124198
Energy: 1.071390394228045
Energy: 1.0767379179517969
Energy: 1.2385270090761376
Energy: 1.2844137410950505
Energy: 0.9722152861715471
Energy: 0.9498995163132208
Energy: 1.0658902452218517
Energy: 0.9821954452332273
Energy: 0.9865558064564913
Energy: 1.2192536222367725
Energy: 1.0104849993067553
Energy: 1.0146563271953493
Energy: 1.0106007596478723
Energy: 1.078989056179181
Energy: 1.0255242580266561
Energy: 1.2009667534017314
Energy: 1.067227956013973
Energy: 1.0804705180536731
Energy: 1.04474651921312
Energy: 1.0627509122347514
Energy: 1.0123195713654147
Energy: 1.2284388359255267
Energy: 1.095818943176479
Energy: 1.0049452422385845
Energy: 1.0228900792170068
Energy: 1.1212128967842225
Energy: 1.0645538708551672
Energy: 1.3160458759494937
Energy: 1.1739461461305578
Energy: 1.076746070669233
Energy: 1.0682506688418616
Energy: 1.1720004813337224
Energy: 1.0833678673034437
Energy: 1.222603504150048
Energy: 1.1200197115566572
Energy: 1.0119125936296147
Energy: 1.0751423679641436
Energy: 1.0869880355961885
Energy: 1.0524664069556728
Energy: 1.2220424453212995
Energy: 1.019228087246495
Energy: 1.097673053819701
Energy: 1.0108273730383674
Energy: 1.1119168801933441
Energy: 1.0453634850470388
Energy: 1.26772242355134
Energy: 1.025102656336115
Energy: 1.0256959183137966
Energy: 1.0604087304088272
Energy: 1.0271881220624903
Energy: 0.9984769284168055
Energy: 1.3142660342217356
Energy: 1.0232848481199983
Energy: 1.0162251862370548
Energy: 1.0421528110958125
Energy: 1.0250776423876262
Energy: 1.0199557035722129
Energy: 1.5557193391586484
Energy: 1.0227388967706055
Energy: 1.13316321353442
Energy: 1.067405290531012
Energy: 1.0094432450601658
Energy: 1.210613604099102
Energy: 1.368438476089057
Energy: 1.119679360910671
Energy: 1.1910806761332762
Energy: 1.2155749371587974
Energy: 1.0333889636205302
Energy: 1.0610716583557314
Energy: 1.4420761514423672
Energy: 1.1143422247208692
Energy: 1.1029471895807692
Energy: 1.1756127146041895
Energy: 1.118953962550507
Energy: 1.138467057038292
Energy: 1.396469502382467
Energy: 1.0650326227771616
Energy: 1.2232635979038249
Energy: 1.1623936235398409
Energy: 1.0117605979003388
Energy: 1.213212057098141
Energy: 1.2823922420221265
Energy: 1.0289911227714361
Energy: 1.0644954377109532
Energy: 1.0499203593650313
Energy: 1.0946605005647934
Energy: 1.0525195519503696

minimum gb energy = 0.9498995163132208 eV
minimum distance =  2.22416741073479 Angstroms
sigma value = 19


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

Energy: 2.092670627489733
Energy: 1.0172381899106302
Energy: 1.0143932778691354
Energy: 1.0557284626437788
Energy: 0.9179044200562689
Energy: 1.013732282027464
Energy: 1.5283232277192336
Energy: 0.9803832748857345
Energy: 0.9722335289877782
Energy: 1.0270200638398972
Energy: 0.9466965388072429
Energy: 1.0326175390452144
Energy: 1.3945680323163199
Energy: 1.016127324132698
Energy: 1.0255388821090166
Energy: 0.9700793675159038
Energy: 0.970059307124791
Energy: 1.0011538605454438
Energy: 1.12367394099795
Energy: 0.9573208287341688
Energy: 0.9506460329489955
Energy: 0.9606126389070607
Energy: 0.9620853489429502
Energy: 0.9312346780630658
Energy: 1.3232462083065504
Energy: 1.0800401109831061
Energy: 1.0913980493487803
Energy: 0.9545118841210681
Energy: 1.0115982412766393
Energy: 0.9303445292739609
Energy: 1.1641949323578447
Energy: 1.0156370152270475
Energy: 1.0016740177542802
Energy: 0.9679050118052908
Energy: 1.0012730254349012
Energy: 0.9735366784492434
Energy: 1.2459238194126194
Energy: 0.9753592760710691
Energy: 1.0412587989033681
Energy: 0.9596482344563244
Energy: 1.0078793667684591
Energy: 0.958824900342219
Energy: 1.0993448240280042
Energy: 1.0316810356935284
Energy: 0.9873390282546902
Energy: 0.8991041838963498
Energy: 1.029948043333475
Energy: 1.0024607380453807
Energy: 1.1056910359779788
Energy: 1.0229171910495027
Energy: 1.0137607024815083
Energy: 0.9185224782493597
Energy: 0.9583564230325713
Energy: 0.9630867876907704
Energy: 1.0921630601948351
Energy: 0.9126112919200847
Energy: 0.8770902851641614
Energy: 0.9205569895483339
Energy: 0.8953063922324731
Energy: 0.9150962917099985
Energy: 1.2579477062208515
Energy: 1.3579612454383871
Energy: 1.270746875568268
Energy: 0.9476033568406552
Energy: 0.8988064346046012
Energy: 1.2609155338533946
Energy: 1.3030280325182737
Energy: 1.0050883380617768
Energy: 1.0066069332231031
Energy: 1.0085568709269959
Energy: 1.0125664922125381
Energy: 1.0347894305572827
Energy: 1.2513456076343985
Energy: 0.9403125100927117
Energy: 1.0179124156316983
Energy: 0.9530615028113266
Energy: 0.9101386876681823
Energy: 0.988364919859921
Energy: 1.2496889436539007
Energy: 0.8918449935050001
Energy: 0.8923698027875885
Energy: 1.040247920503648
Energy: 0.9104863487421248
Energy: 1.0774422660956633
Energy: 1.4306228987256628
Energy: 0.9882040119104525
Energy: 0.9698908116228366
Energy: 1.0153312773241987
Energy: 0.9424586957899674
Energy: 1.0167111366785067
Energy: 1.351713031280596
Energy: 0.913476749156802
Energy: 0.9170543818432211
Energy: 0.9392985154109417
Energy: 0.8957081814008625
Energy: 0.9515986208032162
Energy: 1.2756886717052422
Energy: 0.90722041300169
Energy: 0.9822015568281333
Energy: 0.9146021193897356
Energy: 0.9596295639362737
Energy: 0.9119997874933384
Energy: 1.2092359895577365
Energy: 0.9864919893180448
Energy: 0.8869333343575734
Energy: 1.040108961925143
Energy: 0.9790787004328604
Energy: 1.0284862279540556
Energy: 1.245900314623832
Energy: 0.990111305890171
Energy: 0.9785438728440874
Energy: 0.9242508190096484
Energy: 1.0016562011263455
Energy: 1.0092781519035896
Energy: 1.2171167665479277
Energy: 0.9907158439847223
Energy: 0.9313694229376871
Energy: 0.9665604476419036
Energy: 0.9894838057117202
Energy: 0.9867229182102129
Energy: 1.1374182846512453
Energy: 0.9739405790971367
Energy: 0.9556033721366959
Energy: 0.982062548843943
Energy: 0.8975758819235874
Energy: 0.9842137897991942
Energy: 1.1066172734687865
Energy: 0.9735343675442676
Energy: 0.947366166931798
Energy: 0.9092259213497829
Energy: 1.0073569471528707
Energy: 0.9103492924916462
Energy: 1.151510746529463
Energy: 0.9940315072786132
Energy: 0.9799940286127733
Energy: 0.8969163046727744
Energy: 0.9652865943508312
Energy: 0.9563311724288563
Energy: 1.1708109317081221
Energy: 0.9982655012730377
Energy: 1.0071891392168986
Energy: 0.9237535197695748
Energy: 0.987702485130343
Energy: 0.995902303453024
Energy: 1.2179626126823324
Energy: 1.0001360139528064
Energy: 0.9850931274360522
Energy: 0.9910333861721549
Energy: 1.000429977374712
Energy: 0.9485808741283459
Energy: 1.1809488321003063
Energy: 0.9761892251711572
Energy: 0.9272282309953165
Energy: 0.9625144511065056
Energy: 0.9678225862863744
Energy: 0.9388752810734041
Energy: 1.2492122135792494
Energy: 0.9386694721824841
Energy: 0.9294904658951553
Energy: 0.8971808142501513
Energy: 0.9331352032014172
Energy: 0.9306580329006077
Energy: 1.4459630690604317
Energy: 0.9589520822241872
Energy: 0.9340725439366943
Energy: 1.0162024310560487
Energy: 0.941233724565778
Energy: 0.9018808228074174
Energy: 1.2165553936108504
Energy: 0.9161688630413047
Energy: 0.9074069268675703
Energy: 0.9991113335816529
Energy: 0.9173865608678827
Energy: 0.9567222167577746

minimum gb energy = 0.8770902851641614 eV
minimum distance =  2.23856035435097 Angstroms
sigma value = 101


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

Energy: 1.9099971277719991
Energy: 1.767817898365033
Energy: 1.0885558528110415
Energy: 1.6971233761122482
Energy: 1.7369617459531634
Energy: 1.5434753907296115
Energy: 1.4067084563462349
Energy: 0.9828764107512092
Energy: 0.9676609877593073
Energy: 1.0374770343869255
Energy: 0.9975514587268332
Energy: 1.0506254180102228
Energy: 1.3534477124579294
Energy: 0.8611491873834503
Energy: 0.9326109058054826
Energy: 0.9776119629804577
Energy: 0.9046679916845171
Energy: 0.9592321957319091
Energy: 1.1017297188997812
Energy: 0.9045686488284936
Energy: 0.8926423310373555
Energy: 0.9347980456094438
Energy: 0.9168310586771647
Energy: 0.8700250562586859
Energy: 1.2313761959230665
Energy: 0.9755385862398102
Energy: 0.982936516576082
Energy: 1.013707775607017
Energy: 0.9681872859924321
Energy: 0.8816435317506361
Energy: 1.1048072070961505
Energy: 0.9663519789028768
Energy: 0.9004103788707566
Energy: 0.9160946279840757
Energy: 1.020017471799403
Energy: 0.9217859405843114
Energy: 1.2033207565295652
Energy: 0.8325683578546631
Energy: 1.1374353308933745
Energy: 1.0243729917428048
Energy: 0.9068144002123498
Energy: 1.0015105442137067
Energy: 1.1030972172785882
Energy: 0.9430305482441657
Energy: 0.8740120100933034
Energy: 0.8724282019310018
Energy: 0.9993111162642039
Energy: 0.9114435806547946
Energy: 1.1492699201010657
Energy: 0.861733451960808
Energy: 0.9280155204233743
Energy: 0.8773282283098891
Energy: 1.0223516465940268
Energy: 0.9564173416707753
Energy: 1.0696357463403106
Energy: 0.8921085648473607
Energy: 0.893380986577773
Energy: 0.8566553034093224
Energy: 0.902763711344668
Energy: 0.8689059080301232
Energy: 1.519622105909178
Energy: 0.8753343251477208
Energy: 1.450125828517019
Energy: 1.0354517760421922
Energy: 0.8468918459881684
Energy: 1.4506354154622605
Energy: 1.2235550186241002
Energy: 1.0101901972847551
Energy: 1.0133249507175577
Energy: 0.9927181765020316
Energy: 1.0206027514142437
Energy: 1.0103118633171755
Energy: 1.1519872667582265
Energy: 0.9776225806618771
Energy: 1.00865008782311
Energy: 0.9064061733583725
Energy: 0.9682359713472608
Energy: 0.8909913523803901
Energy: 1.096458975256344
Energy: 0.9173029059791616
Energy: 0.9306517178028862
Energy: 0.9194737092124615
Energy: 0.9055819084186634
Energy: 0.9696278334401216
Energy: 1.389097498903097
Energy: 0.9462501449475329
Energy: 0.8681974992747996
Energy: 0.8926703453681053
Energy: 1.0280068230609913
Energy: 1.0609053130993145
Energy: 1.3645207054940658
Energy: 0.8746724761758251
Energy: 0.9434739437158589
Energy: 0.9594012593909853
Energy: 0.8572498021207593
Energy: 0.8638222875866066
Energy: 1.144181166400661
Energy: 0.9535090456238688
Energy: 0.9959816405910562
Energy: 0.8782489484742368
Energy: 0.950593529651697
Energy: 0.9989760045325299
Energy: 1.2491873565043525
Energy: 1.0300720886124246
Energy: 1.0417806816417574
Energy: 1.0925608876468371
Energy: 1.0018501228501777
Energy: 1.0511809589712118
Energy: 1.3438350218579052
Energy: 0.9257130443022851
Energy: 0.9381826927140408
Energy: 0.930546904985131
Energy: 0.9336920491394607
Energy: 1.0012806199074085
Energy: 1.1922506693676898
Energy: 0.9218662622061535
Energy: 0.9237037192331946
Energy: 0.9427246515458969
Energy: 0.9084943975340749
Energy: 0.8885777069386117
Energy: 1.159969604495128
Energy: 1.032952638700345
Energy: 0.9167352790962299
Energy: 1.0421865215116717
Energy: 0.9312217484109272
Energy: 0.8742993623217014
Energy: 1.117595095511737
Energy: 0.9915036424841907
Energy: 0.8866739480918223
Energy: 0.9433405493760361
Energy: 0.9830292212217977
Energy: 0.9242667436783497
Energy: 1.1888866783141663
Energy: 0.9265779309508716
Energy: 1.0293132263609897
Energy: 0.9684108479888245
Energy: 0.9631372732701015
Energy: 1.0197890913123322
Energy: 1.1117621450764406
Energy: 1.0099112257150045
Energy: 1.0126499974165064
Energy: 0.8584104363145244
Energy: 0.9774449281721732
Energy: 0.9025132281018374
Energy: 1.0835778669820424
Energy: 0.9046739948222279
Energy: 0.8884043875008891
Energy: 0.8798045150977102
Energy: 0.9295460113913152
Energy: 0.8601948508908983
Energy: 1.0879569932994841
Energy: 0.8966260466266027
Energy: 0.9185695775663139
Energy: 0.8529132306853444
Energy: 0.9278304929551809
Energy: 0.8278328782799951
Energy: 1.2821813001510771
Energy: 0.8756712083791066
Energy: 0.9288938744247516
Energy: 0.9740614105145465
Energy: 0.8883528911105775
Energy: 0.882572155195066
Energy: 1.318620671144999
Energy: 0.9591735618684526
Energy: 0.9722208563928908
Energy: 1.013578443893483
Energy: 0.9531828321141333
Energy: 0.9722488146852013
Energy: 1.095381348514879
Energy: 0.9934185102510049
Energy: 0.9814551515967815
Energy: 0.9263823957082741
Energy: 0.9791539315874805
Energy: 0.8824938216807615
Energy: 1.0936445912393993
Energy: 0.9145235452837623
Energy: 0.9307652686157829
Energy: 0.9071774709771908
Energy: 0.9871512650198611
Energy: 0.9344192332783308
Energy: 1.2292598045956533
Energy: 0.8871494882830738
Energy: 0.899361180773941
Energy: 0.9344020219654179
Energy: 0.8649595181167552
Energy: 0.8749366419928395
Energy: 1.3511494993005124
Energy: 0.8581375397505738
Energy: 0.8504268735460982
Energy: 0.9514508142472828
Energy: 0.8564241374379118
Energy: 0.9075276948319576
Energy: 1.133652235052348
Energy: 0.932586580268891
Energy: 0.9513523970541516
Energy: 0.9734621998372461
Energy: 0.9427079744431612
Energy: 1.1093333349347303

minimum gb energy = 0.8278328782799951 eV
minimum distance =  2.24153697788351 Angstroms
sigma value = 33


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

Energy: 0.01852669231697116
Energy: 1.7594924505238598
Energy: 0.11180410896285214
Energy: 0.02075417265219372
Energy: 1.7662301601711154
Energy: 0.019127245383167277
Energy: 0.4456977088500126
Energy: 0.24005467636210467
Energy: 0.18773409563037013
Energy: 0.17909143131617947
Energy: 0.1716557938569883
Energy: 0.2936630718990614
Energy: 1.5175906683585185
Energy: 1.3003624853146143
Energy: 1.3579233517253761
Energy: 1.2744292338961467
Energy: 1.4010506533036813
Energy: 1.26880253432563
Energy: 0.01919265611248697
Energy: 0.24005032314582228
Energy: 0.1959421302515316
Energy: 0.17909474851011253
Energy: 0.23011973328449192
Energy: 0.29366369190344876

minimum gb energy = 0.01852669231697116 eV
minimum distance =  2.26275538059414 Angstroms
sigma value = 1