Model name: model_name=EAM_Dynamo_AcklandBaconCalder_1997_Fe__MO_142799717516_005
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=3.680044695734978
cohesive_energy=4.26217454226904
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

========================================
theta = 0.0
========================================

Energy: 0.01590645518232507
Energy: 1.6034265310094766
Energy: 0.01590645518232507
Energy: 1.603426531009174
Energy: 0.01590645518232507
Energy: 1.6034265310094766
Energy: 1.6034265310094766
Energy: 1.3020675357995288
Energy: 1.6034265310097793
Energy: 1.3020675357983518
Energy: 1.6034265310097793
Energy: 1.381761491032352
Energy: 0.01590645518232507
Energy: 1.6034265310097793
Energy: 0.01590645518232507
Energy: 1.603426531009174
Energy: 0.01590645518232507
Energy: 1.6034265310097793
Energy: 1.6034265310097793
Energy: 1.302067535799226
Energy: 1.6034265310094766
Energy: 1.302067535799226
Energy: 1.6034265310094766
Energy: 1.381761491032352
Energy: 0.01590645518232507
Energy: 1.6034265310097793
Energy: 0.01590645518232507
Energy: 1.6034265310094766
Energy: 0.01590645518232507
Energy: 1.6034265310097793
Energy: 1.6034265310094766
Energy: 1.3817614910320828
Energy: 1.6034265310094766
Energy: 1.3817614910326543
Energy: 1.6034265310097793
Energy: 1.381761491032957

minimum gb energy = 0.01590645518232507 eV
minimum distance =  2.45548430703083 Angstroms
sigma value = 1


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

Energy: 1.4606908299832109
Energy: 1.251399447338048
Energy: 1.4606908299839394
Energy: 1.251399447334406
Energy: 1.4606908299824826
Energy: 1.2513994473365913
Energy: 1.6990169781762112
Energy: 1.097046928322219
Energy: 1.6990169781776683
Energy: 1.0970469283236761
Energy: 1.6990169781754827
Energy: 1.0970469283236761
Energy: 1.391996333051556
Energy: 1.4909887260168202
Energy: 1.3919963330522842
Energy: 1.4909887260139063
Energy: 1.3919963330500988
Energy: 1.490988726006622
Energy: 1.5130846680904257
Energy: 1.2213675002243154
Energy: 1.513084668088969
Energy: 1.2213675002235869
Energy: 1.513084668088969
Energy: 1.2213675002235869
Energy: 1.3211003400003754
Energy: 1.4625419761663925
Energy: 1.3211003400003754
Energy: 1.4625419761642073
Energy: 1.3211003400011039
Energy: 1.4625419761663925
Energy: 1.450323196134346
Energy: 1.1958022530344468
Energy: 1.4503231961350742
Energy: 1.1958022530351753
Energy: 1.450323196136531
Energy: 1.1958022530366321
Energy: 1.2146202361051066
Energy: 1.4099673542890119
Energy: 1.214620236102193
Energy: 1.4099673542919253
Energy: 1.2146202361036498
Energy: 1.4099673542832505
Energy: 1.2150924186215777
Energy: 1.5325904638842844
Energy: 1.215092418622306
Energy: 1.5325904638879266
Energy: 1.215092418620849
Energy: 1.5325904638813708
Energy: 1.4284808101920536
Energy: 1.413578141248314
Energy: 1.4284808101920536
Energy: 1.4135781412461284
Energy: 1.4284808101913253
Energy: 1.4135781412475852
Energy: 1.0997650068187828
Energy: 1.5032250108014251
Energy: 1.0997650068187828
Energy: 1.5032248666598258
Energy: 1.0997650068158689
Energy: 1.5032246135470164
Energy: 1.3357875135747734
Energy: 1.205233508303222
Energy: 1.3357875135740451
Energy: 1.205233508303222
Energy: 1.3357875135740451
Energy: 1.2052335083024937
Energy: 1.0471650482275843
Energy: 1.84349530832181
Energy: 1.047165048226856
Energy: 1.8434953083203531
Energy: 1.047165048225399
Energy: 1.8434953083210814
Energy: 1.5949406490030387
Energy: 1.0139683501282204
Energy: 1.594940648990655
Energy: 1.0139683501282204
Energy: 1.5949406489782718
Energy: 1.013968350128949
Energy: 1.2394383297870473
Energy: 1.2088593491087765
Energy: 1.2394383297863187
Energy: 1.2088593491080477
Energy: 1.2394383297863187
Energy: 1.2088593491044055
Energy: 1.618404706290483
Energy: 1.1116042927787506
Energy: 1.618404706290483
Energy: 1.1116042927787506
Energy: 1.6184047062919396
Energy: 1.111604292778022
Energy: 1.6202513977561774
Energy: 1.3963589879371934
Energy: 1.6202513977561774
Energy: 1.3963589879335512
Energy: 1.6202513977554487
Energy: 1.396358987958252
Energy: 1.3792899322281524
Energy: 1.317146052114074
Energy: 1.3792899322303376
Energy: 1.3171460521104317
Energy: 1.3792899322296093
Energy: 1.3171460521104317
Energy: 1.3796059443796016
Energy: 1.2555951358863222
Energy: 1.3796059443796016
Energy: 1.2555951358826798
Energy: 1.37960594438033
Energy: 1.2555951358790376
Energy: 1.3108211796764653
Energy: 1.2212780661109994
Energy: 1.3108211796771936
Energy: 1.2212780661102707
Energy: 1.310821179677922
Energy: 1.221278066102258
Energy: 1.397384875869169
Energy: 1.1965236275283797
Energy: 1.397384875867712
Energy: 1.1965236275261943
Energy: 1.3973848758633414
Energy: 1.1965236275261943
Energy: 1.133068920828657
Energy: 1.7701990630532576
Energy: 1.1330689208264717
Energy: 1.770199063051072
Energy: 1.1330689208279288
Energy: 1.770199063048887
Energy: 1.3755381779769456
Energy: 1.4120192845475403
Energy: 1.375538177976217
Energy: 1.4120192845489972
Energy: 1.3755381779798592
Energy: 1.4120192845497255
Energy: 1.0707122412433967
Energy: 1.7002462150426778
Energy: 1.070712241240483
Energy: 1.7002462150441344
Energy: 1.0707122412426684
Energy: 1.7002462150434061

minimum gb energy = 1.0139683501282204 eV
minimum distance =  2.34075512194755 Angstroms
sigma value = 33


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

Energy: 1.7072663131365722
Energy: 1.523694415550731
Energy: 1.6455910189711547
Energy: 1.5236944155490737
Energy: 1.7072663131361578
Energy: 1.5236944155474164
Energy: 1.6509431714364262
Energy: 1.266740072159583
Energy: 1.6509431714351832
Energy: 1.2667400721591686
Energy: 1.6509431714364262
Energy: 1.2667400721612403
Energy: 1.2427267943098679
Energy: 1.3131452737570155
Energy: 1.2427267943102824
Energy: 1.3131452505976173
Energy: 1.2427267943077964
Energy: 1.3131451201189608
Energy: 1.5456090934039945
Energy: 1.5456715054784096
Energy: 1.5456090934035802
Energy: 1.545671505477995
Energy: 1.5456090934044093
Energy: 1.545671505478824
Energy: 1.415474649726283
Energy: 1.3838499072829455
Energy: 1.415474649730012
Energy: 1.3838499072833599
Energy: 1.4154746497275261
Energy: 1.3838499072804595
Energy: 1.185665224999856
Energy: 1.1174964510407799
Energy: 1.185665224998613
Energy: 1.1174964502646527
Energy: 1.1856652249994417
Energy: 1.1174964529512466
Energy: 1.6077900073738751
Energy: 1.5992498722063062
Energy: 1.6077900073730462
Energy: 1.5992498722054778
Energy: 1.607790007373461
Energy: 1.5992498722042345
Energy: 1.0379453762491944
Energy: 1.702751299064533
Energy: 1.0379453762520947
Energy: 1.7027512990670188
Energy: 1.03794537624878
Energy: 1.7027512990624614
Energy: 1.1381425802997938
Energy: 1.247180891674215
Energy: 1.1381425803006224
Energy: 1.247180891674215
Energy: 1.138142580300208
Energy: 1.2471808916725577
Energy: 1.1558430545592107
Energy: 1.6230932563639122
Energy: 1.1558425228606002
Energy: 1.6230932563614262
Energy: 1.155843054559625
Energy: 1.623093256358526
Energy: 1.5459030374401403
Energy: 1.1588757678855874
Energy: 1.545903037442212
Energy: 1.1588757678855874
Energy: 1.5459030374372402
Energy: 1.1588757678855874
Energy: 1.2440843362946439
Energy: 1.2554846581708738
Energy: 1.244080045435314
Energy: 1.2554846581758459
Energy: 1.2440843362942293
Energy: 1.2554846581717025
Energy: 1.5784299678289686
Energy: 1.1191527687434002
Energy: 1.5784320400253473
Energy: 1.1191527687434002
Energy: 1.5784299678302118
Energy: 1.1191527687405
Energy: 1.5807252176784017
Energy: 1.13694720123935
Energy: 1.580724866543975
Energy: 1.1368541072688079
Energy: 1.5807252176779876
Energy: 1.1369577194246225
Energy: 1.4851182014941036
Energy: 1.266167311533608
Energy: 1.4851182014949322
Energy: 1.2661673115315364
Energy: 1.485118201494518
Energy: 1.2661673115331937
Energy: 1.2439666323471363
Energy: 1.2668830088999468
Energy: 1.2439666323496221
Energy: 1.2668830088974607
Energy: 1.2439666323471363
Energy: 1.266883008901604
Energy: 1.5577519031627272
Energy: 1.4072009741947653
Energy: 1.5577519031635556
Energy: 1.4072009741943512
Energy: 1.5577519031623124
Energy: 1.407200974195594
Energy: 1.4157415169615217
Energy: 1.1286252242787271
Energy: 1.415741516960693
Energy: 1.128625224316394
Energy: 1.415741516963179
Energy: 1.128625224241437
Energy: 1.187473756689517
Energy: 1.1396825611004218
Energy: 1.1874737566907598
Energy: 1.139682561066898
Energy: 1.187473756689517
Energy: 1.1396825611356403
Energy: 1.534526544276449
Energy: 1.6046118311345012
Energy: 1.5345628476786244
Energy: 1.6046118311365731
Energy: 1.5345265442760347
Energy: 1.6046118311353301
Energy: 1.0798365391483762
Energy: 1.6810324693170382
Energy: 1.0797819295738096
Energy: 1.6810324693182808
Energy: 1.0798365391483762
Energy: 1.681032469304608
Energy: 1.3034959744286814
Energy: 1.2465399225641045
Energy: 1.3034959744290955
Energy: 1.2465399225641045
Energy: 1.303495974430753
Energy: 1.2465399225649332
Energy: 1.1554009254101105
Energy: 1.6192245277606694
Energy: 1.155397916989405
Energy: 1.6192245328348942
Energy: 1.1554009254101105
Energy: 1.619224524751044
Energy: 1.6032993283612584
Energy: 1.4177762674281191
Energy: 1.6032993283587724
Energy: 1.4177762674281191
Energy: 1.6032993283625017
Energy: 1.4177762674285332
Energy: 1.2426925150338375
Energy: 1.2085489642790936
Energy: 1.242544741538416
Energy: 1.2085489642530283
Energy: 1.2426925150317656
Energy: 1.2085489632126676
Energy: 1.6721165644084812
Energy: 1.4678708312112658
Energy: 1.612835383462069
Energy: 1.467870831210023
Energy: 1.6721165644076528
Energy: 1.4678708312058795
Energy: 1.6721000603769727
Energy: 1.5094141915315922
Energy: 1.6126216960451158
Energy: 1.5094141915315922
Energy: 1.6721000603769727
Energy: 1.5094141915295207
Energy: 1.2447584945529269
Energy: 1.3467213806004594
Energy: 1.2447584945541699
Energy: 1.3467213806000453
Energy: 1.2447584945512695
Energy: 1.346721380597559
Energy: 1.6747412161406514
Energy: 1.2656247288764495
Energy: 1.6747412161418946
Energy: 1.2656247288781068
Energy: 1.6747412161402373
Energy: 1.2656247288776925
Energy: 1.1555941472274491
Energy: 1.544700480083879
Energy: 1.1555941472278635
Energy: 1.544700480085951
Energy: 1.1555941472278635
Energy: 1.5447004800842936
Energy: 1.8290866300034545
Energy: 1.2475872407758473
Energy: 1.8290866299947537
Energy: 1.247587240775433
Energy: 1.829086629983981
Energy: 1.2475872407758473
Energy: 1.117850839936799
Energy: 1.6944547427688237
Energy: 1.1178508399384564
Energy: 1.694454742766752
Energy: 1.117850839938042
Energy: 1.6944547427655092
Energy: 1.4987211753939829
Energy: 1.6049321931304852
Energy: 1.4987211753923255
Energy: 1.6049321931308995
Energy: 1.4987211753952256
Energy: 1.6049321931308995
Energy: 1.2664608109709823
Energy: 1.4848408818169607
Energy: 1.2664608109713968
Energy: 1.484840881816132
Energy: 1.2664608109726396
Energy: 1.4848408818190324
Energy: 1.2651214730875109
Energy: 1.2438166083578357
Energy: 1.2651214730858535
Energy: 1.243816608357007
Energy: 1.2651214730858535
Energy: 1.2438166083561784
Energy: 1.5430798219116173
Energy: 1.5405706955868161
Energy: 1.543079821912446
Energy: 1.5405706955864018
Energy: 1.5430798219116173
Energy: 1.5405706955847445
Energy: 1.2443807788119017
Energy: 1.4158096591754419
Energy: 1.2443465906191384
Energy: 1.4158096591737848
Energy: 1.244380778808587
Energy: 1.4158096591737848
Energy: 1.2438081564055137
Energy: 1.185584159515267
Energy: 1.2437820849953594
Energy: 1.1855841595165098
Energy: 1.2438081564034422
Energy: 1.1855841595165098
Energy: 1.5807559797626372
Energy: 1.1055240631933225
Energy: 1.580755435857305
Energy: 1.1074830556546775
Energy: 1.5807559797626372
Energy: 1.1051010532269163
Energy: 1.7027620599422357
Energy: 1.0743510142653934
Energy: 1.7027620599414073
Energy: 1.0743510142658075
Energy: 1.70276205994265
Energy: 1.0743510142649788
Energy: 1.2440074564494923
Energy: 1.1373147310822038
Energy: 1.244007456447006
Energy: 1.1373147310822038
Energy: 1.244007456449078
Energy: 1.1373147310826182

minimum gb energy = 1.03794537624878 eV
minimum distance =  2.39206341219965 Angstroms
sigma value = 51


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

Energy: 1.4182475102500094
Energy: 1.3877110238255694
Energy: 1.4182475102500094
Energy: 1.3877110238265293
Energy: 1.4182475102490493
Energy: 1.3877110238246095
Energy: 1.665970972020577
Energy: 1.2114849634357303
Energy: 1.6659709720215368
Energy: 1.2114849634357303
Energy: 1.6659709720215368
Energy: 1.2114849634357303
Energy: 1.2926713309844988
Energy: 1.6802108830586244
Energy: 1.2926713309844988
Energy: 1.6802108830586244
Energy: 1.2926713309835387
Energy: 1.6802108830586244
Energy: 1.3605672684938956
Energy: 1.0752451866847934
Energy: 1.3605672684929355
Energy: 1.0752451866847934
Energy: 1.3605672684938956
Energy: 1.0752451866847934
Energy: 1.3719375482521903
Energy: 1.342209960058667
Energy: 1.3719375482521903
Energy: 1.342209960058667
Energy: 1.3719375482550702
Energy: 1.342209960056747
Energy: 1.3701204589657912
Energy: 1.3422162619662896
Energy: 1.370120458967711
Energy: 1.3422162619662896
Energy: 1.370120458967711
Energy: 1.3422162619662896
Energy: 1.2193924767275341
Energy: 1.3422911466434704
Energy: 1.2193924767275341
Energy: 1.3422911466415506
Energy: 1.2193924767256141
Energy: 1.3422911466434704
Energy: 1.2038585073298167
Energy: 1.342512386158793
Energy: 1.2038585073316932
Energy: 1.3425123861597532
Energy: 1.203858507330733
Energy: 1.3425123861578332
Energy: 1.5695857249728054
Energy: 1.070771063487852
Energy: 1.5695857249708853
Energy: 1.070771063487852
Energy: 1.5695857249766456
Energy: 1.070771063487852
Energy: 1.1442203846465597
Energy: 1.5642284734453378
Energy: 1.1442203846465597
Energy: 1.5642284736622127
Energy: 1.1442203846455998
Energy: 1.5642284735019785
Energy: 1.6194718509913304
Energy: 1.0685598717775524
Energy: 1.6194718509913304
Energy: 1.0685598717765925
Energy: 1.6194718509894102
Energy: 1.0685598717785125
Energy: 1.418490724161437
Energy: 1.3890375813246705
Energy: 1.4184907241605207
Energy: 1.3890375813246705
Energy: 1.4184907241605207
Energy: 1.3890375813237104
Energy: 1.623162442976936
Energy: 1.2118964122081837
Energy: 1.6231624429903762
Energy: 1.2118964122081837
Energy: 1.623162442939539
Energy: 1.2118964122081837
Energy: 1.2925007617964257
Energy: 1.2892388688374805
Energy: 1.2925007617973856
Energy: 1.2892388688374805
Energy: 1.2925007617954656
Energy: 1.2892388688355603
Energy: 1.3604307046930866
Energy: 1.4044340273203848
Energy: 1.3604307046930866
Energy: 1.4044340273203848
Energy: 1.3604307046921267
Energy: 1.4044340273203848
Energy: 1.3707473236778118
Energy: 1.342158692534835
Energy: 1.3707473236787717
Energy: 1.342158692536755
Energy: 1.3707473236778118
Energy: 1.3421586925357951
Energy: 1.371715314154184
Energy: 1.4967353571983038
Energy: 1.3717153141532241
Energy: 1.4967353571992636
Energy: 1.371715314154184
Energy: 1.4967353571973436
Energy: 1.293550525849966
Energy: 1.3481365887043175
Energy: 1.2935505258509257
Energy: 1.3481365887043175
Energy: 1.293550525849966
Energy: 1.3481365887043175

minimum gb energy = 1.0685598717765925 eV
minimum distance =  2.34868150318448 Angstroms
sigma value = 19


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

Energy: 1.1262890259168492
Energy: 1.0363187444194726
Energy: 1.1262890259162799
Energy: 1.0363187444189033
Energy: 1.1262890259162799
Energy: 1.0363187444194726
Energy: 1.3829194716818458
Energy: 1.4169234303830647
Energy: 1.3829194716818458
Energy: 1.416923430382495
Energy: 1.3829194716812763
Energy: 1.416923430383634
Energy: 0.9800601578827731
Energy: 1.4156077279777324
Energy: 0.9800601578822038
Energy: 1.4156077279771628
Energy: 0.9800601578827731
Energy: 1.415607727976024
Energy: 1.1789513265853089
Energy: 0.9802175298430906
Energy: 1.1789513265853089
Energy: 0.9802175298425212
Energy: 1.1789513265853089
Energy: 0.9802175298425212
Energy: 1.061620009307765
Energy: 1.1240934153924604
Energy: 1.0616200093071955
Energy: 1.1240934153935995
Energy: 1.061620009306626
Energy: 1.1240934153935995
Energy: 1.061567144949932
Energy: 1.123976459898175
Energy: 1.061567144948793
Energy: 1.1239764598987445
Energy: 1.061567144948793
Energy: 1.1239764598976056
Energy: 1.179002463112362
Energy: 0.9802355351259242
Energy: 1.179002463112362
Energy: 0.9802355351259242
Energy: 1.1790024631117924
Energy: 0.9802355351259242
Energy: 0.9800383127263919
Energy: 1.4155211295621168
Energy: 0.9800383127263919
Energy: 1.4155211295643946
Energy: 0.9800383127263919
Energy: 1.4155211295695198
Energy: 1.4947984457479133
Energy: 1.4168725775772213
Energy: 1.4947984457507606
Energy: 1.4168725775772213
Energy: 1.4947984457496217
Energy: 1.4168725775772213
Energy: 1.1262890259174188
Energy: 1.0363187444194726
Energy: 1.1262890259168492
Energy: 1.0363187444200423
Energy: 1.1262890259168492
Energy: 1.0363187444194726
Energy: 1.3829194716824154
Energy: 1.4169234303842035
Energy: 1.382919471682985
Energy: 1.4169234303842035
Energy: 1.3829194716841238
Energy: 1.416923430383634
Energy: 0.9800601578827731
Energy: 1.4156077279771628
Energy: 0.9800601578827731
Energy: 1.415607727976024
Energy: 0.9800601578827731
Energy: 1.415607727976024
Energy: 1.1789513265853089
Energy: 0.9802175298425212
Energy: 1.1789513265853089
Energy: 0.9802175298425212
Energy: 1.1789513265853089
Energy: 0.9802175298430906
Energy: 1.0616200093083346
Energy: 1.1240934153941688
Energy: 1.0616200093071955
Energy: 1.1240934153935995
Energy: 1.061620009307765
Energy: 1.1240934153935995
Energy: 1.061567144948793
Energy: 1.123976459898175
Energy: 1.0615671449493624
Energy: 1.123976459898175
Energy: 1.061567144948793
Energy: 1.123976459898175
Energy: 1.179002463112362
Energy: 0.9802355351259242
Energy: 1.1790024631117924
Energy: 0.9802355351253548
Energy: 1.1790024631117924
Energy: 0.9802355351259242
Energy: 0.9800383127263919
Energy: 1.4155211295700891
Energy: 0.9800383127263919
Energy: 1.4155211295689503
Energy: 0.9800383127275307
Energy: 1.4155211295547399
Energy: 1.4947984457496217
Energy: 1.4168725775766517
Energy: 1.4947984457496217
Energy: 1.4168725775777908
Energy: 1.4947984457507606
Energy: 1.4168725775777908
Energy: 1.1262890259168492
Energy: 1.0363187444189033
Energy: 1.1262890259168492
Energy: 1.0363187444194726
Energy: 1.1262890259168492
Energy: 1.0363187444189033
Energy: 1.382919471684693
Energy: 1.4169234303847726
Energy: 1.3829194716852626
Energy: 1.416923430383634
Energy: 1.3829194716841238
Energy: 1.416923430383634
Energy: 0.9800601578827731
Energy: 1.4156077279771628
Energy: 0.9800601578822038
Energy: 1.4156077279765933
Energy: 0.9800601578827731
Energy: 1.4156077279754546
Energy: 1.1789513265853089
Energy: 0.9802175298425212
Energy: 1.1789513265853089
Energy: 0.9802175298425212
Energy: 1.1789513265853089
Energy: 0.9802175298425212
Energy: 1.061620009306626
Energy: 1.1240934153935995
Energy: 1.0616200093071955
Energy: 1.1240934153941688
Energy: 1.061620009307765
Energy: 1.1240934153941688
Energy: 1.061567144948793
Energy: 1.1239764598987445
Energy: 1.0615671449482236
Energy: 1.123976459898175
Energy: 1.0615671449505015
Energy: 1.1239764598987445
Energy: 1.1790024631117924
Energy: 0.9802355351259242
Energy: 1.179002463112362
Energy: 0.9802355351253548
Energy: 1.1790024631117924
Energy: 0.9802355351259242
Energy: 0.9800383127263919
Energy: 1.4155211295558787
Energy: 0.9800383127263919
Energy: 1.4155211295649641
Energy: 0.9800383127269613
Energy: 1.415521129566103
Energy: 1.4947984457479133
Energy: 1.4168725775772213
Energy: 1.4947984457507606
Energy: 1.4168725775772213
Energy: 1.4947984457484829
Energy: 1.4168725775772213
Energy: 1.1262890259157101
Energy: 1.0363187444194726
Energy: 1.1262890259168492
Energy: 1.0363187444189033
Energy: 1.1262890259162799
Energy: 1.0363187444206117
Energy: 1.3829194716864015
Energy: 1.4169234303842035
Energy: 1.382919471685832
Energy: 1.4169234303859117
Energy: 1.382919471684693
Energy: 1.4169234303847726
Energy: 0.9800601578822038
Energy: 1.4156077279771628
Energy: 0.9800601578822038
Energy: 1.4156077279765933
Energy: 0.9800601578827731
Energy: 1.4156077279771628

minimum gb energy = 0.9800383127263919 eV
minimum distance =  2.35500832130922 Angstroms
sigma value = 27


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

Energy: 1.1180978488809001
Energy: 1.0321910408350548
Energy: 1.1180978488809001
Energy: 1.0321910408350548
Energy: 1.1180978488795053
Energy: 1.0321910408350548
Energy: 1.4145864485028397
Energy: 1.0975718981453422
Energy: 1.414586434108672
Energy: 1.0975718981453422
Energy: 1.41458640370854
Energy: 1.0975718981439475
Energy: 1.0402914008303055
Energy: 1.4124447233966695
Energy: 1.0402917078150171
Energy: 1.4124447233980644
Energy: 1.040291458515776
Energy: 1.4124447233966695
Energy: 1.3315447638639493
Energy: 1.0030512647996217
Energy: 1.3315447638653441
Energy: 1.0030512647996217
Energy: 1.3315447638653441
Energy: 1.0030512648010164
Energy: 1.3085303557367487
Energy: 1.0029067097786712
Energy: 1.308530355735354
Energy: 1.0029067097786712
Energy: 1.3085303557367487
Energy: 1.0029067097786712
Energy: 1.3293074143433075
Energy: 1.4035446416649642
Energy: 1.3293074143447026
Energy: 1.403544641666359
Energy: 1.3293074143447026
Energy: 1.4035446416649642
Energy: 1.1721913880315675
Energy: 1.0997114217166037
Energy: 1.1721913880301729
Energy: 1.0997114217166037
Energy: 1.1721913880301729
Energy: 1.0997114217166037
Energy: 1.1167558809559985
Energy: 1.0348981743135826
Energy: 1.1167558809559985
Energy: 1.0348981743135826
Energy: 1.1167558809559985
Energy: 1.0348981743135826
Energy: 1.28715533170606
Energy: 1.0409491368753314
Energy: 1.28715533170606
Energy: 1.0409491282086951
Energy: 1.28715533170606
Energy: 1.040949137442787
Energy: 1.2162878771460497
Energy: 1.3341887352075799
Energy: 1.2162878771446863
Energy: 1.334188735056998
Energy: 1.2162878771460497
Energy: 1.3341887335665545
Energy: 1.2902344284629201
Energy: 1.0042219924090334
Energy: 1.0318080514975272
Energy: 1.0042219924090334
Energy: 1.0318080514961325
Energy: 1.0042219924090334
Energy: 1.3397529430240902
Energy: 1.2414495761309143
Energy: 1.3397529430240902
Energy: 1.2414495761350985
Energy: 1.3397529430240902
Energy: 1.2414495761309143

minimum gb energy = 1.0029067097786712 eV
minimum distance =  2.33882195984752 Angstroms
sigma value = 9


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

Energy: 1.1909287663517556
Energy: 1.061624305596564
Energy: 1.1909287663513637
Energy: 1.0616243055718728
Energy: 1.1909287663529313
Energy: 1.0616243055808872
Energy: 1.50266274472765
Energy: 1.0605217261133477
Energy: 1.5026620831242228
Energy: 1.0605217261164834
Energy: 1.5026612108997583
Energy: 1.0187580143307444
Energy: 0.9361100719976176
Energy: 1.3258229571904494
Energy: 0.9361100719929147
Energy: 1.3258037291071538
Energy: 0.9361100719952661
Energy: 1.153759318761539
Energy: 1.0368773727967888
Energy: 0.9715993535884364
Energy: 1.0368773727971805
Energy: 0.9715993535860847
Energy: 1.0368773727971805
Energy: 0.9715993535880443
Energy: 1.0047551050676096
Energy: 1.0147230855520135
Energy: 1.0047551050699612
Energy: 1.014723085554365
Energy: 1.0047551050703531
Energy: 1.014723085554757
Energy: 1.1118083309912847
Energy: 1.0295122600327198
Energy: 1.1118083309928526
Energy: 0.9878104819967908
Energy: 1.1118083309967361
Energy: 0.9872306374567555
Energy: 1.0558656356145146
Energy: 1.0716256181303045
Energy: 1.055865635612163
Energy: 1.0716256181310884
Energy: 1.055865635616866
Energy: 1.0716256181291288
Energy: 0.9271071052514177
Energy: 1.089371032337758
Energy: 0.9271071052510257
Energy: 1.0893710323393258
Energy: 0.9271071052506338
Energy: 1.0893710323397177
Energy: 1.37621270792755
Energy: 1.0156786393148758
Energy: 1.376212707931077
Energy: 1.0156786393160517
Energy: 1.3762127079314692
Energy: 1.0156786393148758
Energy: 1.0048594074321193
Energy: 1.3929680427286053
Energy: 1.0048942560539122
Energy: 1.3929680427266458
Energy: 1.0048839906364015
Energy: 1.3929680426459454
Energy: 1.0379486017787274
Energy: 0.975673275886747
Energy: 1.0379486017783355
Energy: 0.9756732758879227
Energy: 1.0379486017783355
Energy: 0.975673275886747
Energy: 0.9525112754709646
Energy: 1.2135848881424152
Energy: 0.9525112754701807
Energy: 1.213584888140064
Energy: 0.9525112754705727
Energy: 1.2135848878537108
Energy: 0.9236386638162212
Energy: 1.057649789780484
Energy: 0.9236118865627176
Energy: 1.0576497897828356
Energy: 0.9579352972809195
Energy: 1.0576497897847952
Energy: 1.1877682470081574
Energy: 1.3497068375155132
Energy: 1.1877682470050221
Energy: 1.3497068375159051
Energy: 1.1877682470058057
Energy: 1.3497068375155132
Energy: 0.9827202699780351
Energy: 1.0873139898742243
Energy: 0.9827202699792108
Energy: 1.0873139898730486
Energy: 0.982720269978427
Energy: 1.0873139898738322
Energy: 0.935357071938774
Energy: 1.123018978923803
Energy: 0.9369467427466655
Energy: 1.123018978886214
Energy: 0.9370798171500737
Energy: 1.1230189787224614
Energy: 1.2686408198994072
Energy: 1.23362016784318
Energy: 1.2686408198986234
Energy: 1.2336201484696154
Energy: 1.2686408199001913
Energy: 1.2336198787877675
Energy: 1.0045409277675958
Energy: 0.9907790104458126
Energy: 1.0045409277691633
Energy: 0.9907790104454205
Energy: 1.0045409277675958
Energy: 0.9907790104442449
Energy: 0.9242755369505365
Energy: 1.3402954156373685
Energy: 0.9242755369481852
Energy: 1.3402954156412878
Energy: 0.9242755369517125
Energy: 1.3402954156381526
Energy: 1.2592593742417995
Energy: 1.0647149683834394
Energy: 1.2592593742421914
Energy: 1.0647149683834394
Energy: 1.2592593742445428
Energy: 1.0647149683834394
Energy: 0.9325088524603659
Energy: 1.3405961307831344
Energy: 0.9325088524607578
Energy: 1.3405961307831344
Energy: 0.932508852459582
Energy: 1.3405961307843104
Energy: 1.0047498344068115
Energy: 0.9911276464473093
Energy: 1.0047498344083792
Energy: 0.9911276464477015
Energy: 1.0047498344072034
Energy: 0.9911276464477015
Energy: 1.268764088391019
Energy: 1.233642795606594
Energy: 1.268764088391411
Energy: 1.2336422153016071
Energy: 1.268764088392195
Energy: 1.2336210953907938
Energy: 0.9369555730993043
Energy: 1.1556735797723292
Energy: 0.9374743111015154
Energy: 1.155673579769194
Energy: 0.9379400083482222
Energy: 1.155673579769194
Energy: 0.9823694111087325
Energy: 1.0462229841711006
Energy: 0.9823694111091245
Energy: 1.0462229841722768
Energy: 0.9823694111087325
Energy: 1.0462229841687494
Energy: 1.1876892069167564
Energy: 1.100353290333
Energy: 1.187689206914405
Energy: 1.100353290333784
Energy: 1.1876892069191083
Energy: 1.100353290333
Energy: 0.9606478862101605
Energy: 1.0572428366294953
Energy: 0.9611163832680667
Energy: 1.0572428366310627
Energy: 0.9608338774342033
Energy: 1.0572428366322388
Energy: 0.952756103781364
Energy: 1.0777328841832925
Energy: 0.9527561037805801
Energy: 1.0777328841789815
Energy: 0.9527561037833235
Energy: 1.077732884181725
Energy: 1.0379074310008267
Energy: 0.9755662698908593
Energy: 1.0379074310027863
Energy: 0.9755662698916432
Energy: 1.0379074310023944
Energy: 0.9755662698920351
Energy: 1.0050311985119391
Energy: 1.325490204784127
Energy: 0.8970182200366938
Energy: 1.3254902047802077
Energy: 0.8945491395819973
Energy: 1.3254902047798156
Energy: 1.3761842516989249
Energy: 1.015944108762629
Energy: 1.3761842517004925
Energy: 1.0159441087610614
Energy: 1.3761842516989249
Energy: 1.015944108763021
Energy: 0.9271825829795962
Energy: 1.113639062935109
Energy: 0.9271825829803801
Energy: 1.1136390629362847
Energy: 0.9271825829799882
Energy: 1.1136390629355006
Energy: 1.0558451977246688
Energy: 1.0716120419216988
Energy: 1.0558451977242769
Energy: 1.0716120419017108
Energy: 1.0558451977246688
Energy: 1.0716120418629105
Energy: 1.111829577691591
Energy: 0.9754370980752449
Energy: 1.1118295776931586
Energy: 0.9753082237155882
Energy: 1.1118295776931586
Energy: 0.9752099211680486
Energy: 1.0047306620193126
Energy: 1.0149401910028457
Energy: 1.0047306620161773
Energy: 1.0149401910012779
Energy: 1.0047306620193126
Energy: 1.0149401910012779
Energy: 1.0367454433843035
Energy: 0.9716137845569621
Energy: 1.0367454433835195
Energy: 0.9716137845557865
Energy: 1.0367454433846954
Energy: 0.9716137845565703
Energy: 0.9362905994522555
Energy: 1.3254452976645061
Energy: 0.9362905994530393
Energy: 1.153272453009507
Energy: 0.9362905994518635
Energy: 1.153685083502723
Energy: 1.5027136279069127
Energy: 0.9730963719537327
Energy: 1.5027129249586912
Energy: 0.9730963719545165
Energy: 1.5027112854240465
Energy: 0.9730963719549084
Energy: 1.1909287663513637
Energy: 1.0616243055554122
Energy: 1.1909287663501882
Energy: 1.06162430556717
Energy: 1.1909287663517556
Energy: 1.0616243055750083
Energy: 1.5026626946664567
Energy: 1.018758014328785
Energy: 1.5026620837737457
Energy: 1.018758014328393
Energy: 1.5026612030068243
Energy: 1.018758014328785
Energy: 0.9361100719929147
Energy: 1.3258253443060213
Energy: 0.9361100719948742
Energy: 1.3258108453083506
Energy: 0.9361100719921308
Energy: 1.1536643976464402
Energy: 1.0368773727971805
Energy: 0.9715993535872604
Energy: 1.0368773727987484
Energy: 0.9715993535880443
Energy: 1.0368773727971805
Energy: 0.9715993535856928
Energy: 1.0047551050695693
Energy: 1.0147230855449947
Energy: 1.0047551050691774
Energy: 1.0147230855457785
Energy: 1.0047551050687853
Energy: 1.0147230855453864

minimum gb energy = 0.8945491395819973 eV
minimum distance =  2.36993068782244 Angstroms
sigma value = 57


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

Energy: 0.8630033155298054
Energy: 0.8040402929577016
Energy: 0.8630033155289131
Energy: 0.8040402929577016
Energy: 0.8630033155289131
Energy: 0.8040402929577016
Energy: 0.7437650401395657
Energy: 0.8701103398010341
Energy: 0.7437650401413094
Energy: 0.8701103398019264
Energy: 0.7437650401395657
Energy: 0.8701103398241897
Energy: 0.8602982290936368
Energy: 1.2597881259040369
Energy: 0.8602982290936368
Energy: 1.2597881259468606
Energy: 0.8602982290936368
Energy: 1.2597881260137316
Energy: 0.6205638703965428
Energy: 0.5680287856229648
Energy: 0.620563870397435
Energy: 0.568028785623857
Energy: 0.620563870397435
Energy: 0.568028785623857
Energy: 0.7090502866608553
Energy: 0.7492816714782112
Energy: 0.7090502866599632
Energy: 0.7492816714782112
Energy: 0.7090502866599632
Energy: 0.7492816714764268
Energy: 0.5684891701571547
Energy: 0.8599747073218164
Energy: 0.5684891701580469
Energy: 0.8599747073218164
Energy: 0.5684891701571547
Energy: 0.8599747073218164
Energy: 0.5685599682737164
Energy: 0.8583457253873609
Energy: 0.5685599682737164
Energy: 0.8583457253873609
Energy: 0.5685599682728242
Energy: 0.8583457253864686
Energy: 0.7462147799620609
Energy: 0.7169154838615817
Energy: 0.7462147799611687
Energy: 0.7169154838633659
Energy: 0.7462147799620609
Energy: 0.7169154838624737
Energy: 0.6201600095833785
Energy: 0.5680287845037935
Energy: 0.6201600095833785
Energy: 0.5680287845037935
Energy: 0.6201600095833785
Energy: 0.5680287845037935
Energy: 0.8237967373193836
Energy: 0.9750541076219897
Energy: 0.8237967373193836
Energy: 0.9750541076210975
Energy: 0.8237967373193836
Energy: 0.9750541076210975
Energy: 0.7094343338645172
Energy: 0.7955389477355499
Energy: 0.7094343338645172
Energy: 0.7955389477364421
Energy: 0.7094343338645172
Energy: 0.7955389477355499
Energy: 0.863003315528021
Energy: 0.8040402929568093
Energy: 0.863003315528021
Energy: 0.8040402929568093
Energy: 0.863003315528021
Energy: 0.8040402929568093
Energy: 0.7437650401413094
Energy: 0.8701103397992499
Energy: 0.7437650401404579
Energy: 0.8701103398072793
Energy: 0.7437650401413094
Energy: 0.8701103398001421
Energy: 0.860298229091893
Energy: 1.259788125879097
Energy: 0.860298229091893
Energy: 1.2597881260253299
Energy: 0.8602982290927853
Energy: 1.2597881259450763
Energy: 0.6205638703965428
Energy: 0.5680287856220726
Energy: 0.6205638703965428
Energy: 0.5680287856220726
Energy: 0.6205638703965428
Energy: 0.5680287856220726
Energy: 0.7090502866590711
Energy: 0.7492816714755346
Energy: 0.7090502866590711
Energy: 0.7492816714764268
Energy: 0.7090502866590711
Energy: 0.7492816714737504
Energy: 0.5684891701571547
Energy: 0.8599747073209242
Energy: 0.5684891701580469
Energy: 0.8599747073209242
Energy: 0.5684891701589391
Energy: 0.8599747073218164
Energy: 0.5685599682728242
Energy: 0.8583457253847249
Energy: 0.5685599682728242
Energy: 0.8583457253847249
Energy: 0.5685599682728242
Energy: 0.8583457253855765
Energy: 0.7462147799620609
Energy: 0.7169154838642581
Energy: 0.7462147799620609
Energy: 0.7169154838642581
Energy: 0.7462147799620609
Energy: 0.7169154838642581

minimum gb energy = 0.5680287845037935 eV
minimum distance =  2.50395640724515 Angstroms
sigma value = 11


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

Energy: 0.8885317221206669
Energy: 1.1030177465082043
Energy: 0.8885317221200134
Energy: 1.1030177465082043
Energy: 0.8885317221206669
Energy: 1.1030177465082043
Energy: 1.1555288893396911
Energy: 1.0253929772576045
Energy: 1.1555288893344628
Energy: 1.0253929772576045
Energy: 1.1555288893351163
Energy: 1.0253929772576045
Energy: 1.0690312967247402
Energy: 1.4194686586776728
Energy: 1.0690312967247402
Energy: 1.4194686585627119
Energy: 1.0690312967247402
Energy: 1.419468658246585
Energy: 1.222963753066192
Energy: 0.8305802973750617
Energy: 1.2229637530668456
Energy: 0.8305802973822503
Energy: 1.2229637530668456
Energy: 0.8305802973802897
Energy: 1.0835234826836821
Energy: 0.8154495424911907
Energy: 1.0835234826836821
Energy: 0.81544954248923
Energy: 1.0835234826836821
Energy: 0.8154495424924978
Energy: 0.9904233157052984
Energy: 1.1616763038451745
Energy: 0.990423315703338
Energy: 1.1616763038464817
Energy: 0.9904233157046449
Energy: 1.1616763038458282
Energy: 0.7922989681906868
Energy: 1.2263588874015519
Energy: 0.7922989681893796
Energy: 1.2263588874035123
Energy: 0.7922989681887261
Energy: 1.2263588874041658
Energy: 1.0990071980201026
Energy: 0.7733723581016613
Energy: 1.0990071980201026
Energy: 0.773372358102315
Energy: 1.099007198020756
Energy: 0.773372358102315
Energy: 1.100622149435389
Energy: 0.7797004487128854
Energy: 1.100622149435389
Energy: 0.7797004487115783
Energy: 1.100622149435389
Energy: 0.7797004487128854
Energy: 0.795690412862824
Energy: 1.3871840606245804
Energy: 0.7956904128589027
Energy: 1.3871840606245804
Energy: 0.7956904128615169
Energy: 1.3871840606232735
Energy: 1.2237148399175524
Energy: 1.3548498192057683
Energy: 1.2237148399149382
Energy: 1.354849819206422
Energy: 1.2237148399182058
Energy: 1.3548498192057683
Energy: 1.081193069075886
Energy: 0.8199956531616609
Energy: 1.0811930690739253
Energy: 0.8199956531688497
Energy: 1.081193069074579
Energy: 0.8199956531616609
Energy: 1.103452243264255
Energy: 0.819535559860884
Energy: 1.103452243264255
Energy: 0.8195355599242756
Energy: 1.103452243264255
Energy: 0.8195355599268899
Energy: 1.1932319887294638
Energy: 1.388692729697398
Energy: 1.1932319887288103
Energy: 1.3886926922533664
Energy: 1.1932319887288103
Energy: 1.3886926180807329
Energy: 1.3197988843267743
Energy: 1.056317747553071
Energy: 1.3197988843274278
Energy: 1.056317747553071
Energy: 1.3197988843261208
Energy: 1.0563177475524175
Energy: 0.8566094868113345
Energy: 1.101203116738089
Energy: 0.8566094868152556
Energy: 1.1012031167374352
Energy: 0.8566094868165627
Energy: 1.1012031167367817
Energy: 0.9655099607316214
Energy: 1.0272228678860313
Energy: 0.965509960733582
Energy: 1.027222867886685
Energy: 0.965509960730968
Energy: 1.0272228678853779
Energy: 1.3972052932867176
Energy: 1.413840870508005
Energy: 1.3972052932860641
Energy: 1.4138408704727143
Energy: 1.3972052932854107
Energy: 1.413840870458337
Energy: 1.2861459546188294
Energy: 0.8252914904263147
Energy: 1.28614595462079
Energy: 0.8252914904269683
Energy: 1.2861459546188294
Energy: 0.8252914904263147
Energy: 1.0814309183863786
Energy: 0.9627315734463696
Energy: 1.0814309183863786
Energy: 0.9627315734463696
Energy: 1.081430918387032
Energy: 0.9627315734450627
Energy: 0.7974520410754556
Energy: 1.108692062062821
Energy: 0.7974520410748022
Energy: 1.108692062062821
Energy: 0.7974520410741486
Energy: 1.108692062062821
Energy: 1.0629107094001065
Energy: 1.358425140000678
Energy: 1.0629107093968388
Energy: 1.3584251400013314
Energy: 1.0629107094020669
Energy: 1.358425140000678
Energy: 1.1637975855465863
Energy: 0.9596031856416473
Energy: 1.1637975855465863
Energy: 0.9596031856416473
Energy: 1.16379758554724
Energy: 0.9596031856409937
Energy: 1.1018761559790604
Energy: 0.9445369316914691
Energy: 1.101876155978407
Energy: 0.9445369316927761
Energy: 1.1018761559790604
Energy: 0.9445369316940833
Energy: 0.7974069686250257
Energy: 1.3871564393740432
Energy: 0.7974069686250257
Energy: 1.3871564393779643
Energy: 0.7974069686243722
Energy: 1.3871564393746967
Energy: 1.5665414749757463
Energy: 1.3565573495372512
Energy: 1.5665414749737858
Energy: 1.3565573495365977
Energy: 1.5665414749757463
Energy: 1.3565573495372512

minimum gb energy = 0.7733723581016613 eV
minimum distance =  2.39227945315443 Angstroms
sigma value = 41


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

Energy: 1.1280040338858655
Energy: 0.9059612799994612
Energy: 1.1280040338853503
Energy: 0.9059612800025518
Energy: 1.1280040338863804
Energy: 0.9059612800046121
Energy: 1.1595714876949932
Energy: 1.2107384110229071
Energy: 1.1595714876924175
Energy: 1.2107384110229071
Energy: 1.1595714876949932
Energy: 1.2107384110229071
Energy: 1.2197022124971642
Energy: 1.6648147910435085
Energy: 1.2197022124971642
Energy: 1.6648147910414481
Energy: 1.2197022124981944
Energy: 1.6648147910440234
Energy: 1.1133829950597607
Energy: 0.8821993730910348
Energy: 1.1133829950613061
Energy: 0.8821993730874291
Energy: 1.1133829950607907
Energy: 0.882199373092065
Energy: 0.8520924472741812
Energy: 0.9501516562546489
Energy: 0.8520924472752114
Energy: 0.9501516562531036
Energy: 0.8520924472752114
Energy: 0.9501516562541338
Energy: 1.117564397042476
Energy: 1.4188292678793426
Energy: 1.1175643970414457
Energy: 1.4188292678798577
Energy: 1.1175643970429912
Energy: 1.4188292678793426
Energy: 0.8577047583242465
Energy: 1.4115209314026969
Energy: 0.8577047583247616
Energy: 1.4115209314026969
Energy: 0.8577047583237315
Energy: 1.4115209314026969
Energy: 0.8376130237360921
Energy: 0.8822357057472082
Energy: 0.8376130237355771
Energy: 0.8822357057487534
Energy: 0.8376130237330015
Energy: 0.8822357057466931
Energy: 0.870787294387812
Energy: 0.9442719123415583
Energy: 0.870787294388327
Energy: 0.9442719123410432
Energy: 0.870787294387812
Energy: 0.9442719123405281
Energy: 0.9136685529059915
Energy: 1.5577825782626753
Energy: 0.9136685529065066
Energy: 1.5577825782626753
Energy: 0.9136685529054764
Energy: 1.5577825782626753
Energy: 0.9144950203474449
Energy: 1.5808442692231777
Energy: 0.9144950203469299
Energy: 1.5808442692231777
Energy: 0.9144950203464146
Energy: 1.5808442692231777
Energy: 0.8322521249320213
Energy: 1.1929704662537775
Energy: 0.8322521249320213
Energy: 1.1929704662537775
Energy: 0.8322521249335667
Energy: 1.0723578583887268
Energy: 0.8378686363855201
Energy: 0.8820373234940431
Energy: 0.8378686363839749
Energy: 0.8820373234924979
Energy: 0.8378686363942767
Energy: 0.8820373234966187
Energy: 0.8065698321859167
Energy: 1.459664576322992
Energy: 0.8065698321843715
Energy: 1.4596645763209315
Energy: 0.8065698321833414
Energy: 1.4596645763250524
Energy: 1.1188568288372658
Energy: 1.4159885654263107
Energy: 1.1188568288367509
Energy: 1.4159885654263107
Energy: 1.1188568288367509
Energy: 1.4159885654257955
Energy: 0.8064923444870812
Energy: 1.1053250995465367
Energy: 0.8064923444839905
Energy: 1.1053250995465367
Energy: 0.8064923444875962
Energy: 1.1053250995460215
Energy: 0.844003601799998
Energy: 0.8819589495563399
Energy: 0.8440036018020582
Energy: 0.8819589495547946
Energy: 0.8440036018020582
Energy: 0.8819589495563399
Energy: 1.1860100761578531
Energy: 1.583569813023649
Energy: 1.186010076156823
Energy: 1.583569813013909
Energy: 1.1860100761573382
Energy: 1.583569812952614
Energy: 1.1490338373327367
Energy: 1.236172185534309
Energy: 1.1490338373327367
Energy: 1.236172185533794
Energy: 1.1490338373311915
Energy: 1.236172185534309
Energy: 0.9146385716961845
Energy: 1.2827915869812254
Energy: 0.9146385716961845
Energy: 1.2827915869812254
Energy: 0.9146385716956694
Energy: 1.3471668803802235
Energy: 0.8495464011977374
Energy: 1.2796970444079625
Energy: 0.8495464011972222
Energy: 1.2796970444084776
Energy: 0.8495464011967072
Energy: 1.2796970444079625
Energy: 1.1901552727437876
Energy: 1.5286477846128037
Energy: 1.1901552727443028
Energy: 1.5286477846107436
Energy: 1.1901552727437876
Energy: 1.5286477846128037
Energy: 1.0628573112907764
Energy: 0.8862564646731158
Energy: 1.0628573112912914
Energy: 0.886256464674146
Energy: 1.0628573112912914
Energy: 0.8862564646726008
Energy: 0.8067713764748938
Energy: 1.3066736036317905
Energy: 0.8067713764743787
Energy: 1.3066736036312756
Energy: 0.8067713764754089
Energy: 1.3066736036317905
Energy: 0.8065462073606293
Energy: 1.300578329717117
Energy: 0.8065462073637197
Energy: 1.300578329717632
Energy: 0.8065462073637197
Energy: 1.300578329717632
Energy: 1.0424293179080972
Energy: 0.8581317576919439
Energy: 1.0424293179075819
Energy: 0.8581317576934892
Energy: 1.0424293179080972
Energy: 0.8581317576919439
Energy: 0.8373081170975557
Energy: 0.8861467278987573
Energy: 0.8373081170975557
Energy: 0.8861467278987573
Energy: 0.8373081170991011
Energy: 0.8861467278987573
Energy: 0.876420756956899
Energy: 1.2842160409106878
Energy: 0.8764207569553538
Energy: 1.2842160409106878
Energy: 0.8764207569584445
Energy: 1.2842160409101726
Energy: 0.9136319425195512
Energy: 1.2784356880124559
Energy: 0.9136319425190361
Energy: 1.278435688012971
Energy: 0.9136319425200662
Energy: 1.2784356880124559
Energy: 1.3331969981824952
Energy: 0.8070383296575271
Energy: 1.3331969981840404
Energy: 0.8070383296580422
Energy: 1.3331969981855856
Energy: 0.8070383296575271
Energy: 0.8322929499620514
Energy: 1.065699449495354
Energy: 0.8322929499635966
Energy: 1.0656994494963843
Energy: 0.8322929499625665
Energy: 1.0656994494958694
Energy: 0.8937825142196135
Energy: 0.9233200370439137
Energy: 0.893782514221159
Energy: 0.9233200370449438
Energy: 0.8937825142201286
Energy: 0.923320037045459
Energy: 0.8063262495027095
Energy: 1.1032214415889683
Energy: 0.8063262495011643
Energy: 1.1032214415889683
Energy: 0.8063262495032245
Energy: 1.1032214415879382

minimum gb energy = 0.8063262495011643 eV
minimum distance =  2.44619384701451 Angstroms
sigma value = 33


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

Energy: 1.073888441775873
Energy: 0.9619244860132429
Energy: 1.0194500212180404
Energy: 0.9619244860129142
Energy: 1.073888441776596
Energy: 0.9619244860129142
Energy: 1.3583791451148886
Energy: 0.8810549986667645
Energy: 1.3583791451170575
Energy: 0.8810549986670931
Energy: 1.358379145115283
Energy: 0.8810549986674876
Energy: 1.263863213498926
Energy: 1.4956419023351777
Energy: 1.2638632134993206
Energy: 1.4956419023351777
Energy: 1.2638632134996493
Energy: 1.4956419023391212
Energy: 1.3286156379743832
Energy: 0.9306520799897345
Energy: 1.328615637975829
Energy: 0.9306520799893401
Energy: 1.3286156379732657
Energy: 0.9306520799850021
Energy: 0.9632559745968752
Energy: 1.5805805856854158
Energy: 0.9629779041685921
Energy: 1.5805805856854158
Energy: 0.9632559745975982
Energy: 1.5805805856854158
Energy: 1.2544675937400633
Energy: 0.9038503085618864
Energy: 1.2544675937421665
Energy: 0.9038503085622809
Energy: 1.2544675937411147
Energy: 0.9038503085644498
Energy: 0.9155606572671607
Energy: 1.1383551652709731
Energy: 0.9155606572609825
Energy: 1.0581405673701252
Energy: 0.9155606572674894
Energy: 1.0582209413533867
Energy: 1.0192163502884213
Energy: 0.9012347580784243
Energy: 1.0194810661657001
Energy: 0.9012347580784243
Energy: 1.0196611181606225
Energy: 0.9012347580802647
Energy: 1.5644474173196812
Energy: 0.9984149906939843
Energy: 1.5644460030034684
Energy: 0.9984149906925384
Energy: 1.5644474173196812
Energy: 0.998414990691421
Energy: 1.3217805441085393
Energy: 0.9115133743300216
Energy: 1.3217805232076378
Energy: 0.9115133743307446
Energy: 1.3217804846222734
Energy: 0.9115133743260782
Energy: 0.9907109722733717
Energy: 0.9274607325280095
Energy: 0.9907109722715313
Energy: 0.9274607325269578
Energy: 0.9907109722729774
Energy: 0.9274607325280095
Energy: 1.578657396279323
Energy: 0.914044278954934
Energy: 1.578657396278929
Energy: 0.914044278954934
Energy: 1.5786573962796517
Energy: 0.9140442789574316
Energy: 0.9394267393851327
Energy: 1.5632147493234598
Energy: 0.939426739384804
Energy: 1.5632147493234598
Energy: 0.9394267393836867
Energy: 1.5632147493252344
Energy: 0.9008399496926046
Energy: 0.9853546486389123
Energy: 0.900839949694445
Energy: 0.985354648637072
Energy: 0.900839949692276
Energy: 0.9853546486454192
Energy: 0.9162731074314223
Energy: 1.061909920596074
Energy: 0.9162731074310279
Energy: 1.0619099205967968
Energy: 0.9162731074314223
Energy: 1.0619099205957454
Energy: 0.944611830714072
Energy: 1.2218849746903717
Energy: 0.9446118307111798
Energy: 1.221884974691095
Energy: 0.9446118307133489
Energy: 1.2218849746954328
Energy: 1.5372005627503702
Energy: 0.9567230501921868
Energy: 1.537200562752539
Energy: 0.9567230501917927
Energy: 1.5372005627500416
Energy: 0.9567230501954075
Energy: 0.9242499012460319
Energy: 1.143625703018194
Energy: 0.9242926076099992
Energy: 1.143625703018917
Energy: 0.9242499012460319
Energy: 1.143625703018917
Energy: 1.293352973816167
Energy: 1.2878411267110972
Energy: 1.2933529738139982
Energy: 1.2878411267110972
Energy: 1.293352973817219
Energy: 1.2878411267074823
Energy: 1.529156844741352
Energy: 0.902604047102307
Energy: 1.5291568447424038
Energy: 0.9026040471027015
Energy: 1.5291568447409578
Energy: 0.902604047106645
Energy: 0.9509188147014189
Energy: 1.0128716066446608
Energy: 0.950918814702865
Energy: 1.012871606645384
Energy: 0.9509188147014189
Energy: 1.0128716066446608
Energy: 0.8746727759875473
Energy: 1.3359418115575976
Energy: 0.874663986062409
Energy: 1.3359418115565458
Energy: 0.8746727759882703
Energy: 1.3359418115590436
Energy: 1.4087786382787335
Energy: 1.3902244969076467
Energy: 1.4087786382787335
Energy: 1.3902244969094868
Energy: 1.408778638277682
Energy: 1.39022449691021
Energy: 0.9136351780477021
Energy: 1.3312018862797248
Energy: 0.9136351780520401
Energy: 1.3312018862855084
Energy: 0.9136351780487537
Energy: 1.3312018862826167
Energy: 1.5792222110806773
Energy: 0.9555454637236849
Energy: 1.5792222110803489
Energy: 0.9555454637248022
Energy: 1.5792222110814003
Energy: 0.9555454637204642
Energy: 0.8976829748098629
Energy: 1.1456157787330505
Energy: 0.8976829748149237
Energy: 1.1456157787344965
Energy: 0.8976829748095343
Energy: 1.1456157787344965
Energy: 1.2941766831355932
Energy: 0.9215144837314183
Energy: 1.2941766831341472
Energy: 0.9215144837321414
Energy: 1.2941766831352646
Energy: 0.9215144837263575
Energy: 1.0276242771416289
Energy: 0.9121367034345712
Energy: 0.9665685603004183
Energy: 0.9121367034349657
Energy: 1.0276242771416289
Energy: 0.9121367034277357
Energy: 0.9594496749539279
Energy: 1.5630592184647094
Energy: 0.9594496749546508
Energy: 1.5630592184647094
Energy: 0.9594496749532049
Energy: 1.5630592184647094
Energy: 0.904414156949992
Energy: 1.2299802280951997
Energy: 0.9044141569471003
Energy: 1.229980228097697
Energy: 0.9044141569518325
Energy: 1.2299802280955283
Energy: 1.2105805067064932
Energy: 0.9187943040656764
Energy: 1.2105805067064932
Energy: 0.9187943040663995
Energy: 1.2105805067079392
Energy: 0.9187943040696858
Energy: 0.9132723989971059
Energy: 1.580008678942169
Energy: 0.9134564987795506
Energy: 1.5800086789425636
Energy: 0.9132723989974345
Energy: 1.580008678942169
Energy: 1.5613184748808326
Energy: 0.8887088043462199
Energy: 1.56131847488333
Energy: 0.8887088043462199
Energy: 1.561318474880438
Energy: 0.8887088043458913
Energy: 0.9907994874876602
Energy: 0.9236218720444522
Energy: 0.9907994874923924
Energy: 0.9236218720440579
Energy: 0.9907994874905524
Energy: 0.9236218720495132
Energy: 0.9343211858750375
Energy: 0.9239047766396489
Energy: 0.9343211858750375
Energy: 0.9239047766399775
Energy: 0.9343211858750375
Energy: 0.9239047766396489
Energy: 1.531384696390422
Energy: 0.9448427784447452
Energy: 1.5313557131559814
Energy: 0.9448427784498062
Energy: 1.5313846963893705
Energy: 0.9448427784400787
Energy: 0.9138151343702602
Energy: 1.535804056442066
Energy: 0.9138151344186346
Energy: 1.535804056442066
Energy: 0.9138151343926728
Energy: 1.535804056443512
Energy: 1.1389449369518048
Energy: 0.9190708239338414
Energy: 1.138944936946744
Energy: 0.9190708239345644
Energy: 1.1389449369518048
Energy: 0.9190708239338414
Energy: 0.958198112805777
Energy: 1.2974683113095393
Energy: 0.9581975142647585
Energy: 1.2974683113102625
Energy: 0.9581981128064999
Energy: 1.2974683113105911
Energy: 0.9027124982906484
Energy: 1.5630602497357546
Energy: 0.9027124982953807
Energy: 1.5630602497360835
Energy: 0.9027124982939345
Energy: 1.5630602497393697
Energy: 0.9666652368142795
Energy: 0.9392590066306428
Energy: 0.9666652368190118
Energy: 0.9392590066313655
Energy: 0.9666652368128337
Energy: 0.9392590066328117
Energy: 1.283258490476521
Energy: 0.8630715489147427
Energy: 1.2832584904761266
Energy: 0.8630715489140198
Energy: 1.283258490475798
Energy: 0.863071548905344
Energy: 0.9540876384844457
Energy: 1.2182395773817616
Energy: 0.9540876384851684
Energy: 1.218239577381433
Energy: 0.9540876384858915
Energy: 1.218239577374926
Energy: 1.5364014511954067
Energy: 0.9577486512675825
Energy: 1.5364014511939608
Energy: 0.9577486512679111
Energy: 1.53640145119613
Energy: 0.957748651267188
Energy: 0.9137389468702077
Energy: 1.269295432009251
Energy: 0.913714978160239
Energy: 1.2692954320081993
Energy: 0.9137389468669213
Energy: 1.2692954320132603
Energy: 1.4088677610652673
Energy: 1.3771632161375555
Energy: 1.408867761067042
Energy: 1.3771632161364382
Energy: 1.4088677610663192
Energy: 1.3771632161386074
Energy: 0.8746713489144894
Energy: 1.2957615026585032
Energy: 0.874671348914095
Energy: 1.2957615026599492
Energy: 0.8746713489144894
Energy: 1.2957615026560056

minimum gb energy = 0.863071548905344 eV
minimum distance =  2.40202753137121 Angstroms
sigma value = 67


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

Energy: 1.0620381049497598
Energy: 0.8655292608401126
Energy: 1.0620381049497598
Energy: 0.8655292608401126
Energy: 1.0620381049497598
Energy: 0.8655292608401126
Energy: 0.9886140276881094
Energy: 0.8015661715070594
Energy: 0.9886140276881094
Energy: 0.8015661715094756
Energy: 0.9886140276905254
Energy: 0.8015661715070594
Energy: 0.8224935619219197
Energy: 1.0873443381506427
Energy: 0.8224935619460794
Energy: 1.0873443381506427
Energy: 1.094975733596396
Energy: 1.0873443381506427
Energy: 0.9884354347437044
Energy: 0.8017326423078899
Energy: 0.9884354347437044
Energy: 0.8017326423078899
Energy: 0.9884354347461203
Energy: 0.8017326423103058
Energy: 1.0620381049497598
Energy: 0.8655292608401126
Energy: 1.0620381049473437
Energy: 0.8655292608401126
Energy: 1.0620381049497598
Energy: 0.8655292608401126
Energy: 0.9886140276905254
Energy: 0.8015661715070594
Energy: 0.9886140276905254
Energy: 0.8015661715094756
Energy: 0.9886140276881094
Energy: 0.8015661715070594
Energy: 1.094975733596396
Energy: 1.0873443381506427
Energy: 1.09497573359398
Energy: 1.0873443381482268
Energy: 1.09497573359398
Energy: 1.0873443381506427

minimum gb energy = 0.8015661715070594 eV
minimum distance =  2.39930976637739 Angstroms
sigma value = 3


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

Energy: 1.208563308280762
Energy: 1.090523681441312
Energy: 1.156712991173463
Energy: 1.0905236814446
Energy: 1.2085633082774743
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Energy: 0.901149833417469
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Energy: 0.9249787515723535
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Energy: 1.0349573742354017
Energy: 1.1253199138923358
Energy: 1.0349573741729947
Energy: 1.1253199138890482
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Energy: 1.102860565148576
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Energy: 0.9605746713105915
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Energy: 1.0030548261112644
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Energy: 0.9968421659587438
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Energy: 1.0019083921917749
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Energy: 0.9928966395052845
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Energy: 0.9407924471537322
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Energy: 0.960570166208942
Energy: 0.9227410193579485
Energy: 0.9605701662056544
Energy: 0.9238358977069515
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Energy: 1.0711446752756237
Energy: 1.0435318808598102
Energy: 1.0177508944276688
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Energy: 1.0711446752756237
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Energy: 1.1326916432000216
Energy: 1.0092375127959852
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Energy: 0.9808913107803907
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Energy: 0.9948990560284562
Energy: 0.9166116381363341
Energy: 0.9950073260703933
Energy: 0.9167323143653823
Energy: 1.0636191269672448
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Energy: 0.9563995955995782
Energy: 1.1802204598787536
Energy: 0.9562386434257851
Energy: 1.1802204599543114
Energy: 0.9587821877514012
Energy: 0.9721521832876295
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Energy: 1.0488916377998516
Energy: 0.9721521832909173
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Energy: 1.153237599960626
Energy: 1.015962023348321
Energy: 1.1356994609764821
Energy: 1.015962023351609
Energy: 1.1355725115036013
Energy: 1.015962023351609
Energy: 0.9719554694689582
Energy: 1.1163371480367736
Energy: 0.9723917469559129
Energy: 1.0476134208190107
Energy: 0.971955469472246
Energy: 1.0199573740763346
Energy: 1.310993311330651
Energy: 0.8756683630406173
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Energy: 0.8765401288113361
Energy: 1.3109933113273633
Energy: 0.877888656395859
Energy: 0.9228161736088059
Energy: 1.0783084349076535
Energy: 0.9228161736088059
Energy: 1.0783084349043657
Energy: 0.9228161736120936
Energy: 1.0783084349076535
Energy: 1.0415663486168047
Energy: 1.0158150405460327
Energy: 1.0408826727488159
Energy: 1.015815040542745
Energy: 1.041242550848037
Energy: 1.015815040542745
Energy: 1.0037014240175368
Energy: 0.9501696505839144
Energy: 1.0036969345881137
Energy: 0.9496721578749548
Energy: 1.0037014240208246
Energy: 0.9496006484237113
Energy: 1.2448593761976388
Energy: 0.9342373683014844
Energy: 1.2448593761976388
Energy: 0.934237368304772
Energy: 1.244859376194351
Energy: 0.934237368304772
Energy: 0.9662708002283854
Energy: 1.2695016345182808
Energy: 0.9656675722593256
Energy: 1.2695016345182808
Energy: 0.9658300702101447
Energy: 1.2695016345182808
Energy: 0.9877196330904564
Energy: 0.9583135774897764
Energy: 0.970867488901095
Energy: 0.958313577493064
Energy: 1.0106786480311798
Energy: 0.9583135774897764
Energy: 1.019350054360822
Energy: 1.0988216283655874
Energy: 1.0193500543575345
Energy: 1.0988216283655874
Energy: 1.0193500543543066
Energy: 1.098821628368875
Energy: 1.1287259342399827
Energy: 0.9812117312554048
Energy: 1.1287259342465583
Energy: 0.9573949210842241
Energy: 1.1287259342465583
Energy: 0.9816939654731576
Energy: 0.9307327498393057
Energy: 1.0930963806537428
Energy: 0.9799514603654864
Energy: 1.093096380650455
Energy: 1.042734976206811
Energy: 1.0930963806537428
Energy: 1.0902749847166546
Energy: 1.0302932323739045
Energy: 1.0902749847199422
Energy: 1.0330885542393247
Energy: 1.09027498472323
Energy: 0.9207298705184792
Energy: 1.0040801086472628
Energy: 0.9103299174122509
Energy: 1.0040801086472628
Energy: 0.909179119739912
Energy: 1.0040801086472628
Energy: 0.9117140836761958
Energy: 1.066000248040468
Energy: 1.0143940536809697
Energy: 1.066000248040468
Energy: 1.014394053677682
Energy: 1.0660002480437556
Energy: 1.0143940536711065
Energy: 1.1848794169571206
Energy: 1.0145416306302106
Energy: 1.1847779330365762
Energy: 1.0145416306302106
Energy: 1.185768294741653
Energy: 1.0145416306302106

minimum gb energy = 0.8756683630406173 eV
minimum distance =  2.38364942081302 Angstroms
sigma value = 81


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

Energy: 1.1396393291937228
Energy: 1.0880455800483464
Energy: 1.0680033702703744
Energy: 1.0880455800478952
Energy: 1.1396393291937228
Energy: 1.088045580047444
Energy: 1.094385151082127
Energy: 1.076277138415686
Energy: 1.0943851510816758
Energy: 1.076277138415686
Energy: 1.094385151082127
Energy: 1.076277138412117
Energy: 1.4217800544516208
Energy: 1.0882988595510688
Energy: 0.968995228335007
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Energy: 1.4217800544516208
Energy: 1.0882988595515202
Energy: 1.144463467974943
Energy: 1.1854885655142966
Energy: 1.1444634679753942
Energy: 1.1854885652147988
Energy: 1.144463467974943
Energy: 1.1854885643271764
Energy: 1.1233249551148523
Energy: 1.018106657541643
Energy: 1.1233249551134983
Energy: 1.0181066575384845
Energy: 1.1233249551148523
Energy: 1.018106657541643
Energy: 0.9847998481240591
Energy: 0.9196576026862157
Energy: 0.9847998462833853
Energy: 0.9196576026862157
Energy: 0.984799847579212
Energy: 0.9196576026871183
Energy: 0.8897444114845455
Energy: 0.9198702808292348
Energy: 0.889744411485448
Energy: 0.9198702808287836
Energy: 0.8897444114845455
Energy: 0.9198702808296861
Energy: 1.121992796349415
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Energy: 1.122771475448845
Energy: 1.1219927963485123
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Energy: 1.0756720903779773
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Energy: 1.1348263517065482
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Energy: 1.4650355124124987
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Energy: 0.9598609636380834
Energy: 1.095051811471626
Energy: 0.959860963637632
Energy: 1.095222432242245
Energy: 0.9598609636362784
Energy: 0.9205862891508184
Energy: 0.9845317193914314
Energy: 0.920586289150367
Energy: 0.984531719388724
Energy: 0.9205862891508184
Energy: 0.9845317193900777
Energy: 1.0939229710541736
Energy: 1.1248893248455745
Energy: 1.093922971055076
Energy: 1.1248893248451233
Energy: 1.093922971055076
Energy: 1.1248893248451233
Energy: 1.1336697196764827
Energy: 1.0915804663200646
Energy: 1.1336697196764827
Energy: 1.0915804663196131
Energy: 1.1336697196796413
Energy: 1.0915804663178081
Energy: 1.0935221620089108
Energy: 0.9602652533857419
Energy: 1.0935221620084594
Energy: 0.9602652533861932
Energy: 1.0935221620089108
Energy: 0.9602652533875469
Energy: 1.1217458604615023
Energy: 1.0376443599550071
Energy: 1.121745860459246
Energy: 1.0376443599550071
Energy: 1.121745860461051
Energy: 1.0376443599550071
Energy: 1.1093661191817479
Energy: 0.9206482072650986
Energy: 1.1093661191821993
Energy: 0.9206482072650986
Energy: 1.1093661191808455
Energy: 0.9206482072637449
Energy: 0.8653754730685843
Energy: 1.1915166735893477
Energy: 0.8656416967473497
Energy: 1.1915166735893477
Energy: 0.8653754730685843
Energy: 1.1915166735893477
Energy: 1.0882725494526329
Energy: 1.0298857784021624
Energy: 1.0882725494521817
Energy: 1.029885778412541
Energy: 1.088272549453084
Energy: 1.0298857784287854
Energy: 1.1858569293772048
Energy: 0.8740788839221452
Energy: 1.1858568923841786
Energy: 0.8740224623564309
Energy: 1.18585684983615
Energy: 0.8843654112739497
Energy: 1.0214752684792814
Energy: 1.124918379235869
Energy: 1.0214752684833426
Energy: 1.124918379235869
Energy: 1.0214752685776098
Energy: 1.124918379237674
Energy: 0.9927192599067285
Energy: 1.0012526418602856
Energy: 0.9196491304820705
Energy: 1.0012526418602856
Energy: 0.9927192599062771
Energy: 1.001252641858932
Energy: 0.9928362439606674
Energy: 1.0050734615355628
Energy: 0.9194637270331978
Energy: 1.0050734615355628
Energy: 0.9928362439606674
Energy: 1.0050734615351113
Energy: 1.1191257626226252
Energy: 1.1236347803714812
Energy: 1.1191257626199178
Energy: 1.1236347803714812
Energy: 1.1191257626217226
Energy: 1.1236347803710298
Energy: 1.1340207181749058
Energy: 0.9402098142804679
Energy: 1.1340207181731419
Energy: 0.9534483874469871
Energy: 1.134020718131177
Energy: 0.9533242028709067
Energy: 1.0883162400527175
Energy: 1.4087971743384482
Energy: 1.0883162390338266
Energy: 1.4087971743384482
Energy: 1.0883162374903945
Energy: 1.4087971743316798
Energy: 0.8655191059563727
Energy: 1.145961986841238
Energy: 0.8655191059545678
Energy: 1.1459619868434943
Energy: 0.8655191059563727
Energy: 1.1459619868416893
Energy: 1.0889776222355612
Energy: 0.9202995409575999
Energy: 1.08897762223511
Energy: 0.9202995409575999
Energy: 1.0889776222324024
Energy: 0.9202995409571487
Energy: 1.127985357494739
Energy: 1.10902948074061
Energy: 1.1280798465301367
Energy: 1.1090294807410612
Energy: 1.1279853574938368
Energy: 1.1090294807415126
Energy: 1.0934471045473184
Energy: 0.9105515038571415
Energy: 1.0934471045491232
Energy: 0.910551503858044
Energy: 1.0934471045477694
Energy: 0.9105515038566904
Energy: 1.1862612792631386
Energy: 1.0920911069426849
Energy: 1.1862612792644927
Energy: 1.0920911069435875
Energy: 1.1862612792437357
Energy: 1.0920911069440389
Energy: 1.017906546723101
Energy: 1.1233858235292833
Energy: 1.0179065467221986
Energy: 1.1233858235292833
Energy: 1.0179065467221986
Energy: 1.1233858235274785
Energy: 0.9200276623188186
Energy: 0.985353827763554
Energy: 0.9200276623174649
Energy: 0.9788447769572179
Energy: 0.9200276623183674
Energy: 0.9788733327334347
Energy: 1.044207848833156
Energy: 0.8882352950586553
Energy: 1.044207848831351
Energy: 0.8882352950568502
Energy: 1.04420784883451
Energy: 0.8882352950600089
Energy: 0.8967458371693198
Energy: 1.4650832266063043
Energy: 0.8966366210102065
Energy: 1.4650832266049507
Energy: 0.8965271374622886
Energy: 1.465083226605402
Energy: 0.8711447218625609
Energy: 1.1866070247195186
Energy: 0.8721417268740878
Energy: 0.9630703250987299
Energy: 0.8729918077850644
Energy: 0.962755880935449
Energy: 1.127886530723801
Energy: 1.0488249647805885
Energy: 1.1278865307233499
Energy: 1.04882496478104
Energy: 1.127886530723801
Energy: 1.0488249647805885
Energy: 0.9609132266145206
Energy: 0.9199577380789593
Energy: 0.9609132266154231
Energy: 0.9199577380789593
Energy: 0.9609132266154231
Energy: 0.9199577380767442

minimum gb energy = 0.8653754730685843 eV
minimum distance =  2.41035394208395 Angstroms
sigma value = 43


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

Energy: 1.3056837161565396
Energy: 1.105156255162744
Energy: 1.305683716155985
Energy: 1.105156255162744
Energy: 1.305683716155985
Energy: 1.105156255162744
Energy: 1.185422792618536
Energy: 0.9409474370030677
Energy: 1.1854227926190901
Energy: 0.9409474370030677
Energy: 1.1854227926190901
Energy: 0.9409474370041764
Energy: 0.9581593182195765
Energy: 1.3689719728457872
Energy: 1.2203189108673544
Energy: 1.368971972845233
Energy: 1.2203189108668002
Energy: 1.368971972845233
Energy: 1.0873572819190878
Energy: 0.8747818929623915
Energy: 1.0873572819196422
Energy: 0.8749376912316447
Energy: 1.0873572819196422
Energy: 0.8754035035649506
Energy: 1.0963441570180337
Energy: 0.8603401714184165
Energy: 1.0963441570180337
Energy: 0.8580248667626891
Energy: 1.0963441570180337
Energy: 0.8596135980445396
Energy: 0.9480490065192326
Energy: 1.031146034512416
Energy: 0.946571595167415
Energy: 1.0311460345118617
Energy: 0.9478687993168725
Energy: 1.0311460345113073
Energy: 1.1032057351524607
Energy: 1.2636681697161491
Energy: 1.103205735155232
Energy: 1.2636681697161491
Energy: 1.1032057351546776
Energy: 1.2636681697161491
Energy: 1.0120198806256138
Energy: 0.8840295339844573
Energy: 1.0120198806256138
Energy: 0.8689324869257132
Energy: 1.0120198806256138
Energy: 0.868542875259796
Energy: 1.3002151271567826
Energy: 0.8973943480339848
Energy: 1.3002155704264897
Energy: 0.8973943480334305
Energy: 1.300215476134005
Energy: 0.8973943480323221
Energy: 0.8243944323028497
Energy: 1.2301004082381806
Energy: 0.8247867470296572
Energy: 1.2301004082365177
Energy: 0.8227337766074999
Energy: 1.2301004082387346
Energy: 1.3028113322537649
Energy: 1.0455435760569134
Energy: 1.3028113322543193
Energy: 1.0455435760591305
Energy: 1.3028113322537649
Energy: 1.045543576058022
Energy: 1.0123802612990724
Energy: 1.0668895363207829
Energy: 1.012380261297964
Energy: 1.0668845916520746
Energy: 1.01238026129353
Energy: 1.0667400747625917
Energy: 1.0815230517632601
Energy: 1.0205149053466036
Energy: 1.0815035370672907
Energy: 1.0205149053471578
Energy: 1.0815730274381194
Energy: 1.0205149053466036
Energy: 0.8723509309537443
Energy: 1.2431721849805852
Energy: 0.8723509309542985
Energy: 1.2431721849805852
Energy: 0.8723509309542985
Energy: 1.243172184986682
Energy: 1.2636734242815546
Energy: 0.8774226863247604
Energy: 1.263673424282109
Energy: 0.8773669915342548
Energy: 1.263673424279892
Energy: 0.8773518433148859
Energy: 0.937766636287158
Energy: 0.8342097044321354
Energy: 0.937824099338212
Energy: 0.8218338773689963
Energy: 0.937961374039805
Energy: 0.8338104064581309
Energy: 0.9266149728128564
Energy: 0.943068277816919
Energy: 0.9267647155371661
Energy: 0.9430682778174482
Energy: 0.9281279819845302
Energy: 0.943068277816919
Energy: 1.3320251822174183
Energy: 1.035884520908045
Energy: 1.332025182216864
Energy: 1.0358845209013936
Energy: 1.3320251822174183
Energy: 1.0358845208880914
Energy: 1.236422519063171
Energy: 1.05098532706845
Energy: 1.23642251904876
Energy: 1.05098532706845
Energy: 1.2364225190615081
Energy: 1.050985327069004
Energy: 0.9279288913492022
Energy: 0.9423671813903268
Energy: 0.9267002532261936
Energy: 0.9423671813903268
Energy: 0.9289893115453192
Energy: 0.9423671813903268
Energy: 0.938112243372186
Energy: 0.9758817675772947
Energy: 0.9375810517918012
Energy: 0.9758817675795117
Energy: 0.9375578744052236
Energy: 0.9758817675640176
Energy: 1.2959897839927417
Energy: 1.117532006010395
Energy: 1.2959897839927417
Energy: 1.117532006010395
Energy: 1.2959897839921874
Energy: 1.117532006010395
Energy: 0.872214480286871
Energy: 1.1911343741815286
Energy: 0.872214480286871
Energy: 1.1911343741809743
Energy: 0.872214480284654
Energy: 1.1911343741820826
Energy: 1.0810591112151378
Energy: 1.019277513347939
Energy: 1.0812621610601145
Energy: 1.0192775133484933
Energy: 1.0813111008648513
Energy: 1.0192775133484933
Energy: 1.0117975603593963
Energy: 1.014335281958692
Energy: 1.0117975603599507
Energy: 1.0143352819548122
Energy: 1.0117975603599507
Energy: 1.0143352819603546
Energy: 1.2980631234458635
Energy: 1.1091992402323847
Energy: 1.2980631234469722
Energy: 1.1091992402323847
Energy: 1.2980631234458635
Energy: 1.109199240232939
Energy: 0.8245376307261445
Energy: 1.0492436534290663
Energy: 0.8251628091888648
Energy: 1.0492436534290663
Energy: 0.8239198269188607
Energy: 1.0492436534301748
Energy: 1.0123364251007607
Energy: 0.8973994538827295
Energy: 1.0626347159060505
Energy: 0.8973994538843922
Energy: 1.0117787599195653
Energy: 0.8973994538827295
Energy: 1.0120541925199873
Energy: 0.8812804585229821
Energy: 1.0120541925199873
Energy: 0.8635600296464746
Energy: 1.012054192519433
Energy: 0.8701586054525994
Energy: 1.091232594638288
Energy: 1.1568538644191724
Energy: 1.0912325946349621
Energy: 1.1568538644435598
Energy: 1.0912325946349621
Energy: 1.156853864414184
Energy: 0.9465880725925905
Energy: 1.031398482789722
Energy: 0.9482552570975936
Energy: 1.0313984827947105
Energy: 0.9434952676639521
Energy: 1.0313984827902765

minimum gb energy = 0.8218338773689963 eV
minimum distance =  2.38266394761988 Angstroms
sigma value = 57


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

Energy: 1.177411257550511
Energy: 0.9779254718594158
Energy: 1.1774112575497935
Energy: 0.9779254718594158
Energy: 1.1774112575512288
Energy: 0.9779254718594158
Energy: 1.0773205054653043
Energy: 0.8558483254496188
Energy: 1.0773205055463337
Energy: 0.8558483254489011
Energy: 1.0773205056503607
Energy: 0.8558483254481837
Energy: 0.8312008434349509
Energy: 1.2031735412199687
Energy: 0.7699889894816444
Energy: 1.2031735412292983
Energy: 0.7699586973669056
Energy: 1.203173541231451
Energy: 1.4005214363336793
Energy: 0.8227841433802993
Energy: 1.4005214363336793
Energy: 0.8230705579861519
Energy: 1.400521436334397
Energy: 0.8235834694085181
Energy: 1.1366842141732931
Energy: 0.832828902637261
Energy: 1.1366842141740108
Energy: 0.8325483454372092
Energy: 1.1366842141732931
Energy: 0.8328120556181933
Energy: 0.8244095197496167
Energy: 1.1450645865230806
Energy: 0.8158900085946881
Energy: 1.145064586522363
Energy: 0.8160578271442747
Energy: 1.1450645865230806
Energy: 1.0354927051229468
Energy: 0.9488771252881092
Energy: 1.0354927064278
Energy: 0.9488771283575694
Energy: 1.0354927047528015
Energy: 0.948877123951712
Energy: 1.0417922455450086
Energy: 0.9774995869925516
Energy: 1.0417922455471618
Energy: 0.9774995869925516
Energy: 1.041792245539985
Energy: 0.9774995869925516
Energy: 1.135069213833465
Energy: 0.8588558398491548
Energy: 1.135069213833465
Energy: 0.8588558398513076
Energy: 1.135069213833465
Energy: 0.858855839852743
Energy: 0.7480478656118977
Energy: 1.1929647533123657
Energy: 0.7480478656118977
Energy: 1.1929647533123657
Energy: 0.7480478656111801
Energy: 1.1929647533145187
Energy: 1.0155282957032035
Energy: 0.8227371577980856
Energy: 1.0155282957032035
Energy: 0.8226872671817014
Energy: 1.0155282957032035
Energy: 0.8228432680950852
Energy: 1.070814688662547
Energy: 0.9256164029349504
Energy: 1.070814688662547
Energy: 0.9256212203646338
Energy: 1.070814688662547
Energy: 0.9259012861766489
Energy: 0.7087038362826948
Energy: 0.8588541439991729
Energy: 0.6717571040475625
Energy: 0.8588541440013261
Energy: 0.667281431504108
Energy: 0.8588541440013261
Energy: 0.8824139467726274
Energy: 0.8555843822574086
Energy: 0.8824139467719097
Energy: 0.8555843822853969
Energy: 0.8824139467640155
Energy: 0.8555843822846794
Energy: 0.882880564651674
Energy: 0.857218080823294
Energy: 0.8828805646545447
Energy: 0.8572180808247292
Energy: 0.8828805646523917
Energy: 0.857218080823294
Energy: 1.070714081401065
Energy: 0.9993119583372203
Energy: 1.0707140813996296
Energy: 0.9993119583372203
Energy: 1.0707140814017826
Energy: 0.9993119583372203
Energy: 0.7490640289196465
Energy: 1.0774424681234382
Energy: 0.7490640289167759
Energy: 1.0774424681227204
Energy: 0.7490640289196465
Energy: 1.0774424681234382
Energy: 1.0138144057214715
Energy: 0.6744409354401888
Energy: 1.0138144057200689
Energy: 0.6736612549175627
Energy: 1.0138144057193512
Energy: 0.673891178025293
Energy: 0.7509161025034284
Energy: 1.0772938288167415
Energy: 0.7509161030263679
Energy: 1.0772938288167415
Energy: 0.7509161021203657
Energy: 1.0772938288174592
Energy: 1.0708932185635613
Energy: 0.9992395091498358
Energy: 1.070893218564279
Energy: 0.9992395091498358
Energy: 1.0708932185635613
Energy: 0.9992395091498358
Energy: 0.882513013932908
Energy: 0.8569319997320249
Energy: 0.8825130139393342
Energy: 0.8569319997270014
Energy: 0.8825130139357787
Energy: 0.8569319997334603
Energy: 0.8823917427096343
Energy: 0.9088840810160009
Energy: 0.8823898009400635
Energy: 0.9088840810160009
Energy: 0.8823913917022329
Energy: 0.9088840810160009
Energy: 0.7277043118314818
Energy: 0.854705171089338
Energy: 0.6680912930330224
Energy: 0.8547051710907733
Energy: 0.6683926407488054
Energy: 0.8547051710907733
Energy: 1.071193841705823
Energy: 1.0641685533064635
Energy: 1.071193841705823
Energy: 1.0641660862541813
Energy: 1.0711938417065405
Energy: 1.0641547351009026

minimum gb energy = 0.667281431504108 eV
minimum distance =  2.34343819414289 Angstroms
sigma value = 17


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

Energy: 1.1225127856886357
Energy: 0.8784952485213139
Energy: 1.1225127856876207
Energy: 0.8784952485213139
Energy: 1.1225127856886357
Energy: 0.8784952485213139
Energy: 0.8523177239207127
Energy: 0.9428460309272068
Energy: 0.8523177238730119
Energy: 0.9428460309291905
Energy: 0.852317723927817
Energy: 0.9428460309281755
Energy: 1.0351320828747592
Energy: 1.1320414524875597
Energy: 1.0351320828747592
Energy: 1.132041452486545
Energy: 1.0351320828767892
Energy: 1.132041452486545
Energy: 0.8501778138984377
Energy: 1.1645462212481728
Energy: 0.8501778138974228
Energy: 1.1645462212430981
Energy: 0.8501778138984377
Energy: 1.1645462212207702
Energy: 0.6951649009311877
Energy: 1.1343068531631832
Energy: 0.6949089085659165
Energy: 1.134306853165213
Energy: 0.6950511383089746
Energy: 1.134306853164198
Energy: 0.8734063119582856
Energy: 0.9295625787431017
Energy: 0.8734063119613305
Energy: 0.9295625786913412
Energy: 0.8734063119582856
Energy: 0.9295625787217886
Energy: 1.0114080763043147
Energy: 0.8184350363938085
Energy: 1.0114080763032998
Energy: 0.8184350363968533
Energy: 1.0114080763053297
Energy: 0.8184350363958385
Energy: 0.8500848699166699
Energy: 0.9812946226354723
Energy: 0.8500848699176848
Energy: 0.9809544974038078
Energy: 0.8500848699186997
Energy: 0.9812551767450944
Energy: 0.7793058637299035
Energy: 0.939385673547633
Energy: 0.7795470565503294
Energy: 0.9393856735466183
Energy: 0.7793938066669598
Energy: 0.9393856735516927
Energy: 1.0012071485455023
Energy: 0.8508392114176163
Energy: 1.0012071485444873
Energy: 0.850839211454107
Energy: 1.0012071485455023
Energy: 0.8508392115292105
Energy: 1.0058205324066583
Energy: 0.7876377150541161
Energy: 1.0058205324066583
Energy: 0.7876377150206241
Energy: 1.0058205324056433
Energy: 0.7876377150815188
Energy: 0.7783183938112554
Energy: 0.9443178073202326
Energy: 0.7783480994914662
Energy: 0.9443178073192178
Energy: 0.7786336189491015
Energy: 0.9443178073202326
Energy: 0.8458565194330708
Energy: 1.024041670053781
Energy: 0.8458565194320558
Energy: 1.024041670053781
Energy: 0.8458565194330708
Energy: 1.0240416700527664
Energy: 1.005331375240878
Energy: 0.8446545791008035
Energy: 1.0053313752398632
Energy: 0.8446545790287908
Energy: 1.005331375240878
Energy: 0.8446545781898274
Energy: 1.0192086962844777
Energy: 0.7973487615803749
Energy: 1.0192086962682392
Energy: 0.797348761578345
Energy: 1.0192086962104352
Energy: 0.7973487615813899
Energy: 0.8706871664675284
Energy: 1.2017983392146527
Energy: 0.8706871663690819
Energy: 1.2016741520963716
Energy: 0.8706871662595637
Energy: 1.2023011425959425
Energy: 1.0036416414970741
Energy: 0.842165550683484
Energy: 1.0036416414950444
Energy: 0.8417982825900436
Energy: 1.0036416414960594
Energy: 0.717620469628673

minimum gb energy = 0.6949089085659165 eV
minimum distance =  2.35771441208497 Angstroms
sigma value = 17


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

Energy: 0.8413078273700704
Energy: 0.790809937325958
Energy: 0.8413078273618401
Energy: 0.7908099373306612
Energy: 0.8413078274186689
Energy: 0.7908099373294855
Energy: 0.8989555467974129
Energy: 0.9519508764884247
Energy: 0.8989555467919259
Energy: 0.9519508764888166
Energy: 0.8989555467927098
Energy: 0.9519508764892084
Energy: 0.9269790461067393
Energy: 0.9222053391541308
Energy: 0.9269790461094829
Energy: 0.9222053391549146
Energy: 0.9269790461051716
Energy: 0.922205339153739
Energy: 0.8236233273569743
Energy: 0.7517660908169156
Energy: 0.8236233273597175
Energy: 0.7514708442473458
Energy: 0.8236233273538388
Energy: 0.7519585062625355
Energy: 0.8312172940583192
Energy: 0.8406720816070391
Energy: 0.8312172940880695
Energy: 0.8406720816572054
Energy: 0.8312172940727846
Energy: 0.8406720816062554
Energy: 0.9082287352874089
Energy: 0.8946202141356733
Energy: 0.9082287352893685
Energy: 0.8946202141341058
Energy: 0.9082287352905443
Energy: 0.8946202141341058
Energy: 0.8460849508757521
Energy: 1.0000397901979998
Energy: 0.8460849508761441
Energy: 1.0000397901979998
Energy: 0.8460849508761441
Energy: 1.0000397901979998
Energy: 0.9697117657709713
Energy: 1.0959156113062514
Energy: 0.9697117657901755
Energy: 1.0959156113054673
Energy: 0.969711765792919
Energy: 1.0959156113070352
Energy: 0.8322018542628162
Energy: 0.9566715906102086
Energy: 0.8322018542639921
Energy: 0.9566715906090328
Energy: 0.8322018542616404
Energy: 0.9566715906090328
Energy: 0.8456903456547123
Energy: 0.8793792254887695
Energy: 0.8456903456551041
Energy: 0.8793792254887695
Energy: 0.8456903456531446
Energy: 0.8793792254887695
Energy: 0.8807081290056575
Energy: 0.8185531529548583
Energy: 0.8807081290052656
Energy: 0.8187821718360626
Energy: 0.8807081290060496
Energy: 0.8188968619764607
Energy: 0.922127362315226
Energy: 0.9859015755606821
Energy: 0.9221273622694066
Energy: 0.9859015755598982
Energy: 0.9221273622607844
Energy: 0.9859015755602902
Energy: 0.9868430804550479
Energy: 0.9611245618341966
Energy: 0.986843080454656
Energy: 0.9611245618345885
Energy: 0.9868430804550479
Energy: 0.9611245618345885
Energy: 0.9844330792576037
Energy: 0.8138165379797565
Energy: 0.9844330792552523
Energy: 0.8138165379911222
Energy: 0.9844330792572117
Energy: 0.8138165379879867
Energy: 0.7654486448640652
Energy: 0.8207621630893799
Energy: 0.7652167335050367
Energy: 0.8207621630909476
Energy: 0.7647814745123398
Energy: 0.8207621630886318
Energy: 0.9221247481365634
Energy: 0.9109231643185197
Energy: 0.9221247481365634
Energy: 0.910923164316168
Energy: 0.9221247481353877
Energy: 0.9109231643157761
Energy: 0.9308976845441944
Energy: 1.0023786430402053
Energy: 0.9308976845422349
Energy: 1.0023786430402053
Energy: 0.9308976845434106
Energy: 1.0023786430402053
Energy: 1.0751407114928029
Energy: 0.7673473700419265
Energy: 1.075140711491235
Energy: 0.7673473700419265
Energy: 1.0751407114924107
Energy: 0.7673473700423186
Energy: 1.0425333562640076
Energy: 0.8855399031860536
Energy: 1.0425333562620482
Energy: 0.8855399033063024
Energy: 1.0425333562628318
Energy: 0.8855399032455901
Energy: 0.9299340105537699
Energy: 0.8371066108190617
Energy: 0.9299340105510265
Energy: 0.8029010734123401
Energy: 0.9299340105537699
Energy: 0.7959791902001147
Energy: 1.0425673151251051
Energy: 0.8896310476107542
Energy: 1.0425673151243213
Energy: 0.889631047658925
Energy: 1.0425673151251051
Energy: 0.8896310476859677
Energy: 1.0753545814697387
Energy: 0.7672131578542009
Energy: 1.0753545814673873
Energy: 0.767213157858904
Energy: 1.0753545814677792
Energy: 0.7672131578565524
Energy: 0.9310201553156928
Energy: 1.002638212393792
Energy: 0.9310201553172606
Energy: 1.0026382123934
Energy: 0.9310201553160848
Energy: 1.002638212394184
Energy: 0.9217832351276088
Energy: 0.9510761064378662
Energy: 0.9217832351283928
Energy: 0.9510761064398258
Energy: 0.9217832351280008
Energy: 0.9510761064374743
Energy: 0.7648251665104381
Energy: 0.8201753303184331
Energy: 0.7648644736334098
Energy: 0.8201753303211764
Energy: 0.7648797350259782
Energy: 0.8201753303203926
Energy: 0.9839243551423199
Energy: 0.8141422616687198
Energy: 0.9839243551431036
Energy: 0.814142261667936
Energy: 0.9839243551419279
Energy: 0.8141422616667602
Energy: 0.985599923382271
Energy: 0.9609269284701517
Energy: 0.9855999233826631
Energy: 0.9609269284697598
Energy: 0.9855999233810954
Energy: 0.9609269284697598
Energy: 0.9223117844062205
Energy: 0.9859654766144007
Energy: 0.9223117843917193
Energy: 0.9859654766144007
Energy: 0.9223117844230732
Energy: 0.9859654766151843
Energy: 0.8804102113112168
Energy: 0.8184140089174188
Energy: 0.8804102113116087
Energy: 0.8178185146806474
Energy: 0.8804102113108248
Energy: 0.8175010033981412
Energy: 0.8456189239539671
Energy: 0.8796428906797424
Energy: 0.8456189239527915
Energy: 0.8796428906793505
Energy: 0.8456189239539671
Energy: 0.8796428906793505
Energy: 0.8311437191809155
Energy: 0.9573832685462326
Energy: 0.8311437191840507
Energy: 0.9573832685470165
Energy: 0.8311437191848347
Energy: 0.9573832685478004
Energy: 0.9697356270695469
Energy: 1.0962332833127457
Energy: 0.969735627058181
Energy: 1.0962332833123538
Energy: 0.9697356270828722
Energy: 1.0962332833135295
Energy: 0.8461708621917493
Energy: 1.0001103267148532
Energy: 0.8461708621913574
Energy: 1.0001103267148532
Energy: 0.8461708621941009
Energy: 1.000110326714461
Energy: 0.9057298503727107
Energy: 0.8651004857710347
Energy: 0.9057298503758462
Energy: 0.8651004857718186
Energy: 0.9057298503789815
Energy: 0.8651004857718186
Energy: 0.8309104583100271
Energy: 0.8409813817347473
Energy: 0.8309104583206092
Energy: 0.8409813817359232
Energy: 0.8309104583143383
Energy: 0.8409813817327877
Energy: 0.8235984972666791
Energy: 1.0016785424646844
Energy: 0.8235984972709902
Energy: 1.0016785426108359
Energy: 0.8235984972651116
Energy: 1.0016785422739247
Energy: 0.9268526578023607
Energy: 0.922550747291056
Energy: 0.9268526577988335
Energy: 0.9225507472914478
Energy: 0.9268526577968739
Energy: 0.922550747291056
Energy: 0.8987034238003491
Energy: 0.9143977380851741
Energy: 0.8987034238050522
Energy: 0.9143977380847821
Energy: 0.8987034238089715
Energy: 0.9143977380847821
Energy: 0.8413078274186689
Energy: 0.7908099373239984
Energy: 0.8413078274174929
Energy: 0.7908099373263501
Energy: 0.8413078274241202
Energy: 0.790809937321647
Energy: 0.8989555467981968
Energy: 0.9566281281469867
Energy: 0.8989555467927098
Energy: 0.9566281281473787
Energy: 0.8989555467950613
Energy: 0.9566281281477707
Energy: 0.9269790461126182
Energy: 0.9222053391549146
Energy: 0.9269790461110504
Energy: 0.922205339153739
Energy: 0.9269790461098747
Energy: 0.9222053391541308
Energy: 0.8236233273542307
Energy: 0.6653433530818743
Energy: 0.8236233273550146
Energy: 0.6602127050658388
Energy: 0.8236233273514871
Energy: 0.6654026612167847
Energy: 0.8312172941280458
Energy: 0.8406720816313384
Energy: 0.8312172941135446
Energy: 0.840672081628203
Energy: 0.8312172940955163
Energy: 0.8406720816301626

minimum gb energy = 0.6602127050658388 eV
minimum distance =  2.35893282095306 Angstroms
sigma value = 57


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

Energy: 0.7733442484516733
Energy: 0.8163743107896273
Energy: 0.7733442484535877
Energy: 0.8163743107909035
Energy: 0.7733442484523114
Energy: 0.8163743107896273
Energy: 0.8664775314311243
Energy: 0.843973930825911
Energy: 0.8664775314285719
Energy: 0.8439739308252729
Energy: 0.866477531424743
Energy: 0.8439739308278255
Energy: 0.8582164313999159
Energy: 0.8439177243118967
Energy: 0.858216390206206
Energy: 0.8439177243118967
Energy: 0.8582163474689418
Energy: 0.8439177243131729
Energy: 0.8142409434115417
Energy: 0.9020110934938235
Energy: 0.8142409434453634
Energy: 0.9020110934944616
Energy: 0.814240943407771
Energy: 0.9020110934938235
Energy: 0.7688481402652726
Energy: 0.8123855370925929
Energy: 0.7688481402614438
Energy: 0.8123855370919545
Energy: 0.7688481402627201
Energy: 0.8123855370919545
Energy: 0.9845608200252641
Energy: 0.8031844899657576
Energy: 0.9845608200271786
Energy: 0.8031844899663958
Energy: 0.9845608200252641
Energy: 0.8031844899663958
Energy: 0.8003332972104882
Energy: 0.939251530406328
Energy: 0.8003332972124024
Energy: 0.9392515304082423
Energy: 0.800333297214317
Energy: 0.9392515304076041
Energy: 0.962990111839118
Energy: 0.9471352013812737
Energy: 0.9629901118359272
Energy: 0.9471352013825498
Energy: 0.962990111839118
Energy: 0.9471352013799973
Energy: 0.8772585327749829
Energy: 0.8081094290555247
Energy: 0.8772585327756212
Energy: 0.8081094290574391
Energy: 0.8772585327756212
Energy: 0.8081094290574391
Energy: 0.813664289002997
Energy: 0.9003989738150624
Energy: 0.813664289003635
Energy: 0.9003989738144242
Energy: 0.8136642890017205
Energy: 0.9003989738144242
Energy: 0.8001311360904984
Energy: 0.9927743592383733
Energy: 0.8001311360879457
Energy: 0.9927743592396496
Energy: 0.8001311360904984
Energy: 0.9927743592377352
Energy: 0.8787769856386188
Energy: 0.8112529042354614
Energy: 0.8787769856367044
Energy: 0.8112529042348232
Energy: 0.8787769856386188
Energy: 0.8112529042341851
Energy: 0.8245716146665812
Energy: 0.862914828317838
Energy: 0.8245716146653049
Energy: 0.8629148283191143
Energy: 0.8245716146672194
Energy: 0.8629148283191143
Energy: 0.8579859742816754
Energy: 0.8401409105371949
Energy: 0.8579859742816754
Energy: 0.8401409105340042
Energy: 0.8579859742766283
Energy: 0.840140910533366
Energy: 0.7707674736307647
Energy: 0.898929078979439
Energy: 0.7714131856122868
Energy: 0.8989290789730575
Energy: 0.7715131879700476
Energy: 0.8989290789762483
Energy: 0.8670659974426513
Energy: 0.8623830960792283
Energy: 0.8670659974407369
Energy: 0.8623830960785903
Energy: 0.867065997442013
Energy: 0.8623830960792283
Energy: 0.8967958359944345
Energy: 0.774502065107646
Energy: 0.8967958359944345
Energy: 0.7745020651101984
Energy: 0.8967958359950726
Energy: 0.7745020651108366
Energy: 0.7290558912641264
Energy: 0.7990580647984443
Energy: 0.7320307422055115
Energy: 0.7990580647990825
Energy: 0.7321500332027777
Energy: 0.799058064793339
Energy: 0.8440714464451883
Energy: 0.8257953390463741
Energy: 0.8440714464458264
Energy: 0.8257953390393545
Energy: 0.8440714464445503
Energy: 0.8257953390399927
Energy: 0.8439061155959241
Energy: 0.9153677234091372
Energy: 0.8439061155959241
Energy: 0.9153677234084991
Energy: 0.8439061155959241
Energy: 0.9153677234091372
Energy: 0.9604033749575474
Energy: 0.7363153593230398
Energy: 0.9604033749569093
Energy: 0.736315359324316
Energy: 0.9604033749575474
Energy: 0.7363153593211255
Energy: 0.8326099994088029
Energy: 0.851803489929694
Energy: 0.8326099994100791
Energy: 0.8522672693249204
Energy: 0.8326099994081646
Energy: 0.8508495854020576
Energy: 0.8441906296321284
Energy: 0.9020825433606542
Energy: 0.8441906296334046
Energy: 0.9020825433606542
Energy: 0.8441906296327665
Energy: 0.9020825433606542
Energy: 0.9300323114211069
Energy: 1.021878965486375
Energy: 0.9300323114217449
Energy: 1.0219146596116144
Energy: 0.9300323114230213
Energy: 1.021898529381911
Energy: 0.9402045289592226
Energy: 0.7389023694454401
Energy: 0.9402045289585845
Energy: 0.738902369449269
Energy: 0.9402045289592226
Energy: 0.7389023694518215
Energy: 0.8186292629275853
Energy: 0.888010326866425
Energy: 0.8186292629269473
Energy: 0.888010326865787
Energy: 0.8186292629275853
Energy: 0.888010326865787
Energy: 0.8324821228169607
Energy: 0.8257057454640665
Energy: 0.8324821228175989
Energy: 0.8257057455188889
Energy: 0.8324821228131317
Energy: 0.8257057454640665

minimum gb energy = 0.7290558912641264 eV
minimum distance =  2.3586738590494 Angstroms
sigma value = 43


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

Energy: 1.0332443739332247
Energy: 0.7240038015162168
Energy: 1.0332443739299702
Energy: 0.7240038015176117
Energy: 1.0332443739336898
Energy: 0.7240038015180766
Energy: 0.7824284114978661
Energy: 0.7818910460954918
Energy: 0.7824284114978661
Energy: 0.7818910460954918
Energy: 0.7824284114978661
Energy: 0.7818910460954918
Energy: 0.8017446094416195
Energy: 0.7822094705663024
Energy: 0.8017446094430144
Energy: 0.7822094705663024
Energy: 0.8017446094434794
Energy: 0.7822094705658373
Energy: 0.9807399196318282
Energy: 0.7775215221680036
Energy: 0.9807399196318282
Energy: 0.7775215221689334
Energy: 0.9807399196341531
Energy: 0.7775215221689334
Energy: 0.7058478366710731
Energy: 0.7342029858116536
Energy: 0.7058474710997356
Energy: 0.7342029858116536
Energy: 0.7058473902804954
Energy: 0.7342029858135134
Energy: 0.7600377172027831
Energy: 0.7136950524080541
Energy: 0.7600377172018532
Energy: 0.7136950524131684
Energy: 0.7600377172009233
Energy: 0.7136950524131684
Energy: 0.7453972196306455
Energy: 0.8048839716098489
Energy: 0.7453972196311105
Energy: 0.804883971608919
Energy: 0.7453972196301806
Energy: 0.8048839716098489
Energy: 0.8317852581194413
Energy: 0.7076916505961237
Energy: 0.8202545597066137
Energy: 0.7076916505975186
Energy: 0.8202118222764756
Energy: 0.7076916505956586
Energy: 0.7321078190374262
Energy: 0.7022842895835039
Energy: 0.7321078190364962
Energy: 0.7022842895825739
Energy: 0.7321078190378911
Energy: 0.7022842895765719
Energy: 0.7169736013830315
Energy: 0.7657362388158155
Energy: 0.7169736013816367
Energy: 0.7657362388158155
Energy: 0.7169736013825666
Energy: 0.7657362388162805
Energy: 0.8250321093335118
Energy: 0.8081648237342567
Energy: 0.8250321093339769
Energy: 0.8081648237333692
Energy: 0.8250321093330469
Energy: 0.8081648237351867
Energy: 0.7304989496550031
Energy: 0.7024625665472071
Energy: 0.730498949655468
Energy: 0.7024625665425576
Energy: 0.7304989496550031
Energy: 0.7024625665434874
Energy: 0.7167859831411741
Energy: 0.7237337112807581
Energy: 0.7167859831462463
Energy: 0.7237337112812232
Energy: 0.7167859831402442
Energy: 0.723733711282153
Energy: 0.7263785106287992
Energy: 0.8096182242420433
Energy: 0.7263785106264745
Energy: 0.8096182242429733
Energy: 0.7263785106260094
Energy: 0.8096182242429733
Energy: 0.7571848291409611
Energy: 0.7011329878880967
Energy: 0.7571848291409611
Energy: 0.7011329878862369
Energy: 0.757184829141891
Energy: 0.7011329878890266
Energy: 0.7453983226574303
Energy: 0.7176733362668007
Energy: 0.7453983226588251
Energy: 0.717673336264476
Energy: 0.7453983226583603
Energy: 0.7176733362695905
Energy: 0.7486757933419644
Energy: 0.8037568574798666
Energy: 0.7486757933401046
Energy: 0.8037568574812615
Energy: 0.7486757933396396
Energy: 0.8037568574807965
Energy: 0.7384922342074364
Energy: 0.7338031965244218
Energy: 0.7384922342083663
Energy: 0.7338031965258167
Energy: 0.7384922342079013
Energy: 0.7338031965244218
Energy: 0.7246068215612693
Energy: 0.7417746972196605
Energy: 0.7246068215608044
Energy: 0.7417746972215203
Energy: 0.7246068215603394
Energy: 0.7417746972210554
Energy: 0.7859479671402382
Energy: 0.6760341395077796
Energy: 0.7859479671374484
Energy: 0.6760341395073146
Energy: 0.785947967140703
Energy: 0.6760341394849968
Energy: 0.788325261020766
Energy: 0.7588634928710146
Energy: 0.7883252610226259
Energy: 0.758863492865435
Energy: 0.7883252610212311
Energy: 0.7588634928617154
Energy: 0.79001433274653
Energy: 0.7473129079041748
Energy: 0.7900143327488548
Energy: 0.7473129079046398
Energy: 0.7900143327492775
Energy: 0.7473129079032449
Energy: 0.7922166829215556
Energy: 0.7735956287949166
Energy: 0.792216682919273
Energy: 0.7735956287949166
Energy: 0.7922166829210905
Energy: 0.7735956287939867
Energy: 0.7687407858069745
Energy: 0.7184586730481294
Energy: 0.7687407826815502
Energy: 0.7184586733027977
Energy: 0.7687407711191033
Energy: 0.7184586728482835
Energy: 0.7323120358531692
Energy: 0.7131326453098807
Energy: 0.7323120358527043
Energy: 0.7131326453103457
Energy: 0.7323120358531692
Energy: 0.7131326453098807
Energy: 0.7324692406642528
Energy: 0.766511766854898
Energy: 0.732469240662393
Energy: 0.766511766854898
Energy: 0.732469240662858
Energy: 0.7665117668553629
Energy: 0.7764479769423764
Energy: 0.7822271544708884
Energy: 0.7353167397479231
Energy: 0.7822271544694934
Energy: 0.735316739748853
Energy: 0.7822271544694934
Energy: 0.6944010781647103
Energy: 0.6777990726345009
Energy: 0.6944010781651752
Energy: 0.6777990710129932
Energy: 0.6944010781651752
Energy: 0.6777990709009813
Energy: 0.695079809659083
Energy: 0.7295674707313435
Energy: 0.6950798096600129
Energy: 0.7295674707318085
Energy: 0.695079809659083
Energy: 0.7295674707313435
Energy: 0.7640024234374148
Energy: 0.6711321458626541
Energy: 0.7640024234364848
Energy: 0.6711321458803224
Energy: 0.7640024234378797
Energy: 0.6711321458621891
Energy: 0.749246366623641
Energy: 0.7957462861409689
Energy: 0.7028440372921659
Energy: 0.7965975886378525
Energy: 0.7051515315205242
Energy: 0.7959365732861523
Energy: 0.6956736808251766
Energy: 0.7117924724307988
Energy: 0.6956736808247116
Energy: 0.7117924724303338
Energy: 0.6956736808237817
Energy: 0.7117924724307988
Energy: 0.7399883257342346
Energy: 0.6822912232126487
Energy: 0.7399883257337696
Energy: 0.682291223210324
Energy: 0.7399883257346995
Energy: 0.682291223209859
Energy: 0.7945084826528733
Energy: 0.7902041944925643
Energy: 0.7945084826524085
Energy: 0.7902041942187906
Energy: 0.7945084826514786
Energy: 0.7902041936950405
Energy: 0.724015188111345
Energy: 0.7118003965922438
Energy: 0.7240151881090203
Energy: 0.7118003965922438
Energy: 0.7240151881099502
Energy: 0.7118003965922438
Energy: 0.6590818692201275
Energy: 0.6831449784821729
Energy: 0.6590818692205925
Energy: 0.6831449784840328
Energy: 0.6590818692191976
Energy: 0.6831449784831028

minimum gb energy = 0.6590818692191976 eV
minimum distance =  2.36850378760856 Angstroms
sigma value = 81


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

Energy: 0.34894205078889895
Energy: 0.38861601755045627
Energy: 0.01653849564072021
Energy: 0.38861601755045627
Energy: 0.34894205078889895
Energy: 0.38861601755045627
Energy: 1.2661733427035562
Energy: 0.01780600854710907
Energy: 1.2661733427018478
Energy: 0.01780600854710907
Energy: 1.2661733427035562
Energy: 0.01780600854710907
Energy: 0.35006075572516193
Energy: 0.01755555499804147
Energy: 0.35006075572516193
Energy: 0.01755555499804147
Energy: 0.35006075572516193
Energy: 0.01755555499804147
Energy: 0.01653849564072021
Energy: 0.38861601755045627
Energy: 0.01653849564072021
Energy: 0.38861601755045627
Energy: 0.01653849564072021
Energy: 0.3886160175521647
Energy: 1.2661733427018478
Energy: 0.01780600854710907
Energy: 1.2661733427018478
Energy: 0.01780600854710907
Energy: 1.2661733427018478
Energy: 0.017806008545400723
Energy: 0.3500607557268703
Energy: 0.01755555499804147
Energy: 0.35006075572516193
Energy: 0.01755555499804147
Energy: 0.35006075572516193
Energy: 0.017555554996333114
Energy: 0.34894205078889895
Energy: 0.3886160175521647
Energy: 0.01653849564072021
Energy: 0.38861601755045627
Energy: 0.34894205078889895
Energy: 0.3886160175521647
Energy: 1.2661733427035562
Energy: 0.01780600854710907
Energy: 1.2661733427035562
Energy: 0.01780600854710907
Energy: 1.2661733427035562
Energy: 0.01780600854710907
Energy: 0.3500607557268703
Energy: 0.017555554996333114
Energy: 0.3500607557268703
Energy: 0.017555554996333114
Energy: 0.35006075572516193
Energy: 0.017555554996333114
Energy: 0.01653849564072021
Energy: 0.38861601755045627
Energy: 0.01653849564072021
Energy: 0.38861601755045627
Energy: 0.01653849564072021
Energy: 0.38861601755045627

minimum gb energy = 0.01653849564072021 eV
minimum distance =  2.56725805921315 Angstroms
sigma value = 3


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

Energy: 0.553265988610739
Energy: 0.5357220967627307
Energy: 0.5532659886138063
Energy: 0.5357220967657983
Energy: 0.5532659886132951
Energy: 0.5357220967683544
Energy: 0.5649507949441155
Energy: 0.5732414054581678
Energy: 0.5649507949441155
Energy: 0.5732414054566342
Energy: 0.5649507949466718
Energy: 0.5732414054576567
Energy: 0.5570170146137715
Energy: 0.5745369315304167
Energy: 0.557017014628086
Energy: 0.5745369315309279
Energy: 0.5570170145928112
Energy: 0.5745369315309279
Energy: 0.5690988448688669
Energy: 0.6521373297022207
Energy: 0.5690988448678445
Energy: 0.6521373297032432
Energy: 0.5690988448683556
Energy: 0.6521373297042656
Energy: 0.49808061520813723
Energy: 0.557029822915085
Energy: 0.4980806152060923
Energy: 0.557029822915085
Energy: 0.4980806152045586
Energy: 0.557029822892591
Energy: 0.5561193658689785
Energy: 0.5112555527969664
Energy: 0.5561193658679561
Energy: 0.5112555527969664
Energy: 0.5561193658679561
Energy: 0.5112555527969664
Energy: 0.5236688778833333
Energy: 0.7286256226707248
Energy: 0.5236688778838444
Energy: 0.7286256226707248
Energy: 0.5236688778848669
Energy: 0.7286256226702137
Energy: 0.49618429125866087
Energy: 0.5563125407035628
Energy: 0.496184291259172
Energy: 0.5563125407015179
Energy: 0.4961842912596833
Energy: 0.5563125407020292
Energy: 0.5674327665514971
Energy: 0.5206628683945709
Energy: 0.5674327665525196
Energy: 0.5206628683930371
Energy: 0.5674327665504746
Energy: 0.5206628683955934
Energy: 0.5376678766025186
Energy: 0.6891812385182616
Energy: 0.5376678766035411
Energy: 0.689181238516728
Energy: 0.5376678766030298
Energy: 0.689181238516728
Energy: 0.7494938248823325
Energy: 0.5586054195972846
Energy: 0.7494938248828438
Energy: 0.5586054195972846
Energy: 0.74949382488131
Energy: 0.5586054195957509
Energy: 0.578654372582096
Energy: 0.5762736450338887
Energy: 0.5786543725831184
Energy: 0.5762736449015268
Energy: 0.5786543725443115
Energy: 0.5762736442412976
Energy: 0.5736692553292547
Energy: 0.6873990516847867
Energy: 0.5736692553312996
Energy: 0.6873990516852979
Energy: 0.5736692553302771
Energy: 0.6873990516847867
Energy: 0.7033111889150482
Energy: 0.45957086297912764
Energy: 0.7033111889160707
Energy: 0.4595708722773628
Energy: 0.703311188914537
Energy: 0.4595708669353438
Energy: 0.5250832484351557
Energy: 0.5605386316269528
Energy: 0.525083248442313
Energy: 0.560538631629509
Energy: 0.5250832484325997
Energy: 0.5605386316330875
Energy: 0.5801356141831902
Energy: 0.7283494214780846
Energy: 0.5801356141831902
Energy: 0.7283494214775734
Energy: 0.5801356141837013
Energy: 0.7283494214775734
Energy: 0.5641641292116566
Energy: 0.6568021530573138
Energy: 0.5641641292142128
Energy: 0.6568021530557802
Energy: 0.5641641292131903
Energy: 0.6568021530568026
Energy: 0.5727634059779094
Energy: 0.5273573225097445
Energy: 0.5727634059784207
Energy: 0.527357312367377
Energy: 0.5727634059773983
Energy: 0.5273571893762937
Energy: 0.4968536108663727
Energy: 0.7442724889170036
Energy: 0.4968536108663727
Energy: 0.7442724889175147
Energy: 0.4968536108663727
Energy: 0.7442724889185371
Energy: 0.4417306774429228
Energy: 0.6184109918850038
Energy: 0.41571033966799864
Energy: 0.6184109918839814
Energy: 0.41578887178962676
Energy: 0.6184109918819365
Energy: 0.5736139802001387
Energy: 0.5769480575170097
Energy: 0.5736139802001387
Energy: 0.5769480575180322
Energy: 0.5736139802011611
Energy: 0.5769480575175209
Energy: 0.44857607123346593
Energy: 0.5142845524296071
Energy: 0.44857607123346593
Energy: 0.514284552431652
Energy: 0.44857607123346593
Energy: 0.5142845524306296
Energy: 0.6173342705056727
Energy: 0.4527443050448091
Energy: 0.6173342704657968
Energy: 0.4527443050432754
Energy: 0.6173342704719315
Energy: 0.4527443050427642
Energy: 0.5743377765088553
Energy: 0.398205822025097
Energy: 0.5743377765098778
Energy: 0.3982058220240746
Energy: 0.5743377765098778
Energy: 0.3982058220245859
Energy: 0.49740602914418647
Energy: 0.5429252042299473
Energy: 0.49740602914572013
Energy: 0.5429252042294361
Energy: 0.49740602914520887
Energy: 0.5429252042365932
Energy: 0.607625059442179
Energy: 0.495071184094389
Energy: 0.6076250594426903
Energy: 0.49507118409592266
Energy: 0.6076250594426903
Energy: 0.4950711840933665
Energy: 0.6466218000864076
Energy: 0.5285772493310722
Energy: 0.6466218000879412
Energy: 0.5285772493310722
Energy: 0.6466218000858962
Energy: 0.5285772493315833
Energy: 0.5250794312030913
Energy: 0.5745661669374279
Energy: 0.5250794312021154
Energy: 0.5745661669358941
Energy: 0.52507943120258
Energy: 0.5745661669369168
Energy: 0.5943559784144073
Energy: 0.5731065135009513
Energy: 0.5943559784138961
Energy: 0.5731065135009513
Energy: 0.5943559784138961
Energy: 0.5731065135009513
Energy: 0.7017757120755714
Energy: 0.6320129646504741
Energy: 0.7017757120786389
Energy: 0.6320129646504741
Energy: 0.7017757120817063
Energy: 0.6320129646504741
Energy: 0.5879065418868927
Energy: 0.5717607155860893
Energy: 0.5879065419012071
Energy: 0.5717607155860893
Energy: 0.5879065418705334
Energy: 0.5717607155860893
Energy: 0.6942019778295608
Energy: 0.5420012219031605
Energy: 0.6942019778295608
Energy: 0.5420012219169635
Energy: 0.694201977830072
Energy: 0.5420012219200311
Energy: 0.6401487319645914
Energy: 0.6424859511346737
Energy: 0.6401487319651026
Energy: 0.6424859511341624
Energy: 0.6401487319645914
Energy: 0.6424859511346737

minimum gb energy = 0.3982058220240746 eV
minimum distance =  2.41452600767966 Angstroms
sigma value = 67


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

Energy: 0.7529469666658509
Energy: 0.7540458285091584
Energy: 0.7529469666658509
Energy: 0.7540458285069731
Energy: 0.7529469666643941
Energy: 0.7540458285055163
Energy: 0.7190029480265425
Energy: 0.726032721071887
Energy: 0.7190029480265425
Energy: 0.7260327210704302
Energy: 0.719002948025814
Energy: 0.7260327210711586
Energy: 0.7672679225873972
Energy: 0.7210922463343308
Energy: 0.7672679225888541
Energy: 0.7210922463328738
Energy: 0.7672679225866688
Energy: 0.7210922463343308
Energy: 0.7350442983501887
Energy: 0.7936024370582974
Energy: 0.7350442983509171
Energy: 0.793602437056112
Energy: 0.7350442983523742
Energy: 0.793602437056112
Energy: 0.9408087702515165
Energy: 0.7161260992417101
Energy: 0.9408087702515165
Energy: 0.7161260992387963
Energy: 0.9408087702515165
Energy: 0.7161260992446239
Energy: 0.773767496841587
Energy: 0.7208148665550521
Energy: 0.7737674968408584
Energy: 0.7208148665550521
Energy: 0.7737674968401299
Energy: 0.7208148665543238
Energy: 0.720644872723926
Energy: 0.9151740966100004
Energy: 0.7206448727231975
Energy: 0.9151740966107289
Energy: 0.720644872723926
Energy: 0.9151740966114572
Energy: 0.9906346890906539
Energy: 0.7148831323085398
Energy: 0.990634689089197
Energy: 0.7148831323085398
Energy: 0.9906346890935677
Energy: 0.7148831323078115
Energy: 0.7945233184183639
Energy: 0.7955883419599863
Energy: 0.7945233184176355
Energy: 0.7955883419570725
Energy: 0.794523318416907
Energy: 0.7955883419585293
Energy: 0.7956792493804306
Energy: 0.9405124494880862
Energy: 0.7956792493789737
Energy: 0.9405124494880862
Energy: 0.7956792493789737
Energy: 0.9405124494880862
Energy: 1.0115821294248553
Energy: 0.7234574132477106
Energy: 1.0115821294226701
Energy: 0.7234574132477106
Energy: 1.0115821294248553
Energy: 0.7234574132469821
Energy: 0.7165191019890903
Energy: 0.7597909756119834
Energy: 0.7165191019898187
Energy: 0.7597909756119834
Energy: 0.7165191019890903
Energy: 0.7597909756127118
Energy: 0.7196098419838005
Energy: 0.9727993584665351
Energy: 0.7196098419830721
Energy: 0.9727993584665351
Energy: 0.7196098419838005
Energy: 0.9727993584665351
Energy: 0.7644173113311665
Energy: 0.70843136708565
Energy: 0.7644173113355373
Energy: 0.70843136708565
Energy: 0.7644173113362657
Energy: 0.70843136708565
Energy: 0.7282574502081881
Energy: 0.7244719045070097
Energy: 0.7282574502074597
Energy: 0.7244719045077381
Energy: 0.7282574502081881
Energy: 0.7244719045062812
Energy: 0.7249867719928578
Energy: 0.7310342493655909
Energy: 0.7249867719950432
Energy: 0.7310342493626771
Energy: 0.7249867719921294
Energy: 0.7310342493655909
Energy: 0.7999606016279586
Energy: 0.7098828108451263
Energy: 0.7999606016294155
Energy: 0.7098828108458547
Energy: 0.7999606016279586
Energy: 0.7098828108465831
Energy: 0.7218553625251158
Energy: 0.7161688158150824
Energy: 0.7218553625214736
Energy: 0.7161688158150824
Energy: 0.7218553625149177
Energy: 0.7161688158158108
Energy: 0.72571828541586
Energy: 0.7683094285052359
Energy: 0.72571828541586
Energy: 0.7683094285074211
Energy: 0.72571828541586
Energy: 0.768309428508878
Energy: 0.9979210314485457
Energy: 0.7255434709664474
Energy: 0.9979210314492739
Energy: 0.7255434709038012
Energy: 0.9979210314485457
Energy: 0.7255434709547923
Energy: 0.7496587735127297
Energy: 0.726472325181242
Energy: 0.7496587735120013
Energy: 0.726472325181242
Energy: 0.7496587735156435
Energy: 0.726472325181242
Energy: 0.7280361303380724
Energy: 0.8658691753685726
Energy: 0.7280361303424431
Energy: 0.8658691753714863
Energy: 0.7280361303380724
Energy: 0.8658691753685726
Energy: 0.7946680490337916
Energy: 0.7294905586215407
Energy: 0.7946680490359768
Energy: 0.7294905586200839
Energy: 0.7946680490352483
Energy: 0.7294905586193555

minimum gb energy = 0.70843136708565 eV
minimum distance =  2.41225749027007 Angstroms
sigma value = 33


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

Energy: 0.8390566509563436
Energy: 0.880706380862954
Energy: 0.8390566509568058
Energy: 0.880706380862954
Energy: 0.8390566509554194
Energy: 0.8807063808634161
Energy: 0.8372619815772507
Energy: 0.8474206944715772
Energy: 0.837261981578637
Energy: 0.8474206944697286
Energy: 0.8372619815795611
Energy: 0.8474206944706529
Energy: 0.8584042059453916
Energy: 0.8237809384413745
Energy: 0.8584042059449296
Energy: 0.8237809384409124
Energy: 0.8584042059458538
Energy: 0.8237809384399881
Energy: 0.8313700788064591
Energy: 0.9406911192518022
Energy: 0.8313700788069213
Energy: 0.9406911192518022
Energy: 0.8313700788059971
Energy: 0.9406911192531885
Energy: 0.8589399622126584
Energy: 0.8506260138092658
Energy: 0.8589399622140447
Energy: 0.8506260138106523
Energy: 0.8589399622108098
Energy: 0.8506260138120385
Energy: 0.9100904069598705
Energy: 0.8384149674984442
Energy: 0.9100904069631053
Energy: 0.9098577318181154
Energy: 0.910090406961719
Energy: 0.8856118731681211
Energy: 0.8380275920767826
Energy: 1.119335830617044
Energy: 0.8380275920790929
Energy: 1.119335830617044
Energy: 0.8380275920777067
Energy: 1.119335830617044
Energy: 0.9165906581678801
Energy: 0.8425360218438809
Energy: 0.9165906581697285
Energy: 0.8425360218438809
Energy: 0.9165906581697285
Energy: 0.8425360218438809
Energy: 0.9150853807565922
Energy: 0.8824479126917188
Energy: 0.9150853807561302
Energy: 0.8824479126930631
Energy: 0.9150853807561302
Energy: 0.8824479126930631
Energy: 0.856252169761338
Energy: 0.9228239500845067
Energy: 0.8562521697645729
Energy: 0.9485254374367416
Energy: 0.8562521697604139
Energy: 0.8875855419375497
Energy: 0.9777317903292132
Energy: 0.8139311121916211
Energy: 0.9777317903227437
Energy: 0.8139311121925454
Energy: 0.9777317902756505
Energy: 0.8139311121902348
Energy: 0.8363027753365235
Energy: 0.8517509621932031
Energy: 0.8363027753360613
Energy: 0.8517509621936653
Energy: 0.8363027753369856
Energy: 0.8517509621932031
Energy: 0.8299807127696773
Energy: 0.8396606701720639
Energy: 0.8299807127673666
Energy: 0.8396606701739125
Energy: 0.8299807127682909
Energy: 0.8396606701739125
Energy: 0.8344626970449418
Energy: 0.8185824089376316
Energy: 0.8344626970435556
Energy: 0.8185824089371695
Energy: 0.8344626970444797
Energy: 0.8185824089376316
Energy: 0.8379459778588509
Energy: 0.8517986017292952
Energy: 0.8379459778588509
Energy: 0.851798601728833
Energy: 0.8379459778588509
Energy: 0.8517986017292952
Energy: 0.8313905336123836
Energy: 0.8791155609918558
Energy: 0.8313905336114592
Energy: 0.8791155609946286
Energy: 0.8313905336119213
Energy: 0.87911556099278
Energy: 1.1479665345052004
Energy: 0.831188381243245
Energy: 1.1479665345052004
Energy: 0.8311883812427828
Energy: 1.1479665345056627
Energy: 0.8311883812427828
Energy: 0.885000096499688
Energy: 0.9065786867090238
Energy: 0.885000096499688
Energy: 0.9065786867099479
Energy: 0.8850000964978396
Energy: 0.9065786867080996
Energy: 0.8224710652739102
Energy: 0.912677877025519
Energy: 0.8224710652752968
Energy: 0.912677877025981
Energy: 0.8224710652743724
Energy: 0.9126778770245947
Energy: 1.1087999716208532
Energy: 0.9374821537819747
Energy: 1.108799971619929
Energy: 0.937482153782437
Energy: 1.1087999716208532
Energy: 0.9374821537847474
Energy: 0.8346620264146736
Energy: 0.8947295210479398
Energy: 0.8346620264179083
Energy: 0.8947295210484019
Energy: 0.8346620264174464
Energy: 0.894729521048864
Energy: 0.8362555121120331
Energy: 0.845500746555534
Energy: 0.8362555121097226
Energy: 0.8455007465564581
Energy: 0.8362555121134195
Energy: 0.845500746555534
Energy: 0.9319242538044752
Energy: 0.8140316114327851
Energy: 0.9319242537943087
Energy: 0.8140316114327851
Energy: 0.9319242537883012
Energy: 0.814031611432323
Energy: 0.8596091122030779
Energy: 0.8493102340952506
Energy: 0.85960911220354
Energy: 0.8493102340957128
Energy: 0.8596091122044642
Energy: 0.8493102340952506
Energy: 0.8353694331674639
Energy: 0.845650824964759
Energy: 0.8353694331674639
Energy: 0.8456508249652211
Energy: 0.8353694331688504
Energy: 0.8456508249652211
Energy: 1.0002413648558452
Energy: 0.8420260591416521
Energy: 1.0002413648516864
Energy: 0.8420260591416521
Energy: 1.0002413648484514
Energy: 0.8420260591416521
Energy: 0.8346851377212966
Energy: 0.845965973268491
Energy: 0.8346851377212966
Energy: 0.8459659732855891
Energy: 0.8346851377203723
Energy: 0.8459659732578626
Energy: 0.8185637943399214
Energy: 0.9754257446733319
Energy: 0.8185637943431562
Energy: 0.975425744674256
Energy: 0.8185637943403836
Energy: 0.9754257446714835
Energy: 1.1112262642736441
Energy: 0.9332154056189614
Energy: 1.1112262642745683
Energy: 0.9332154056194234
Energy: 1.1112262642741062
Energy: 0.9332154056189614
Energy: 0.8203550907059155
Energy: 1.117753806800309
Energy: 0.8203550907068397
Energy: 1.1177538068007713
Energy: 0.8203550907068397
Energy: 1.1177538068007713
Energy: 0.9128987956124125
Energy: 0.9279267689151829
Energy: 0.912898795610564
Energy: 0.927926768916107
Energy: 0.9128987956124125
Energy: 0.9279267689170313
Energy: 0.8569400488665154
Energy: 0.939110329236956
Energy: 0.8569400488679019
Energy: 0.9391103292364938
Energy: 0.8569400488674397
Energy: 0.9391103292364938
Energy: 0.8371068742040839
Energy: 1.1319614935764295
Energy: 0.8371068742031598
Energy: 1.1319614935792022
Energy: 0.8371068742040839
Energy: 1.1319614935800841
Energy: 0.838400568147996
Energy: 0.8483552983615336
Energy: 0.8384005681475338
Energy: 0.8483552983610714
Energy: 0.8384005681470719
Energy: 0.8483552983615336
Energy: 0.8489482795230029
Energy: 0.8340023398257121
Energy: 0.8489482795234651
Energy: 0.8340023398257121
Energy: 0.8489482795230029
Energy: 0.8340023398257121
Energy: 0.8381435063044442
Energy: 0.8754830228853905
Energy: 0.8381435063039822
Energy: 0.8754830228863146
Energy: 0.8381435063049063
Energy: 0.8754830228849282
Energy: 0.84362069262386
Energy: 0.8599880984917732
Energy: 0.8436206926220113
Energy: 0.8599880984913111
Energy: 0.843620692624322
Energy: 0.859988098490849

minimum gb energy = 0.8139311121902348 eV
minimum distance =  2.40646252618044 Angstroms
sigma value = 41


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

Energy: 1.0711695136263926
Energy: 1.190585054904961
Energy: 1.0711695136263926
Energy: 1.190585054904961
Energy: 1.0711695136251311
Energy: 1.190585054904961
Energy: 1.0769936224103838
Energy: 1.1230390624749196
Energy: 1.0769936224103838
Energy: 1.1230390624749196
Energy: 1.0769936224103838
Energy: 1.1230390624749196
Energy: 1.2315574082551817
Energy: 1.0349551985814769
Energy: 1.3546247970270673
Energy: 1.0349551985827385
Energy: 1.2326140701929498
Energy: 1.0349551985814769
Energy: 1.1725274132482928
Energy: 1.1597645411099535
Energy: 1.1725274132495542
Energy: 1.1597645411112154
Energy: 1.1725274132482928
Energy: 1.1597645411112154
Energy: 1.1576248522781745
Energy: 1.1213885969373176
Energy: 1.1576248522769128
Energy: 1.1213885969360562
Energy: 1.1576248522781745
Energy: 1.1213885969347943
Energy: 1.322961359962206
Energy: 1.1435764119874088
Energy: 1.3229613599647294
Energy: 1.1435764119886707
Energy: 1.322961359963468
Energy: 1.1435764119874088
Energy: 1.2796528870401962
Energy: 1.0756669657152338
Energy: 1.2796528870414576
Energy: 1.0756669657139724
Energy: 1.2796528870401962
Energy: 1.0756669657139724
Energy: 1.1011144302676743
Energy: 1.0360172454603789
Energy: 1.1011144302664129
Energy: 1.0360172454603789
Energy: 1.101114430265151
Energy: 1.0360172454603789
Energy: 1.0757167097002223
Energy: 1.0872163490883369
Energy: 1.0757167097002223
Energy: 1.0872163490883369
Energy: 1.0757167097002223
Energy: 1.0872163490883369
Energy: 1.1282088647175832
Energy: 1.1961454253662207
Energy: 1.1282088647163215
Energy: 1.196145425352399
Energy: 1.1282088647163215
Energy: 1.196145425352399
Energy: 1.0712247621649773
Energy: 1.0355977188732852
Energy: 1.0712247621637156
Energy: 1.0355977188745469
Energy: 1.0712247621637156
Energy: 1.0355977188745469
Energy: 1.102100506477514
Energy: 1.1231128586054062
Energy: 1.102100506477514
Energy: 1.1231128586054062
Energy: 1.102100506477514
Energy: 1.1231128586054062
Energy: 1.0511102235457925
Energy: 1.1566707596821053
Energy: 1.0511102235457925
Energy: 1.1566707596821053
Energy: 1.0511102235445884
Energy: 1.1566707596821053
Energy: 1.445424156650036
Energy: 1.1242264971672935
Energy: 1.445424156650036
Energy: 1.1242264971660316
Energy: 1.445424156650036
Energy: 1.1242264971660316

minimum gb energy = 1.0349551985814769 eV
minimum distance =  2.37329287061592 Angstroms
sigma value = 11


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

Energy: 1.3683012664041787
Energy: 1.4281125022983674
Energy: 1.3683012664041787
Energy: 1.4281125022983674
Energy: 1.3683012664047332
Energy: 1.4281125022972587
Energy: 1.3080701909270036
Energy: 1.3871359278572895
Energy: 1.3080701909270036
Energy: 1.3871359278578441
Energy: 1.3080701909270036
Energy: 1.3871359278572895
Energy: 1.3458320183308512
Energy: 1.2508657385749982
Energy: 1.3458320183097892
Energy: 1.250865738574444
Energy: 1.393403773183269
Energy: 1.250865738574444
Energy: 1.375057904150326
Energy: 1.299596712335372
Energy: 1.37505790415088
Energy: 1.299596712335372
Energy: 1.37505790415088
Energy: 1.299596712335372
Energy: 1.3572206417231816
Energy: 1.2777992636233675
Energy: 1.357220641722073
Energy: 1.2777992636233675
Energy: 1.357220641722073
Energy: 1.2777992636233675
Energy: 1.39803129043908
Energy: 1.3482235885217604
Energy: 1.39803129043908
Energy: 1.3482235885239775
Energy: 1.3980312904396341
Energy: 1.3482235885206522
Energy: 1.3175510077055381
Energy: 1.384310922284371
Energy: 1.3175510077060921
Energy: 1.384310922284371
Energy: 1.3175510077055381
Energy: 1.384310922284371
Energy: 1.3408649285751886
Energy: 1.3409819038238595
Energy: 1.3408649285762972
Energy: 1.3409819038238595
Energy: 1.3408649285751886
Energy: 1.3409819038238595
Energy: 1.3328864569089582
Energy: 1.3395046356365286
Energy: 1.3328864569089582
Energy: 1.339504635637083
Energy: 1.3328864569095125
Energy: 1.3395046356426255
Energy: 1.2949221435448097
Energy: 1.3554450315111501
Energy: 1.2949221435437013
Energy: 1.3554450315100415
Energy: 1.294922143543147
Energy: 1.355445031509487
Energy: 1.3214688418507694
Energy: 1.3538949646691607
Energy: 1.3214688418502154
Energy: 1.353894964668052
Energy: 1.3214688418502154
Energy: 1.3538949646686065
Energy: 1.2623800117737833
Energy: 1.3124827277822062
Energy: 1.2623345044735754
Energy: 1.3124827277827604
Energy: 1.2625437686418364
Energy: 1.3124827277827604
Energy: 1.2804185011748472
Energy: 1.3130392295702082
Energy: 1.280418501177593
Energy: 1.3130392295696538
Energy: 1.2804185011759557
Energy: 1.3130392295702082
Energy: 1.3919681765248795
Energy: 1.3614659037547632
Energy: 1.3919681765248795
Energy: 1.3614659037558716
Energy: 1.391968176521554
Energy: 1.361465903754209
Energy: 1.3565982194371402
Energy: 1.3482522106215826
Energy: 1.3812459020584462
Energy: 1.3482522106199197
Energy: 1.4124960382013418
Energy: 1.3482522106199197
Energy: 1.3196701665884623
Energy: 1.3819626592347913
Energy: 1.3196701665867991
Energy: 1.3819626592353456
Energy: 1.3196701665867991
Energy: 1.3819626592364542
Energy: 1.2995805514279126
Energy: 1.3150255859274744
Energy: 1.2995805514290213
Energy: 1.3150255859274744
Energy: 1.2995805514273586
Energy: 1.3150255859274744
Energy: 1.3711337232457557
Energy: 1.2830383519416064
Energy: 1.3711337232457557
Energy: 1.2830383519438238
Energy: 1.3711337232457557
Energy: 1.2830383519460404
Energy: 1.315368218732819
Energy: 1.3330619785373123
Energy: 1.315368218732819
Energy: 1.3330619785373123
Energy: 1.315368218732819
Energy: 1.3330619785373123
Energy: 1.3629979926848783
Energy: 1.346789735159782
Energy: 1.362997992683795
Energy: 1.346789735159782
Energy: 1.3629979926815778
Energy: 1.3467897351603362
Energy: 1.4154080058752287
Energy: 1.3638800040606338
Energy: 1.4154080058752287
Energy: 1.3638800040611878
Energy: 1.4154080058757832
Energy: 1.3638800040611878
Energy: 1.3981960591272982
Energy: 1.4100591757767265
Energy: 1.3981960591023566
Energy: 1.4100591757767265
Energy: 1.3981960590879459
Energy: 1.4100591757767265
Energy: 1.3275621812370864
Energy: 1.2443399665173562
Energy: 1.3275621812376404
Energy: 1.2443399665179105
Energy: 1.3275621812370864
Energy: 1.2443399665179105
Energy: 1.395015872840302
Energy: 1.3885420934414592
Energy: 1.3950158728187108
Energy: 1.3885420934414592
Energy: 1.3950158728397477
Energy: 1.3885420934414592
Energy: 1.3033152674256527
Energy: 1.3553397353387993
Energy: 1.3033152674262067
Energy: 1.3553397353387993
Energy: 1.303315267426761
Energy: 1.3553397353376908
Energy: 1.3295892268975507
Energy: 1.3247374243103658
Energy: 1.3295892268981047
Energy: 1.3247374243098111
Energy: 1.3295892268981047
Energy: 1.3247374243103658
Energy: 1.3257396537071282
Energy: 1.3419581022240257
Energy: 1.3257396537071282
Energy: 1.3419581022262426
Energy: 1.3257396537071282
Energy: 1.341958102222363
Energy: 1.3273505345372527
Energy: 1.4035277953592347
Energy: 1.3273505345366983
Energy: 1.4035277953675236
Energy: 1.3273505345372527
Energy: 1.4035277953608725
Energy: 1.3917001223601413
Energy: 1.3670657274636264
Energy: 1.3917001223601413
Energy: 1.3670657274619638
Energy: 1.3917001223601413
Energy: 1.3670657274625178
Energy: 1.3450576359114081
Energy: 1.3191085050417188
Energy: 1.345057635910854
Energy: 1.3191085050417188
Energy: 1.345057635910854
Energy: 1.319108505042273
Energy: 1.3686472093745707
Energy: 1.3644698298972193
Energy: 1.3686472093745707
Energy: 1.3644698298972193
Energy: 1.368647209370691
Energy: 1.3644698298983278

minimum gb energy = 1.2443399665173562 eV
minimum distance =  2.34710793880967 Angstroms
sigma value = 57


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

Energy: 1.4483524704775073
Energy: 1.4975939869033004
Energy: 1.448352470476521
Energy: 1.497593986902314
Energy: 1.448352470476521
Energy: 1.4975939869033004
Energy: 1.4640873794464166
Energy: 1.4439195189389762
Energy: 1.464087379447403
Energy: 1.4439195189389762
Energy: 1.4640873794464166
Energy: 1.4439195189370033
Energy: 1.4658461253441628
Energy: 1.3365405684443366
Energy: 1.4658461253431763
Energy: 1.3365405684443366
Energy: 1.4658461253441628
Energy: 1.3365405684443366
Energy: 1.462243463542494
Energy: 1.548167067862421
Energy: 1.462243463542494
Energy: 1.548167067862421
Energy: 1.462243463542494
Energy: 1.469595126044275
Energy: 1.4656404305768773
Energy: 1.3365304434373049
Energy: 1.4656404305768773
Energy: 1.3365304434373049
Energy: 1.4656404305778639
Energy: 1.3365304434373049
Energy: 1.4642514394609782
Energy: 1.457799158121785
Energy: 1.4642514394590058
Energy: 1.4577991581207987
Energy: 1.4642514394609782
Energy: 1.4577991581207987
Energy: 1.4483524704784934
Energy: 1.497593986904287
Energy: 1.4483524704775073
Energy: 1.497593986904287
Energy: 1.4483524704784934
Energy: 1.497593986904287
Energy: 1.464087379444444
Energy: 1.4439195189399623
Energy: 1.4640873794434577
Energy: 1.4439195189399623
Energy: 1.4640873794434577
Energy: 1.4439195189370033
Energy: 1.4658461253441628
Energy: 1.3365405684443366
Energy: 1.4658461253441628
Energy: 1.3365405684453229
Energy: 1.4658461253441628
Energy: 1.3365405684443366
Energy: 1.4622434635434802
Energy: 1.4402951994210713
Energy: 1.4622434635434802
Energy: 1.4402951994240303
Energy: 1.4622434635434802
Energy: 1.4402951994250166
Energy: 1.4656404305778639
Energy: 1.3365304434382912
Energy: 1.4656404305788502
Energy: 1.3365304434382912
Energy: 1.4656404305788502
Energy: 1.3365304434382912
Energy: 1.4642514394609782
Energy: 1.4577991581207987
Energy: 1.4642514394609782
Energy: 1.4577991581207987
Energy: 1.4642514394609782
Energy: 1.4577991581188259
Energy: 1.4483524704775073
Energy: 1.497593986902314
Energy: 1.448352470476521
Energy: 1.4975939869033004
Energy: 1.448352470476521
Energy: 1.4975939869033004
Energy: 1.464087379444444
Energy: 1.4439195189389762
Energy: 1.4640873794454303
Energy: 1.4439195189389762
Energy: 1.464087379444444
Energy: 1.4439195189370033
Energy: 1.4658461253441628
Energy: 1.3365405684443366
Energy: 1.4658461253431763
Energy: 1.3365405684443366
Energy: 1.4658461253431763
Energy: 1.3365405684443366
Energy: 1.462243463542494
Energy: 1.4402951994210713
Energy: 1.4622434635434802
Energy: 1.4402951994161397
Energy: 1.4622434635434802
Energy: 1.4402951994210713
Energy: 1.4656404305778639
Energy: 1.3365304434373049
Energy: 1.4656404305778639
Energy: 1.3365304434373049
Energy: 1.4656404305778639
Energy: 1.3365304434373049

minimum gb energy = 1.3365304434373049 eV
minimum distance =  2.33320744758127 Angstroms
sigma value = 9


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

Energy: 1.5953528417853684
Energy: 1.575258231860087
Energy: 1.595352841784563
Energy: 1.575258231860087
Energy: 1.595352841784563
Energy: 1.575258231860087
Energy: 1.529603748669972
Energy: 1.5116099260922897
Energy: 1.5296037486739988
Energy: 1.5116099260922897
Energy: 1.5296037486764147
Energy: 1.5116099260914841
Energy: 1.5266707467784868
Energy: 1.4980132622069615
Energy: 1.5634345338646893
Energy: 1.498013262208572
Energy: 1.5634345338654947
Energy: 1.4980132622077666
Energy: 1.4244715084768058
Energy: 1.5936606662986106
Energy: 1.4244715084760007
Energy: 1.5936606662994155
Energy: 1.4244715084760007
Energy: 1.5936606662994155
Energy: 1.461735038660656
Energy: 1.4938805188104765
Energy: 1.4617350386598507
Energy: 1.4938805188104765
Energy: 1.4617350386598507
Energy: 1.4938805188112818
Energy: 1.4688178405179224
Energy: 1.524097907641709
Energy: 1.4688178405187278
Energy: 1.524097907641709
Energy: 1.4688178405187278
Energy: 1.5240979076409036
Energy: 1.502706717586721
Energy: 1.4674765118754156
Energy: 1.5027067175875264
Energy: 1.4674765118754156
Energy: 1.502706717586721
Energy: 1.4674765118746105
Energy: 1.4278014532887078
Energy: 1.5201014879962664
Energy: 1.4278014532887078
Energy: 1.5201014879970716
Energy: 1.4278014532887078
Energy: 1.5201014879970716
Energy: 1.475638688785607
Energy: 1.4897057264879578
Energy: 1.4753561466106193
Energy: 1.4897057264887632
Energy: 1.296950493018231
Energy: 1.4897057264879578
Energy: 1.4711458998829046
Energy: 1.4542928887092277
Energy: 1.4711458998829046
Energy: 1.4542928887084223
Energy: 1.4711458998829046
Energy: 1.4542928887092277
Energy: 1.4497486853482602
Energy: 1.5065288579602973
Energy: 1.449748685347455
Energy: 1.5065288579522444
Energy: 1.449748685347455
Energy: 1.5065288579651295
Energy: 1.5622832277592675
Energy: 1.5191534272819
Energy: 1.562283227760878
Energy: 1.5191534272819
Energy: 1.562283227760878
Energy: 1.5191534272819
Energy: 1.4480665591030037
Energy: 1.5043820472666285
Energy: 1.4480665591014295
Energy: 1.5043820472666285
Energy: 1.448066559102235
Energy: 1.5043820472674339
Energy: 1.4765077890033376
Energy: 1.437838454709087
Energy: 1.476507789004143
Energy: 1.4378384547082816
Energy: 1.4765077890033376
Energy: 1.437838454709087
Energy: 1.475610735139529
Energy: 1.5003614870844397
Energy: 1.4756107351403343
Energy: 1.5003614870868558
Energy: 1.4756107351387235
Energy: 1.5003614870868558
Energy: 1.502227258923488
Energy: 1.5876159263816938
Energy: 1.502227258923488
Energy: 1.5876159263800833
Energy: 1.5022272589226828
Energy: 1.5876159263816938
Energy: 1.5575492649427982
Energy: 1.5362331642003937
Energy: 1.5575492649427982
Energy: 1.5362331642011988
Energy: 1.5575492649427982
Energy: 1.5362331642020042
Energy: 1.5926571330852197
Energy: 1.5208468244500117
Energy: 1.5926571330860253
Energy: 1.5208468244500117
Energy: 1.5926571330876358
Energy: 1.5208468244508169
Energy: 1.5026353866142783
Energy: 1.433620087062193
Energy: 1.5026353866150837
Energy: 1.4336200870629985
Energy: 1.5026353866142783
Energy: 1.433620087062193
Energy: 1.5316215906209865
Energy: 1.5196641707227327
Energy: 1.5316215906209865
Energy: 1.5196641707211223
Energy: 1.531621590621792
Energy: 1.5196641707227327
Energy: 1.5614602715994699
Energy: 1.5717788034196853
Energy: 1.5614602715986645
Energy: 1.571778803420491
Energy: 1.5614602715994699
Energy: 1.571778803420491

minimum gb energy = 1.296950493018231 eV
minimum distance =  2.35698601631488 Angstroms
sigma value = 27


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

Energy: 1.5247037811824302
Energy: 1.3912233294756937
Energy: 1.5247037484407193
Energy: 1.3912233294947007
Energy: 1.5247038655724465
Energy: 1.3912233294831606
Energy: 1.5252086155951068
Energy: 1.4724710193995942
Energy: 1.5252086155957856
Energy: 1.4724710193995942
Energy: 1.525208615594428
Energy: 1.4724710193995942
Energy: 1.467834869324373
Energy: 1.4025971095611343
Energy: 1.467834869324373
Energy: 1.4025971095604555
Energy: 1.467834869324373
Energy: 1.4025971095611343
Energy: 1.4581787136951208
Energy: 1.4316579062172268
Energy: 1.4581787136964786
Energy: 1.4316579062185846
Energy: 1.4581787136944422
Energy: 1.4316579062172268
Energy: 1.4598821408589506
Energy: 1.4530907492235103
Energy: 1.4598821408603082
Energy: 1.4530907492235103
Energy: 1.4598821408603082
Energy: 1.4530907492235103
Energy: 1.4680549715794122
Energy: 1.545691207625449
Energy: 1.4680549715794122
Energy: 1.5456912076261278
Energy: 1.4680549715766968
Energy: 1.5456912076261278
Energy: 1.4241153334803192
Energy: 1.5241927371786328
Energy: 1.4241153334782826
Energy: 1.5241927371786328
Energy: 1.4241153334776038
Energy: 1.5241927371793116
Energy: 1.466438412578292
Energy: 1.490967414378569
Energy: 1.4664384125776133
Energy: 1.490967414378569
Energy: 1.4664384125776133
Energy: 1.4909674143799265
Energy: 1.4253665500976078
Energy: 1.4629101489946383
Energy: 1.4253665500969288
Energy: 1.4629101489953173
Energy: 1.4253665500969288
Energy: 1.4629101489946383
Energy: 1.5643393667150003
Energy: 1.3755467880214076
Energy: 1.5643393666905627
Energy: 1.3755467880220864
Energy: 1.564339366700066
Energy: 1.3755467880214076
Energy: 1.5173460855103236
Energy: 1.452945406748747
Energy: 1.5173460855103236
Energy: 1.452945406748068
Energy: 1.5173460855110024
Energy: 1.452945406748068
Energy: 1.4540561645431083
Energy: 1.4251274264439744
Energy: 1.4540561645431083
Energy: 1.4251274264439744
Energy: 1.454056164543787
Energy: 1.4251274264439744
Energy: 1.5405910518742285
Energy: 1.4353975599278985
Energy: 1.540591051874907
Energy: 1.4353975599278985
Energy: 1.540591051874907
Energy: 1.4353975599278985
Energy: 1.4583380231376086
Energy: 1.4303681783779114
Energy: 1.4583380231382874
Energy: 1.4303681783779114
Energy: 1.4583380231389664
Energy: 1.4303681783772326
Energy: 1.4316201755305427
Energy: 1.5449808661680104
Energy: 1.4316201755291849
Energy: 1.5449808658077058
Energy: 1.4316201755319002
Energy: 1.544980865813815
Energy: 1.4705978881707849
Energy: 1.4591511558697547
Energy: 1.4705978881701058
Energy: 1.4591511558711123
Energy: 1.4705978881694273
Energy: 1.459151155869076
Energy: 1.4262329757034953
Energy: 1.4672945946924736
Energy: 1.426232975704174
Energy: 1.4672945946924736
Energy: 1.4262329757034953
Energy: 1.4672945946924736
Energy: 1.4311973289083222
Energy: 1.40173614982007
Energy: 1.4311973289069648
Energy: 1.4017361498214278
Energy: 1.4311973289069648
Energy: 1.4017361498214278
Energy: 1.4548722695530292
Energy: 1.4616503900219657
Energy: 1.454872269553708
Energy: 1.4616503900219657
Energy: 1.454872269553708
Energy: 1.461650390021287
Energy: 1.5247037544239905
Energy: 1.3912233294865548
Energy: 1.5247041297983577
Energy: 1.391223329481803
Energy: 1.5247037879507688
Energy: 1.3912233294947007
Energy: 1.5252086155957856
Energy: 1.4724710193995942
Energy: 1.5252086155951068
Energy: 1.4724710193989154
Energy: 1.5252086155957856
Energy: 1.4724710193995942
Energy: 1.4678348693216576
Energy: 1.4025971095604555
Energy: 1.4678348693230154
Energy: 1.4025971095597767
Energy: 1.4678348693223366
Energy: 1.4025971095597767
Energy: 1.4581787136964786
Energy: 1.4316579062172268
Energy: 1.4581787136951208
Energy: 1.4316579062179056
Energy: 1.4581787136957998
Energy: 1.4316579062172268
Energy: 1.4598821408596294
Energy: 1.4530907492214742
Energy: 1.4598821408603082
Energy: 1.4530907492214742
Energy: 1.4598821408596294
Energy: 1.4530907492214742
Energy: 1.4680549715814488
Energy: 1.545691207625449
Energy: 1.4680549715780544
Energy: 1.5456912076247702
Energy: 1.4680549715794122
Energy: 1.5456912076247702

minimum gb energy = 1.3755467880214076 eV
minimum distance =  2.35297363855999 Angstroms
sigma value = 19


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

Energy: 1.4248327840586592
Energy: 1.4833302825859198
Energy: 1.4248327840580735
Energy: 1.4833302825865056
Energy: 1.4248327840598314
Energy: 1.4833302825859198
Energy: 1.4169460249396586
Energy: 1.360701815215106
Energy: 1.4169460249384866
Energy: 1.36070181521452
Energy: 1.4169460249379007
Energy: 1.360701815213934
Energy: 1.518105432773474
Energy: 1.3528265488686573
Energy: 1.3970785194867796
Energy: 1.3528265488698294
Energy: 1.3970785194856077
Energy: 1.3528265488698294
Energy: 1.370131275588021
Energy: 1.3527049325800575
Energy: 1.370131275588021
Energy: 1.3527049325800575
Energy: 1.370131275588021
Energy: 1.3527049325806437
Energy: 1.3531797460982407
Energy: 1.402041974156765
Energy: 1.3531797460976545
Energy: 1.402041974156765
Energy: 1.3531797460982407
Energy: 1.402041974156765
Energy: 1.3496193289269507
Energy: 1.3875664554709306
Energy: 1.3496193289269507
Energy: 1.3875664554709306
Energy: 1.3496193289269507
Energy: 1.3875664554709306
Energy: 1.364866163290417
Energy: 1.4709724683704621
Energy: 1.3648661632910033
Energy: 1.4709724683698764
Energy: 1.364866163290417
Energy: 1.4709724683704621
Energy: 1.3936307518792046
Energy: 1.4790692826303504
Energy: 1.3936307518786186
Energy: 1.4790692826303504
Energy: 1.3936307518786186
Energy: 1.4790692826303504
Energy: 1.4600732482953442
Energy: 1.3611686333095976
Energy: 1.4600732482959302
Energy: 1.361168633309012
Energy: 1.4600732482965162
Energy: 1.361168633309012
Energy: 1.368059979282187
Energy: 1.3806783147156418
Energy: 1.3680599792827732
Energy: 1.3806783147150559
Energy: 1.3680599792816013
Energy: 1.3806783147156418
Energy: 1.3620897279008226
Energy: 1.5048036093247266
Energy: 1.3620897279008226
Energy: 1.5048036093247266
Energy: 1.3620897279008226
Energy: 1.5048036093247266
Energy: 1.419409244598682
Energy: 1.3706441323411427
Energy: 1.419409244598682
Energy: 1.3706441323417282
Energy: 1.419409244598682
Energy: 1.3706441323417282
Energy: 1.3607139953112435
Energy: 1.4413004518282608
Energy: 1.3607139953130012
Energy: 1.4413004518276749
Energy: 1.3607139953118292
Energy: 1.4413004518282608
Energy: 1.3854256395221725
Energy: 1.3419603865003187
Energy: 1.3854256395221725
Energy: 1.3419603865003187
Energy: 1.3854256395221725
Energy: 1.3419603865009047
Energy: 1.4458084827729178
Energy: 1.3435660983931796
Energy: 1.4458084827735036
Energy: 1.3435660983943516
Energy: 1.4458084827729178
Energy: 1.3435660983955233
Energy: 1.4727298708979648
Energy: 1.3530797267794143
Energy: 1.4727298708991101
Energy: 1.3530797267794143
Energy: 1.4727298708996959
Energy: 1.353079726780586
Energy: 1.3684312279905104
Energy: 1.399191675952204
Energy: 1.3684312279893387
Energy: 1.399191675952204
Energy: 1.3684312279899244
Energy: 1.399191675952204
Energy: 1.4592972044600543
Energy: 1.4747992458506611
Energy: 1.4592972044606403
Energy: 1.474799245851247
Energy: 1.4592972044606403
Energy: 1.474799245851247
Energy: 1.399593526650808
Energy: 1.385692547436311
Energy: 1.399593526650808
Energy: 1.3856925474368966
Energy: 1.3765357256300141
Energy: 1.385692547436311
Energy: 1.3826683259861854
Energy: 1.4232324623897727
Energy: 1.3826683259844275
Energy: 1.4232324623897727
Energy: 1.3826683259861854
Energy: 1.4232324623897727
Energy: 1.3460146370726063
Energy: 1.490032789234996
Energy: 1.3460146370714343
Energy: 1.490032789234996
Energy: 1.34601463707202
Energy: 1.49003278923441
Energy: 1.5167222068080626
Energy: 1.3451577256676117
Energy: 1.5167222067131638
Energy: 1.3451577256676117
Energy: 1.5167222059915808
Energy: 1.3451577256676117
Energy: 1.4021371846574895
Energy: 1.4293640103897962
Energy: 1.4021371846574895
Energy: 1.4293640103897962
Energy: 1.402137184655732
Energy: 1.4293640103892102
Energy: 1.4116980770443317
Energy: 1.4164178856646619
Energy: 1.4116980770472616
Energy: 1.416417885664076
Energy: 1.4116980770466754
Energy: 1.416417885664076
Energy: 1.3796562901424045
Energy: 1.3718235815239743
Energy: 1.3796562901424045
Energy: 1.3718235815228024
Energy: 1.3796562901424045
Energy: 1.3718235815228024
Energy: 1.3748010661276557
Energy: 1.370931453544346
Energy: 1.3748010661282417
Energy: 1.370931453540857
Energy: 1.3748010661276557
Energy: 1.370931453546104
Energy: 1.3562118325632189
Energy: 1.3700784067660934
Energy: 1.3562118325638048
Energy: 1.3700784067666796
Energy: 1.3562118325632189
Energy: 1.3700784067672653
Energy: 1.3821845665975638
Energy: 1.385686359647321
Energy: 1.3821845666010795
Energy: 1.3856863596467348
Energy: 1.3821845666022516
Energy: 1.385686359647321
Energy: 1.387043000480084
Energy: 1.3857772543878202
Energy: 1.387043000479498
Energy: 1.385777254388406
Energy: 1.387043000480084
Energy: 1.385777254388406

minimum gb energy = 1.3419603865003187 eV
minimum distance =  2.36762433091027 Angstroms
sigma value = 101


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

Energy: 1.3171771455098449
Energy: 1.3474978069722512
Energy: 1.31717714550933
Energy: 1.3474978069717363
Energy: 1.3171771455098449
Energy: 1.3474978069722512
Energy: 1.3409008560395608
Energy: 1.3067786949520317
Energy: 1.3409008560369855
Energy: 1.3010629586930005
Energy: 1.3409008560390459
Energy: 1.30106295868991
Energy: 1.3150088146118575
Energy: 1.3028680889400541
Energy: 1.3150088146113426
Energy: 1.3028680889426298
Energy: 1.3150088146113426
Energy: 1.3028680889415993
Energy: 1.267685152175729
Energy: 1.3322426534710543
Energy: 1.2676851521783046
Energy: 1.3465925000528383
Energy: 1.2676851521777894
Energy: 1.3943402120472537
Energy: 1.3029340622716112
Energy: 1.3262534965261707
Energy: 1.3029340622695509
Energy: 1.3262534965256558
Energy: 1.3029340622710963
Energy: 1.3262534965277162
Energy: 1.2872287914515854
Energy: 1.2872817095297602
Energy: 1.2872287914572513
Energy: 1.2872817095297602
Energy: 1.2872287914989267
Energy: 1.2872817095297602
Energy: 1.29928335558778
Energy: 1.4711875475177725
Energy: 1.2992899456566331
Energy: 1.4711875475177725
Energy: 1.299298405052222
Energy: 1.471187547517257
Energy: 1.2762591985801344
Energy: 1.5578789150674721
Energy: 1.2762591985796194
Energy: 1.4160158471348347
Energy: 1.2762591985801344
Energy: 1.3458664200037909
Energy: 1.3451551624418023
Energy: 1.288926897325785
Energy: 1.3451551624407723
Energy: 1.288926897326815
Energy: 1.3451551624407723
Energy: 1.288926897324755
Energy: 1.305702230565376
Energy: 1.3226539096513175
Energy: 1.3057022305669215
Energy: 1.3226539096518324
Energy: 1.3057022305658912
Energy: 1.3962525698823411
Energy: 1.266691874947752
Energy: 1.51254242678107
Energy: 1.2666918749462068
Energy: 1.5125424267661325
Energy: 1.2666918749472371
Energy: 1.5125424266260754
Energy: 1.4997337766941707
Energy: 1.3197160054536772
Energy: 1.4997337766952008
Energy: 1.3197160054547072
Energy: 1.4997337766936556
Energy: 1.310323589205521
Energy: 1.295342789402689
Energy: 1.3028822900834212
Energy: 1.295342789401659
Energy: 1.302882290082906
Energy: 1.295342789403719
Energy: 1.302882290081876
Energy: 1.3174111463274774
Energy: 1.3380167865741779
Energy: 1.3174111463279925
Energy: 1.4459959556891788
Energy: 1.3174111463274774
Energy: 1.3480533643714065
Energy: 1.3415878546970788
Energy: 1.312271703481967
Energy: 1.341587854676475
Energy: 1.3122717034829974
Energy: 1.3415878546800808
Energy: 1.3122717034829974
Energy: 1.314370899905794
Energy: 1.3049973841221778
Energy: 1.314370899905794
Energy: 1.3049973841211477
Energy: 1.314370899905794
Energy: 1.3049973841221778
Energy: 1.2656038828648517
Energy: 1.4913889688034312
Energy: 1.2656038828643366
Energy: 1.4913889688013708
Energy: 1.2656038828633065
Energy: 1.491388968802401
Energy: 1.2783515791545066
Energy: 1.3477815305359129
Energy: 1.278351579152446
Energy: 1.347781530535398
Energy: 1.2783515791539917
Energy: 1.3477815305359129
Energy: 1.2865709877811358
Energy: 1.288966027513661
Energy: 1.2865709877806204
Energy: 1.2889660275116006
Energy: 1.2865709877806204
Energy: 1.288966027512631
Energy: 1.3127328345736786
Energy: 1.317607706067494
Energy: 1.3127328345850104
Energy: 1.3176077060654803
Energy: 1.3127328345901612
Energy: 1.3176077060649654
Energy: 1.2758826683689168
Energy: 1.4847078105636011
Energy: 1.2758826683689168
Energy: 1.4847078101166926
Energy: 1.275882668370977
Energy: 1.4847078066835875
Energy: 1.505698896118304
Energy: 1.2868453270418319
Energy: 1.505698896117789
Energy: 1.2868453270397715
Energy: 1.505698896118304
Energy: 1.2868453270423468
Energy: 1.3601854166451506
Energy: 1.2869456646683561
Energy: 1.3601854166436056
Energy: 1.2869456646719617
Energy: 1.3601854166441205
Energy: 1.2869456646688715
Energy: 1.2677918131639463
Energy: 1.4300111723495084
Energy: 1.2677918131639463
Energy: 1.4300111723479634
Energy: 1.2677918131634311
Energy: 1.4300111723464177
Energy: 1.363201995313264
Energy: 1.3364512034866434
Energy: 1.3632019953112036
Energy: 1.336451203486128
Energy: 1.3632019953117187
Energy: 1.3364512034881886
Energy: 1.2939979943620856
Energy: 1.3049790819923703
Energy: 1.2939979943610556
Energy: 1.3049790819918552
Energy: 1.2939979943600255
Energy: 1.3049790819923703
Energy: 1.317663872990349
Energy: 1.335906262986991
Energy: 1.317663872990349
Energy: 1.3359062629864762
Energy: 1.3176638729872585
Energy: 1.3359062629864762
Energy: 1.3289670945627596
Energy: 1.3272980955986615
Energy: 1.3289670945653353
Energy: 1.3272980955991764
Energy: 1.3289670945617293
Energy: 1.3272980955986615
Energy: 1.4281626369982587
Energy: 1.3029656384650041
Energy: 1.4281626369977436
Energy: 1.302965638463974
Energy: 1.428162636998774
Energy: 1.3029656384650041
Energy: 1.2783992547750047
Energy: 1.3413038398608907
Energy: 1.2783992547755199
Energy: 1.3413038398608907
Energy: 1.2783992547729444
Energy: 1.3413038398603756
Energy: 1.265922295102835
Energy: 1.3138470654719225
Energy: 1.2659222951048956
Energy: 1.3138470654714072
Energy: 1.265922295101805
Energy: 1.3138470654714072
Energy: 1.3602778085461658
Energy: 1.2868405488867969
Energy: 1.3602778085492564
Energy: 1.286840548887827
Energy: 1.360277808547196
Energy: 1.2868405488888572
Energy: 1.373875694358856
Energy: 1.2872054001496946
Energy: 1.3738756943598862
Energy: 1.2872054001481494
Energy: 1.373875694358341
Energy: 1.2872054001496946

minimum gb energy = 1.2656038828633065 eV
minimum distance =  2.3806157008682 Angstroms
sigma value = 33


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

Energy: 0.01799044563567271
Energy: 0.9096020312987303
Energy: 0.017990445635292295
Energy: 0.9096020312991582
Energy: 0.01799044563567271
Energy: 0.9096020312987303
Energy: 0.018758393891317893
Energy: 2.3198743261141725
Energy: 0.018758393890889923
Energy: 2.3198743261146
Energy: 0.018758393891317893
Energy: 2.3198743261146
Energy: 0.9104009662819517
Energy: 0.3257334972906568
Energy: 0.9106130000155037
Energy: 0.32573349729274914
Energy: 0.9106134459320498
Energy: 0.3257334972919407
Energy: 0.018758393891317893
Energy: 2.3198743261141725
Energy: 0.018758393891317893
Energy: 2.3198743261146
Energy: 0.018758393891317893
Energy: 2.3198743261141725

minimum gb energy = 0.017990445635292295 eV
minimum distance =  2.58150642435929 Angstroms
sigma value = 1