Model name: model_name=EAM_Dynamo_MendelevBorovikov_2020_FeNiCr__MO_922363340570_000
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=3.548374074697496
cohesive_energy=4.048047252937728
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: 0.01623664960937196
Energy: 1.4672161742928367
Energy: 0.01623664960937196
Energy: 1.467216174294428
Energy: 0.01623664960937196
Energy: 1.467216174294428
Energy: 1.4672161742934877
Energy: 1.322409912678949
Energy: 1.4672161742941026
Energy: 1.322409912683723
Energy: 1.467216174293777
Energy: 1.3224099126773576
Energy: 0.01623664960937196
Energy: 1.467216174295079
Energy: 0.01623664960937196
Energy: 1.4672161742941026
Energy: 0.01623664960937196
Energy: 1.4672161742947536
Energy: 1.4672161742947536
Energy: 1.3224099126691118
Energy: 1.4672161742953684
Energy: 1.322409912678949
Energy: 1.467216174294428
Energy: 1.3224099126849889
Energy: 0.01623664960904647
Energy: 1.467216174293777
Energy: 0.01623664960904647
Energy: 1.467216174293777
Energy: 0.01623664960904647
Energy: 1.4672161742934877
Energy: 1.467216174294428
Energy: 1.3224099126799256
Energy: 1.4672161742941026
Energy: 1.3224099126796
Energy: 1.4672161742931622
Energy: 1.3224099126856397

minimum gb energy = 0.01623664960904647 eV
minimum distance =  2.26126129072422 Angstroms
sigma value = 1


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

Energy: 1.2243969113409927
Energy: 1.1876678717146323
Energy: 1.224396911341776
Energy: 1.1876678717201166
Energy: 1.2243969113425597
Energy: 1.1876678717177662
Energy: 1.4175894341541302
Energy: 1.1436690753729373
Energy: 1.4175894341525632
Energy: 1.1436690753737206
Energy: 1.4175894341509963
Energy: 1.1436690753729373
Energy: 1.1718455208480785
Energy: 1.2581016341164075
Energy: 1.1718455208512126
Energy: 1.2581016341171911
Energy: 1.1718455208512126
Energy: 1.2581016341164075
Energy: 1.3530964430219647
Energy: 1.1755951840675396
Energy: 1.353096443023532
Energy: 1.1755951840675396
Energy: 1.353096443023532
Energy: 1.1755951840675396
Energy: 1.207228363037019
Energy: 1.3214323894895188
Energy: 1.2072283630385863
Energy: 1.3214323894895188
Energy: 1.2072283630307512
Energy: 1.3214323894887352
Energy: 1.2797236265321745
Energy: 1.1292171325101246
Energy: 1.279723626534525
Energy: 1.1292171324999387
Energy: 1.279723626529824
Energy: 1.129217132512475
Energy: 1.2218044611847236
Energy: 1.2388074772819928
Energy: 1.221804461182373
Energy: 1.238807477273374
Energy: 1.221804461182373
Energy: 1.2388074772788589
Energy: 1.1845737308551263
Energy: 1.345716469497712
Energy: 1.1845737308488582
Energy: 1.3457164694937944
Energy: 1.184573730848075
Energy: 1.3457164695000623
Energy: 1.320026209089696
Energy: 1.2115121162754479
Energy: 1.3200262090904793
Energy: 1.2115121162840665
Energy: 1.3200262090928299
Energy: 1.2115121162832831
Energy: 1.1158064261571605
Energy: 1.335491508754315
Energy: 1.1158064261579441
Energy: 1.3354915087394283
Energy: 1.1158064261563774
Energy: 1.3354915087472634
Energy: 1.2843713520358613
Energy: 1.1292909274134628
Energy: 1.2843713520280262
Energy: 1.1292909274134628
Energy: 1.2843713520272426
Energy: 1.1292909274134628
Energy: 1.0937286943976157
Energy: 1.2758906544184536
Energy: 1.0937286943968323
Energy: 1.2758906544121853
Energy: 1.0937286943976157
Energy: 1.275890654409835
Energy: 1.3943365029858295
Energy: 1.1035914848571364
Energy: 1.3943365029834787
Energy: 1.1035914848571364
Energy: 1.3943365029858295
Energy: 1.1035914848571364
Energy: 1.1376379087586836
Energy: 1.2322906269341516
Energy: 1.1376379087579
Energy: 1.2322906269341516
Energy: 1.1376379087579
Energy: 1.2322906269302338
Energy: 1.412800910861907
Energy: 1.1297685116463898
Energy: 1.4128009108611235
Energy: 1.1297685116456062
Energy: 1.412800910861907
Energy: 1.1297685116463898
Energy: 1.3948426947551815
Energy: 1.2767796942367076
Energy: 1.3948426947551815
Energy: 1.2767796942351406
Energy: 1.394842694754398
Energy: 1.2767796942382745
Energy: 1.2358363615319232
Energy: 1.2391634823316504
Energy: 1.2358363615193872
Energy: 1.2391634823308668
Energy: 1.235836361511552
Energy: 1.2391634823316504
Energy: 1.2374474673154368
Energy: 1.1909436846659902
Energy: 1.2374474673130864
Energy: 1.1909436846659902
Energy: 1.237447467317004
Energy: 1.1909436846644232
Energy: 1.1864551318506025
Energy: 1.1722027868108946
Energy: 1.1711038190865652
Energy: 1.1722027868124616
Energy: 1.1711038190904826
Energy: 1.1722027868148122
Energy: 1.2633501787199999
Energy: 1.1285851721859497
Energy: 1.2633501787199999
Energy: 1.1285851721883
Energy: 1.263350178718433
Energy: 1.128585172182032
Energy: 1.1345691658420203
Energy: 1.3941377453994257
Energy: 1.1345691658420203
Energy: 1.3941377454033435
Energy: 1.1345691658420203
Energy: 1.394137745400993
Energy: 1.2838249819312226
Energy: 1.214289883608748
Energy: 1.283824981930439
Energy: 1.2142898836095313
Energy: 1.2838249819296554
Energy: 1.214289883608748
Energy: 1.0981756734580392
Energy: 1.4921518410507875
Energy: 1.1531686488504846
Energy: 1.4921518410523547
Energy: 1.1037338390299354
Energy: 1.492151841051571

minimum gb energy = 1.0937286943968323 eV
minimum distance =  2.26314410612055 Angstroms
sigma value = 33


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

Energy: 1.4163058694323583
Energy: 1.29572254891096
Energy: 1.3275155032646775
Energy: 1.2957225489189819
Energy: 1.416305869437706
Energy: 1.2957225489185364
Energy: 1.532394937819578
Energy: 1.1561931540626877
Energy: 1.5323949378186867
Energy: 1.156193154066699
Energy: 1.5323949378177955
Energy: 1.15619315406759
Energy: 1.1474104544959125
Energy: 1.2096556037523547
Energy: 1.147410454497695
Energy: 1.209655603753246
Energy: 1.1474104544959125
Energy: 1.2096556037536919
Energy: 1.3610638502942272
Energy: 1.3214412860886682
Energy: 1.361063850321858
Energy: 1.3214412860810918
Energy: 1.3610638502897707
Energy: 1.3214412860802005
Energy: 1.2571836478102303
Energy: 1.161981182021486
Energy: 1.2571836478102303
Energy: 1.1619811820201489
Energy: 1.2571836478115677
Energy: 1.1619811820254968
Energy: 1.1496407579063619
Energy: 1.1473090075753558
Energy: 1.1496407579005683
Energy: 1.1473090075731274
Energy: 1.1496407579014598
Energy: 1.147309007574464
Energy: 1.431429971572169
Energy: 1.3422851666811115
Energy: 1.4244954419773097
Energy: 1.342285166690916
Energy: 1.4314299715645928
Energy: 1.34228516669047
Energy: 1.1369671506086254
Energy: 1.4497796106406917
Energy: 1.1368900012022662
Energy: 1.449779610650051
Energy: 1.1369671506108538
Energy: 1.4497796106513876
Energy: 1.2137160371271973
Energy: 1.1525784478994434
Energy: 1.2137160371312081
Energy: 1.1525784478927585
Energy: 1.2137160371472515
Energy: 1.1525784478932042
Energy: 1.2027141336408804
Energy: 1.5475700351381245
Energy: 1.202804759556078
Energy: 1.5475700351510486
Energy: 1.2027141336386522
Energy: 1.5475700351506032
Energy: 1.3718793565471772
Energy: 1.199778089934561
Energy: 1.3718793565453946
Energy: 1.1997780899220825
Energy: 1.3718793565400467
Energy: 1.199778089921191
Energy: 1.1500508432609229
Energy: 1.2499575757393144
Energy: 1.149870648953903
Energy: 1.2499575757406511
Energy: 1.1500508432640426
Energy: 1.2499575757402055
Energy: 1.4562819991376437
Energy: 1.1634475000232383
Energy: 1.2895397651683587
Energy: 1.163447500022347
Energy: 1.4562819991309994
Energy: 1.1634475000227926
Energy: 1.3387654845830423
Energy: 1.3802073644563058
Energy: 1.2348766446508945
Energy: 1.380207364457197
Energy: 1.3387654845825967
Energy: 1.380207364457197
Energy: 1.222199386534204
Energy: 1.2110557326535945
Energy: 1.2221993865310843
Energy: 1.2110557326580509
Energy: 1.2221993865333127
Energy: 1.211055732658942
Energy: 1.1497838887590395
Energy: 1.1961077181076805
Energy: 1.149783888761268
Energy: 1.1961077181054525
Energy: 1.1497838887661702
Energy: 1.1961077181058979
Energy: 1.3524566457905849
Energy: 1.3073972070155289
Energy: 1.3524566457879108
Energy: 1.3073972070338007
Energy: 1.3524566457945955
Energy: 1.3073972070324638
Energy: 1.3207010812774644
Energy: 1.1477119542578307
Energy: 1.3207010812747906
Energy: 1.1477119542515912
Energy: 1.320701081279247
Energy: 1.1477119542529284
Energy: 1.1444060260174682
Energy: 1.1948253382267293
Energy: 1.1444060260201425
Energy: 1.1948253382311862
Energy: 1.1444060260290556
Energy: 1.1948253382369793
Energy: 1.3297594643171389
Energy: 1.348141178420361
Energy: 1.344680039477091
Energy: 1.348141178423035
Energy: 1.329759464319367
Energy: 1.3481411784225894
Energy: 1.1415427704370609
Energy: 1.5764246830897188
Energy: 1.1419213666247157
Energy: 1.5764246830955122
Energy: 1.1415427704424088
Energy: 1.5764246830964035
Energy: 1.2100037911095163
Energy: 1.1529441509732266
Energy: 1.210003791110853
Energy: 1.1529441509709983
Energy: 1.210003791108625
Energy: 1.152944150971444
Energy: 1.1985698744808222
Energy: 1.525852432091556
Energy: 1.198543086855689
Energy: 1.525852432099578
Energy: 1.1985698744901403
Energy: 1.5258524321004694
Energy: 1.3655764966529487
Energy: 1.2555078497959562
Energy: 1.3655764966484918
Energy: 1.255507849792391
Energy: 1.3655764966444812
Energy: 1.255507849792391
Energy: 1.147466746391508
Energy: 1.1509910784210806
Energy: 1.1474661864441529
Energy: 1.1509910784295483
Energy: 1.1474667463990844
Energy: 1.1509910784282111
Energy: 1.4609749018005307
Energy: 1.2552867636066782
Energy: 1.351603324058014
Energy: 1.2552867636066782
Energy: 1.4609749018063243
Energy: 1.25528676360445
Energy: 1.4183667047989814
Energy: 1.2589812485616547
Energy: 1.3268755199886473
Energy: 1.2589812485638423
Energy: 1.4183667047958617
Energy: 1.2589812485647336
Energy: 1.1478315255822003
Energy: 1.208749935945493
Energy: 1.1478315255759612
Energy: 1.2087499359459388
Energy: 1.1478315255772982
Energy: 1.208749935937512
Energy: 1.4275567653024952
Energy: 1.1572826271871306
Energy: 1.427556765299376
Energy: 1.157282627198718
Energy: 1.4275567653002672
Energy: 1.157282627198718
Energy: 1.1983949582342641
Energy: 1.3711136063385565
Energy: 1.1983949582356008
Energy: 1.371113606335437
Energy: 1.1983949582306987
Energy: 1.371113606336774
Energy: 1.3214995674555743
Energy: 1.152924000920839
Energy: 1.3214995674560202
Energy: 1.1529240009203934
Energy: 1.3214995674560202
Energy: 1.1529240009195019
Energy: 1.1593923959802253
Energy: 1.2922060734270049
Energy: 1.1593923959802253
Energy: 1.2922060734969325
Energy: 1.1593923959850867
Energy: 1.2922060734265592
Energy: 1.3290496927321946
Energy: 1.348812822572739
Energy: 1.329144119356565
Energy: 1.3488128225754128
Energy: 1.3290496927281836
Energy: 1.3488128225749672
Energy: 1.1841072546530769
Energy: 1.3082935353296181
Energy: 1.1841072546566422
Energy: 1.3082935353309553
Energy: 1.1841072546633271
Energy: 1.3082935353309553
Energy: 1.2216398697651694
Energy: 1.1475084364645736
Energy: 1.221639869764724
Energy: 1.147508436460563
Energy: 1.221639869760267
Energy: 1.1475084364596715
Energy: 1.3050400179050052
Energy: 1.3548895368509413
Energy: 1.3050400179045598
Energy: 1.3548895368482674
Energy: 1.3050400179014399
Energy: 1.3548895368473761
Energy: 1.156460920041008
Energy: 1.2862046869436305
Energy: 1.1569385829057492
Energy: 1.2862046869293695
Energy: 1.1564609200441276
Energy: 1.2862046869302608
Energy: 1.1157497027612264
Energy: 1.1544893295485625
Energy: 1.149370317853082
Energy: 1.1544893295481167
Energy: 1.115749702765683
Energy: 1.1544893295472254
Energy: 1.3385973977019001
Energy: 1.395880417121423
Energy: 1.2284888426715668
Energy: 1.395880417124097
Energy: 1.3385973976894219
Energy: 1.3958804171236514
Energy: 1.4458672357431215
Energy: 1.1114977247324778
Energy: 1.4458672357444589
Energy: 1.1114977247391624
Energy: 1.445867235742676
Energy: 1.1114977247391624
Energy: 1.15000422579784
Energy: 1.1183574424459994
Energy: 1.1500042257996228
Energy: 1.1183574424477822
Energy: 1.1500042257947205
Energy: 1.1183574424482277

minimum gb energy = 1.1114977247324778 eV
minimum distance =  2.31376956309723 Angstroms
sigma value = 51


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

Energy: 1.2878400699503143
Energy: 1.2616191459812334
Energy: 1.2066427015242491
Energy: 1.2616191459812334
Energy: 1.2878400699472168
Energy: 1.2616191459802004
Energy: 1.4290368287874349
Energy: 1.1964072596632793
Energy: 1.429036828784337
Energy: 1.1964072596653446
Energy: 1.4290368287864021
Energy: 1.196407259664312
Energy: 1.3038775772072706
Energy: 1.3080906248143065
Energy: 1.3038775772052054
Energy: 1.3080906248163717
Energy: 1.3038775772021076
Energy: 1.308090624815339
Energy: 1.337600111121769
Energy: 1.188329134183783
Energy: 1.3376001111238343
Energy: 1.1883291341858477
Energy: 1.3376001111228017
Energy: 1.1883291341858477
Energy: 1.3749240316839895
Energy: 1.315777887229038
Energy: 1.3749240316819245
Energy: 1.315777887229038
Energy: 1.374924031677794
Energy: 1.315777887229038
Energy: 1.2581165058376627
Energy: 1.308925905841834
Energy: 1.2581165058407604
Energy: 1.308925905849062
Energy: 1.2581165058407604
Energy: 1.308925905849062
Energy: 1.3071893444887925
Energy: 1.2848918695186378
Energy: 1.3071893444867275
Energy: 1.2848918695196703
Energy: 1.3071893444908578
Energy: 1.284891869517605
Energy: 1.162211521338864
Energy: 1.3155574443503566
Energy: 1.1622115213429942
Energy: 1.3155574443462263
Energy: 1.1622115213398965
Energy: 1.3155574443472589
Energy: 1.3895586826278503
Energy: 1.1897584888659196
Energy: 1.3895586826299156
Energy: 1.1897584888617891
Energy: 1.3895586826319806
Energy: 1.1897584888617891
Energy: 1.1819642271251665
Energy: 1.497796703277652
Energy: 1.1819557261751965
Energy: 1.4977967032797173
Energy: 1.1819642271231012
Energy: 1.4977967032797173
Energy: 1.490285945411532
Energy: 1.210137170654985
Energy: 1.3645577507184241
Energy: 1.2101371706570503
Energy: 1.4902859454104993
Energy: 1.2101371706570503
Energy: 1.2857126530386112
Energy: 1.2550364935269855
Energy: 1.1810807703201958
Energy: 1.2550364935228553
Energy: 1.2857126530396439
Energy: 1.2550364935228553
Energy: 1.5012834128574362
Energy: 1.1927844978670723
Energy: 1.5012834128595014
Energy: 1.192784497865007
Energy: 1.5012834128646644
Energy: 1.192784497865007
Energy: 1.3300272666018866
Energy: 1.1561891082115794
Energy: 1.3300272666039519
Energy: 1.1561891082115794
Energy: 1.330027266606017
Energy: 1.1561891082105469
Energy: 1.2581052671319226
Energy: 1.234378456469945
Energy: 1.2581052671319226
Energy: 1.2343784564689122
Energy: 1.2581052671267596
Energy: 1.2343784564689122
Energy: 1.3739261447726006
Energy: 1.2864783240018376
Energy: 1.373926144771568
Energy: 1.2864783239997728
Energy: 1.3739261447674378
Energy: 1.2864783240018376
Energy: 1.2585683417140345
Energy: 1.3383846737743013
Energy: 1.2585683417088716
Energy: 1.3383846737743013
Energy: 1.2585683417068063
Energy: 1.3383846737732688
Energy: 1.2367795953624894
Energy: 1.2896576606942063
Energy: 1.2367795953624894
Energy: 1.2896576606921413
Energy: 1.2367795953635219
Energy: 1.2896576606921413

minimum gb energy = 1.1561891082105469 eV
minimum distance =  2.24888552224055 Angstroms
sigma value = 19


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

Energy: 1.1711426808341034
Energy: 1.2522874113231313
Energy: 1.1667184046845438
Energy: 1.2522874113231313
Energy: 1.171142680828591
Energy: 1.2522874113231313
Energy: 1.3155875218063389
Energy: 1.0343718713018544
Energy: 1.3155875218032762
Energy: 1.0343718712957295
Energy: 1.3155875218020514
Energy: 1.0343718712981793
Energy: 1.2211226031345062
Energy: 1.0365040602224038
Energy: 1.221122603135731
Energy: 1.0365040602230164
Energy: 1.2211226031320561
Energy: 1.036504060223629
Energy: 1.0905598690679552
Energy: 1.220622577708307
Energy: 1.0905598690642802
Energy: 1.2206225777101445
Energy: 1.0905598690655052
Energy: 1.2206225777107294
Energy: 1.1128885150096244
Energy: 1.114980479028687
Energy: 1.1128885150059493
Energy: 1.114980479028687
Energy: 1.1128885150059493
Energy: 1.1149804790292996
Energy: 1.110765750855591
Energy: 1.1140439257767483
Energy: 1.1110009700273742
Energy: 1.1140439257755235
Energy: 1.1107657508592659
Energy: 1.1140439257853232
Energy: 1.0343246330769513
Energy: 1.220597027452728
Energy: 1.0343246330769513
Energy: 1.2205970274484406
Energy: 1.034324633077564
Energy: 1.2205970274484406
Energy: 1.2207816276449996
Energy: 1.1154441987325463
Energy: 1.2208881418273547
Energy: 1.1154441987343835
Energy: 1.2207816276407122
Energy: 1.115444198733771
Energy: 1.237316284897159
Energy: 1.088354104675112
Energy: 1.2585693465622674
Energy: 1.0883541046763372
Energy: 1.2373162848953216
Energy: 1.0883541046763372
Energy: 1.1048775654542105
Energy: 1.2329909697696946
Energy: 1.140899543369445
Energy: 1.2329909697715318
Energy: 1.104877565449923
Energy: 1.2329909697703068
Energy: 1.3155875218038888
Energy: 1.0343718713012418
Energy: 1.3155875218051138
Energy: 1.034371871290217
Energy: 1.315587521800214
Energy: 1.0343718712945045
Energy: 1.2211226031363436
Energy: 1.0365040602205666
Energy: 1.221122603135731
Energy: 1.0365040602205666
Energy: 1.2211226031320561
Energy: 1.036504060221179
Energy: 1.0905598690618301
Energy: 1.2205723424061627
Energy: 1.0905598690587677
Energy: 1.2205723424031
Energy: 1.0905598690599927
Energy: 1.2205723424037127
Energy: 1.1128885150139118
Energy: 1.1281236791600655
Energy: 1.1128885150096244
Energy: 1.1281236791588407
Energy: 1.1128885150077867
Energy: 1.128123679158228
Energy: 1.0867430287737692
Energy: 1.113764793548373
Energy: 1.086743028768869
Energy: 1.113764793547148
Energy: 1.0867430287725444
Energy: 1.1137647935453103
Energy: 1.034324633073889
Energy: 1.2205970274557905
Energy: 1.0343246330757265
Energy: 1.220597027452728
Energy: 1.0343246330745015
Energy: 1.220597027452728
Energy: 1.22115132030201
Energy: 1.1154441987325463
Energy: 1.220603613982042
Energy: 1.1154441987343835
Energy: 1.221151320303847
Energy: 1.1154441987331587
Energy: 1.1704545345426953
Energy: 1.0883541046744996
Energy: 1.3097923669118026
Energy: 1.0883541046757246
Energy: 1.1704545345433077
Energy: 1.0883541046769494
Energy: 1.171142680832266
Energy: 1.2522874113200686
Energy: 1.1667184046857688
Energy: 1.2522874113219065
Energy: 1.1711426808267533
Energy: 1.2522874113219065
Energy: 1.3155875218038888
Energy: 1.0343718712981793
Energy: 1.3155875218069513
Energy: 1.0343718712957295
Energy: 1.3155875218038888
Energy: 1.034371871296342
Energy: 1.2211226031338935
Energy: 1.036504060221179
Energy: 1.2211226031351183
Energy: 1.0365040602217916
Energy: 1.2211226031320561
Energy: 1.0365040602217916
Energy: 1.0905598690661178
Energy: 1.2206225777076947
Energy: 1.090559869061218
Energy: 1.2206225777101445
Energy: 1.0905598690624425
Energy: 1.2206225777107294
Energy: 1.1128885150114618
Energy: 1.11498047900789
Energy: 1.1128885150077867
Energy: 1.1149804790103401
Energy: 1.112888515006562
Energy: 1.1149804790097275
Energy: 1.110765750851944
Energy: 1.1140439257883858
Energy: 1.1110009700304089
Energy: 1.114043925795708
Energy: 1.1107657508537534
Energy: 1.1140439257963206
Energy: 1.0343246330732765
Energy: 1.2205970274533406
Energy: 1.0343246330732765
Energy: 1.2205970274496656
Energy: 1.0343246330708267
Energy: 1.220597027450278
Energy: 1.2207816276468375
Energy: 1.1154441987356087
Energy: 1.2208881418243198
Energy: 1.1154441987380588
Energy: 1.2207816276413248
Energy: 1.1154441987380588
Energy: 1.2373162849014465
Energy: 1.0883541046732745
Energy: 1.2585693465598173
Energy: 1.0883541046769494
Energy: 1.237316284899609
Energy: 1.088354104677562
Energy: 1.1048775655007603
Energy: 1.2329909697721444
Energy: 1.140899543371895
Energy: 1.2329909697733694
Energy: 1.1048775654842227
Energy: 1.2329909697739818
Energy: 1.3155875218069513
Energy: 1.034371871302467
Energy: 1.3155875218094013
Energy: 1.0343718712932795
Energy: 1.3155875218051138
Energy: 1.034371871292667
Energy: 1.2211226031375406
Energy: 1.0365040602205666
Energy: 1.2211226031387659
Energy: 1.0365040602193416
Energy: 1.2211226031338935
Energy: 1.0365040602193416

minimum gb energy = 1.0343246330708267 eV
minimum distance =  2.34912975437031 Angstroms
sigma value = 27


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

Energy: 1.1555033883342885
Energy: 1.2119542283251026
Energy: 1.0268571769430708
Energy: 1.2119542283281033
Energy: 1.155503388326787
Energy: 1.2119542283281033
Energy: 1.1599302088154602
Energy: 1.0350824924884034
Energy: 1.1599302088169603
Energy: 1.035082492486903
Energy: 1.1599302088139596
Energy: 1.0350824924899036
Energy: 1.183274425995037
Energy: 1.2360171246341032
Energy: 1.1832744259935368
Energy: 1.2360171246266018
Energy: 1.1832744259860353
Energy: 1.2360171246266018
Energy: 1.2410561313979505
Energy: 1.140685277025049
Energy: 1.2410561313964503
Energy: 1.1406852770265492
Energy: 1.2410561313964503
Energy: 1.1406852770235487
Energy: 1.2375316433151378
Energy: 1.1399211670776073
Energy: 1.2375316433136374
Energy: 1.1399211670776073
Energy: 1.2375316433106365
Energy: 1.1399211670746068
Energy: 1.202595844542723
Energy: 1.3267043650200008
Energy: 1.202595844544223
Energy: 1.3267043650155
Energy: 1.2025958445502245
Energy: 1.3267043650245018
Energy: 1.1485166121279822
Energy: 1.2620434472819138
Energy: 1.148516612126482
Energy: 1.2620434472834143
Energy: 1.1485166121279822
Energy: 1.2620434472834143
Energy: 1.1483750582309529
Energy: 1.2106151856847047
Energy: 1.0195000097651712
Energy: 1.2106151856817042
Energy: 1.1483750582294527
Energy: 1.2106151856802039
Energy: 1.1604201733640302
Energy: 1.0926187724098526
Energy: 1.1604201733295236
Energy: 1.0926187724203547
Energy: 1.1604201733760329
Energy: 1.0926187724188543
Energy: 1.3100609300766561
Energy: 1.1763882325447093
Energy: 1.3100609300781565
Energy: 1.1763882325402082
Energy: 1.3100609300796568
Energy: 1.1763882325432087
Energy: 1.3880437720957854
Energy: 1.1386814658277877
Energy: 1.024630751496255
Energy: 1.138681465833789
Energy: 1.3880437720927847
Energy: 1.138681465833789
Energy: 1.1911142978976996
Energy: 1.2617581666486297
Energy: 1.1911142978931988
Energy: 1.2617581666471294
Energy: 1.1911142978946991
Energy: 1.2617581666501299

minimum gb energy = 1.0195000097651712 eV
minimum distance =  2.2389264847676 Angstroms
sigma value = 9


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

Energy: 1.0885351633976692
Energy: 0.9875811997536184
Energy: 1.00912730270102
Energy: 0.9875811997624708
Energy: 1.0885351634052571
Energy: 0.9875811997620492
Energy: 1.2801548048549198
Energy: 0.9843474665745563
Energy: 1.280154804845224
Energy: 0.9843474665804579
Energy: 1.2801548048498612
Energy: 0.9843474665825657
Energy: 0.9286875991404702
Energy: 1.0881865405281437
Energy: 0.9286875991396271
Energy: 1.0881865405235067
Energy: 0.9286875991400487
Energy: 1.0881865405239284
Energy: 0.9682833045409059
Energy: 0.8594016059800446
Energy: 1.015512115709556
Energy: 0.8594016066630688
Energy: 0.9682833045434353
Energy: 0.8594016056332632
Energy: 1.0404878084224956
Energy: 0.9542803832654411
Energy: 1.0404878084279756
Energy: 0.9542803832662842
Energy: 1.0404878084254463
Energy: 0.9542803832675489
Energy: 0.9369815671013909
Energy: 1.011509289589827
Energy: 0.9369815671018124
Energy: 1.011509289738174
Energy: 0.9369815671022339
Energy: 1.0115092895835038
Energy: 0.9134283723688977
Energy: 1.065932968896607
Energy: 0.9134283723734965
Energy: 1.065932968902087
Energy: 0.9134283723651038
Energy: 1.0659329689046166
Energy: 0.8985453259717618
Energy: 0.9424746770785394
Energy: 0.8985453259350871
Energy: 0.9424746770612942
Energy: 0.8985453259414103
Energy: 0.9424746770634019
Energy: 1.0268730511724506
Energy: 0.9586440028055879
Energy: 1.0268730511661275
Energy: 0.9586440028123326
Energy: 1.0268730511610689
Energy: 0.958644002811068
Energy: 0.9943109489268056
Energy: 1.029921880092253
Energy: 0.994310948925541
Energy: 1.02992188009689
Energy: 0.9943109489280703
Energy: 1.029921880081714
Energy: 0.9518507586484679
Energy: 0.8705701617452649
Energy: 0.951850758645517
Energy: 0.870570161754539
Energy: 0.9518507586535265
Energy: 0.8705701617536961
Energy: 0.9927230659341684
Energy: 1.0399211609827341
Energy: 0.9923943514368244
Energy: 1.0399211609730383
Energy: 0.9927230659425993
Energy: 1.0399211609738814
Energy: 0.9476511655854373
Energy: 1.029138505751649
Energy: 0.9476511655850157
Energy: 1.029138505747012
Energy: 0.947651165588388
Energy: 1.0291385057503843
Energy: 0.9713708459161343
Energy: 0.99291554861593
Energy: 0.9713708459144481
Energy: 0.9929155486239395
Energy: 0.9713708459300071
Energy: 0.9929155486285766
Energy: 0.9462570828041198
Energy: 0.9743947494538235
Energy: 0.9462570828015905
Energy: 0.9743947494542451
Energy: 0.946257082793581
Energy: 0.974394749452559
Energy: 1.139817128048468
Energy: 1.0250078739290507
Energy: 1.1398171280573204
Energy: 0.9099866134595597
Energy: 1.1398171280653298
Energy: 1.025007873936217
Energy: 1.2390253277447532
Energy: 0.8343320395336854
Energy: 1.2326736261968123
Energy: 0.8343320395265189
Energy: 1.2390253277552534
Energy: 0.8343320395277837
Energy: 0.898127512842301
Energy: 0.9864896747786329
Energy: 0.8981275128397717
Energy: 0.9864896747857994
Energy: 0.8981275128456734
Energy: 0.9864896747866425
Energy: 0.9014215478634283
Energy: 1.246123276120532
Energy: 0.9089079128292071
Energy: 1.2461232761331786
Energy: 0.9014215477087966
Energy: 1.2461232761167382
Energy: 0.9932228198848783
Energy: 0.9998526036634617
Energy: 0.9932228198865644
Energy: 1.034481479188289
Energy: 0.9932228198874076
Energy: 1.073931678830379
Energy: 0.9020954188240762
Energy: 1.110317240708188
Energy: 0.9020954188261838
Energy: 1.1103172383043245
Energy: 0.9020954188249192
Energy: 1.110317239405755
Energy: 0.9507548301951957
Energy: 0.9740885617654914
Energy: 0.950754830204048
Energy: 0.9740885617524234
Energy: 0.950754830202362
Energy: 0.9740885617528449
Energy: 1.1876831638329755
Energy: 0.8338883203947717
Energy: 1.1876831633749436
Energy: 0.8338883204002518
Energy: 1.1876831620885298
Energy: 0.8338883204048889
Energy: 0.9971739100446182
Energy: 1.0164886647604148
Energy: 0.9971739100492552
Energy: 1.0164886655222303
Energy: 0.9971739100517845
Energy: 1.0164886654497622
Energy: 0.8842896756416742
Energy: 1.039782929381562
Energy: 0.8842896756450465
Energy: 1.039782929373131
Energy: 0.8842896756526344
Energy: 1.039782929373131
Energy: 0.9823085271219423
Energy: 1.0038707990352222
Energy: 0.9718298041431672
Energy: 1.0038707990369085
Energy: 0.9823085271067666
Energy: 1.0038707990364868
Energy: 0.9094009125895034
Energy: 0.9998206011183407
Energy: 0.9094009125869741
Energy: 0.9998206011170759
Energy: 0.9094009125781216
Energy: 0.9998206011174975
Energy: 1.0022344269154972
Energy: 0.9765978737158605
Energy: 1.0022344269184482
Energy: 0.9765978737318792
Energy: 1.0022344269247714
Energy: 0.9765978737314578
Energy: 0.9961820611706771
Energy: 0.8765401511566371
Energy: 0.9143425307770714
Energy: 0.8765401511650681
Energy: 0.9961820611685692
Energy: 0.8765401511503138
Energy: 0.9845395820532421
Energy: 0.9963013645044401
Energy: 0.9845395820448112
Energy: 0.9963013645099201
Energy: 0.9845395820469189
Energy: 0.9963013645044401
Energy: 1.005452285165739
Energy: 0.9541644765474536
Energy: 1.0054522851724836
Energy: 0.9541644765326992
Energy: 1.0054522851712189
Energy: 0.9541644765331209
Energy: 0.896602306205464
Energy: 1.00100003049265
Energy: 0.8972529800431267
Energy: 1.0010000304859055
Energy: 0.8966023061844249
Energy: 1.0010000304854838
Energy: 0.9508986037670338
Energy: 1.0113713251096244
Energy: 0.950898603760289
Energy: 1.0113713251180554
Energy: 0.9508986037636614
Energy: 1.0113713251218492
Energy: 0.967105474563747
Energy: 0.9828740726979378
Energy: 0.967105474556619
Energy: 0.9753482219050928
Energy: 0.967105474563747
Energy: 0.9964490134562037
Energy: 1.0510505632296794
Energy: 0.953422998604413
Energy: 1.0510505632292582
Energy: 0.9534229986195889
Energy: 1.0510505632157685
Energy: 0.9534229986157948
Energy: 0.9554117453398524
Energy: 0.8707775379190951
Energy: 0.9554117453377446
Energy: 0.870777537888322
Energy: 0.9554117453322645
Energy: 0.8707775379292123
Energy: 0.903961994150237
Energy: 1.127682666367328
Energy: 0.9039619941544522
Energy: 1.1276826663601616
Energy: 0.9039619941430705
Energy: 1.1276826663677497
Energy: 1.2072299717068402
Energy: 1.0149076332373426
Energy: 1.2072299717068402
Energy: 1.0149076332259608
Energy: 1.2072299717051538
Energy: 1.0149076332305975
Energy: 1.0091273027043923
Energy: 0.987581199751089
Energy: 1.0091273027043923
Energy: 0.9875811997561474
Energy: 1.0091273027031276
Energy: 0.9875811997578336
Energy: 1.2801548048578706
Energy: 0.9843474665796147
Energy: 1.280154804845224
Energy: 0.98434746659686
Energy: 1.2801548048364098
Energy: 0.9843474665960168
Energy: 0.9286875991518522
Energy: 1.0881865405281437
Energy: 0.9286875991459506
Energy: 1.0881865405319378
Energy: 0.9286875991446857
Energy: 1.08818654053531
Energy: 0.9898427375058207
Energy: 0.866985943857022
Energy: 1.020908997537468
Energy: 0.8669859399232045
Energy: 0.9898427355355395
Energy: 0.8669859463839394
Energy: 1.0404878084300833
Energy: 0.9542803832671272
Energy: 1.0404878084326126
Energy: 0.9542803832704997
Energy: 1.0404878084309266
Energy: 0.9542803832709214

minimum gb energy = 0.8338883203947717 eV
minimum distance =  2.23115466410881 Angstroms
sigma value = 57


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

Energy: 1.2839022053166456
Energy: 1.0372157356289484
Energy: 0.5119723912277654
Energy: 1.0372157356289484
Energy: 1.2839022053166456
Energy: 1.0372157356231906
Energy: 1.024515045193381
Energy: 1.0318643530105096
Energy: 1.024515042402174
Energy: 1.0318643530105096
Energy: 1.0245150442236644
Energy: 1.0318643530105096
Energy: 1.0122025624199205
Energy: 0.7474647178810682
Energy: 1.0122025624180013
Energy: 0.7474647178820278
Energy: 1.0122025624189606
Energy: 0.7474647178801086
Energy: 1.0366742710517516
Energy: 0.8307335800454358
Energy: 1.0366742710479133
Energy: 0.8307335800425569
Energy: 1.036674271052711
Energy: 0.8307335800396781
Energy: 0.42817338327422144
Energy: 1.0378431347732517
Energy: 0.4281733841595372
Energy: 1.0378431347521841
Energy: 0.42817338313416387
Energy: 1.0378431346706622
Energy: 0.903957350117221
Energy: 1.0108482541420656
Energy: 0.9040361951820096
Energy: 1.010848254141106
Energy: 0.9039573501181806
Energy: 1.0108482541459038
Energy: 0.9053491695014707
Energy: 0.47635694230390946
Energy: 0.9054060463723921
Energy: 0.4763569423048691
Energy: 0.9053491695014707
Energy: 0.47635694230582865
Energy: 1.0388233297768672
Energy: 0.4251816899110665
Energy: 1.0388233297807057
Energy: 0.4251816899081876
Energy: 1.0388233297816651
Energy: 0.4251816899101068
Energy: 1.0374819228061145
Energy: 0.8605546120449131
Energy: 1.0374819228022762
Energy: 0.8605546120468325
Energy: 1.0374819228080339
Energy: 0.860554612047792
Energy: 0.4758975945929393
Energy: 1.020446669102666
Energy: 0.47589759459102016
Energy: 1.020446669101706
Energy: 0.4758975945929393
Energy: 1.0204466691036251
Energy: 0.4278385056886546
Energy: 1.0323311711725145
Energy: 0.4278385056896142
Energy: 1.0323311711725145
Energy: 0.42783850568481624
Energy: 1.032331171176353
Energy: 1.2839022053166456
Energy: 1.0372157356251097
Energy: 0.5119723912277654
Energy: 1.037215735627029
Energy: 1.2839022053166456
Energy: 1.0372157356212712
Energy: 1.024515044444241
Energy: 1.0318643530105096
Energy: 1.0245150449813973
Energy: 1.0318643530105096
Energy: 1.0245150431704628
Energy: 1.03186435300955
Energy: 1.0122025624170417
Energy: 0.7474647178849065
Energy: 1.0122025624180013
Energy: 0.7474647178829874
Energy: 1.0122025624170417
Energy: 0.747464717879149
Energy: 1.036674271050792
Energy: 0.8307335800425569
Energy: 1.0366742710498325
Energy: 0.8307335800415975
Energy: 1.0366742710536707
Energy: 0.8307335800396781
Energy: 0.4281733831754266
Energy: 1.0378431346572277
Energy: 0.42817338347852846
Energy: 1.0378431347560226
Energy: 0.4281733830488033
Energy: 1.037843134646672
Energy: 0.9039573501181806
Energy: 1.0108482541420656
Energy: 0.9040361951810499
Energy: 1.0108482541420656
Energy: 0.9039573501181806
Energy: 1.0108482541449442
Energy: 0.9053491695033897
Energy: 0.4763569423048691
Energy: 0.9054060463733515
Energy: 0.4763569423048691
Energy: 0.9053491695043495
Energy: 0.47635694230678827
Energy: 1.0388233297816651
Energy: 0.4251816899101068
Energy: 1.0388233297759075
Energy: 0.4251816899062684
Energy: 1.0388233297778269
Energy: 0.4251816899110665

minimum gb energy = 0.4251816899062684 eV
minimum distance =  2.38561541119898 Angstroms
sigma value = 11


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

Energy: 0.844647328203966
Energy: 0.9900515631590106
Energy: 0.8446473282032629
Energy: 0.9900515631597134
Energy: 0.8446473282046689
Energy: 0.9900515631611193
Energy: 0.9718821798481095
Energy: 1.015019421917066
Energy: 0.971882179844595
Energy: 1.015019421918472
Energy: 0.9718821798431893
Energy: 1.015019421918472
Energy: 1.1090898454775986
Energy: 1.0696824229140829
Energy: 1.1090898454768956
Energy: 1.0696824229295472
Energy: 1.1090898454783014
Energy: 1.069682422923924
Energy: 1.1803366982804553
Energy: 0.755981709064704
Energy: 1.1803366982839698
Energy: 0.7559817090632982
Energy: 1.180336698282564
Energy: 0.7559817090618922
Energy: 0.9765024766836172
Energy: 0.748110496143794
Energy: 0.9765024766836172
Energy: 0.7481104961430911
Energy: 0.9765024766843202
Energy: 0.748110496143794
Energy: 0.937178097576143
Energy: 1.0909298291217275
Energy: 0.9371780975824694
Energy: 1.0909298291210245
Energy: 0.937178097576143
Energy: 1.0909298291210245
Energy: 0.7510732369897208
Energy: 1.1702670281110836
Energy: 0.7510732369890178
Energy: 1.1702670281153014
Energy: 0.7510732369897208
Energy: 1.170267028108272
Energy: 1.0353737182090972
Energy: 0.7435511890769984
Energy: 1.0353737182090972
Energy: 0.7435511890755926
Energy: 1.0353737182098
Energy: 0.7435511890784042
Energy: 1.0334175176664908
Energy: 0.7437121792278075
Energy: 1.0334175176664908
Energy: 0.74371217922359
Energy: 1.033417517667194
Energy: 0.7437121792313222
Energy: 0.7377109228365964
Energy: 1.1944861855503044
Energy: 0.7377109228323789
Energy: 1.1944861855439781
Energy: 0.7377109228295672
Energy: 1.1944861855313256
Energy: 1.2340935487197873
Energy: 1.28917117442533
Energy: 1.2340935487183815
Energy: 1.28917117442533
Energy: 1.2340935487197873
Energy: 1.2891711744246273
Energy: 0.9760973728174651
Energy: 0.7505737082891597
Energy: 0.976097372818168
Energy: 0.7505737082919713
Energy: 0.9760973728174651
Energy: 0.7505737082919713
Energy: 1.0535005297205322
Energy: 0.7572656667631527
Energy: 1.0535005297205322
Energy: 0.7572656667645585
Energy: 1.053500529721938
Energy: 0.7572656667673701
Energy: 1.072628624201095
Energy: 1.3097107278717934
Energy: 1.072628624201095
Energy: 1.3097107278710904
Energy: 1.072628624200392
Energy: 1.3097107278710904
Energy: 1.2583337711132663
Energy: 1.025963844509777
Energy: 1.2583337711125633
Energy: 1.025963844509074
Energy: 1.2583337711132663
Energy: 1.025963844509074
Energy: 0.846350553709203
Energy: 1.0431812298371133
Energy: 0.846350553709203
Energy: 1.0431812298335987
Energy: 0.8463505537099058
Energy: 1.043181229832896
Energy: 0.8750915009481581
Energy: 1.0128907828061318
Energy: 0.8750915009467521
Energy: 1.012890782805429
Energy: 0.875091500948861
Energy: 1.0128907828068345
Energy: 1.3071448136307326
Energy: 0.9901080319082096
Energy: 1.3071448136300299
Energy: 0.9901080318822014
Energy: 1.3071448136307326
Energy: 0.9901080318927452
Energy: 1.1904301266080832
Energy: 0.7573443899549387
Energy: 1.1904301266073805
Energy: 0.7573443899577504
Energy: 1.1904301266073805
Energy: 0.7573443899570474
Energy: 0.9788757082451229
Energy: 0.9156365655518246
Energy: 0.9788757082444202
Energy: 0.9156365655518246
Energy: 0.9788757082444202
Energy: 0.9156365655504186
Energy: 0.7381477885077337
Energy: 1.0767065324828071
Energy: 0.7381477885070308
Energy: 1.0767065324828071
Energy: 0.7381477885098425
Energy: 1.0767065324821041
Energy: 1.0173735952013638
Energy: 1.1754587208398106
Energy: 1.0173735951985523
Energy: 1.1754587208412164
Energy: 1.0173735951985523
Energy: 1.1754587208391076
Energy: 1.063388100420356
Energy: 0.932693021055089
Energy: 1.0633881004210588
Energy: 0.932693021057198
Energy: 1.063388100420356
Energy: 0.932693021057198
Energy: 1.0349597909564556
Energy: 0.8615563006617523
Energy: 1.0349597909557529
Energy: 0.8615563006652669
Energy: 1.0349597909557529
Energy: 0.8615563006645639
Energy: 0.738317005854122
Energy: 1.1924622519111192
Energy: 0.7383170058484986
Energy: 1.1924622519202572
Energy: 0.7383170058506073
Energy: 1.1924622519244747
Energy: 1.336113421320468
Energy: 1.287417641958196
Energy: 1.336113421319062
Energy: 1.2874176419588987
Energy: 1.336113421320468
Energy: 1.2874176419588987

minimum gb energy = 0.7377109228295672 eV
minimum distance =  2.25597646392665 Angstroms
sigma value = 41


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

Energy: 0.9017863274576108
Energy: 0.8170062849480948
Energy: 0.9017863274581648
Energy: 0.8170062849486489
Energy: 0.9017863274576108
Energy: 0.8170062849480948
Energy: 0.8153481254693726
Energy: 0.9960862368623449
Energy: 0.8153481254666025
Energy: 0.996086236864561
Energy: 0.8153481254627245
Energy: 0.996086236864007
Energy: 1.0154319858960799
Energy: 1.481627792522674
Energy: 1.0154319858933096
Energy: 1.4816277925232277
Energy: 1.0154319858938639
Energy: 1.481627792520458
Energy: 0.7965313254430065
Energy: 0.7727699260727245
Energy: 0.7965313250387203
Energy: 0.7727699260738324
Energy: 0.7965313252895923
Energy: 0.7727699260699544
Energy: 0.8003007410478872
Energy: 0.7812122673785802
Energy: 0.8003007410478872
Energy: 0.7812122673802423
Energy: 0.8003007410473333
Energy: 0.7812122673830124
Energy: 1.0734803934988593
Energy: 0.996058351291007
Energy: 1.0734803934994135
Energy: 0.996058351290453
Energy: 1.0734803934949813
Energy: 0.9960583512849127
Energy: 0.7806314235337486
Energy: 1.1263225808927946
Energy: 0.7806314235348567
Energy: 1.1263225808855921
Energy: 0.7806314235304245
Energy: 1.1263225808855921
Energy: 0.7959669459374453
Energy: 0.7729144128615004
Energy: 0.7959669459379993
Energy: 0.7729144128692568
Energy: 0.7959669459363372
Energy: 0.7729144128675947
Energy: 0.7957793276848887
Energy: 0.7742678501867712
Energy: 0.7957793276848887
Energy: 0.7742678501862171
Energy: 0.7957793276843348
Energy: 0.7742678501856632
Energy: 0.7830887919226699
Energy: 1.1510646434325698
Energy: 0.7830887919221159
Energy: 1.151064643435894
Energy: 0.7830887919215619
Energy: 1.1510646434281375
Energy: 0.7861875593010629
Energy: 1.3148593560751363
Energy: 0.7861875593016169
Energy: 1.3148593560762443
Energy: 0.7861875592994009
Energy: 1.3148593560751363
Energy: 0.7824083817475656
Energy: 1.0655788956267216
Energy: 0.7824083817470117
Energy: 1.0655788956256136
Energy: 0.7824083817464575
Energy: 1.0655788956261676
Energy: 0.7997326328144929
Energy: 0.7922660234937547
Energy: 0.7997326328161551
Energy: 0.7922660234937547
Energy: 0.7997326328161551
Energy: 0.7922660234926469
Energy: 0.7776284266067385
Energy: 1.1243961468787878
Energy: 0.7776284266067385
Energy: 1.1243961468987325
Energy: 0.7776284266061846
Energy: 1.1243961468937462
Energy: 1.0729787695716237
Energy: 1.2535017718220567
Energy: 1.07297876957938
Energy: 1.253501771827597
Energy: 1.0729787695832582
Energy: 1.253501771825381
Energy: 0.7924946230808091
Energy: 0.9871055382063848
Energy: 0.7924946230808091
Energy: 0.9871055382052769
Energy: 0.7924946230808091
Energy: 0.9871055382041689
Energy: 0.8019472519610059
Energy: 0.792274493298293
Energy: 0.801947251966546
Energy: 0.792274493299955
Energy: 0.8019472519648839
Energy: 0.792274493298293
Energy: 1.1686393526094343
Energy: 1.48208928847759
Energy: 1.1686393526138665
Energy: 1.482089288475374
Energy: 1.1686393526094343
Energy: 1.482089288477036
Energy: 0.8174128010102016
Energy: 1.1359041103645975
Energy: 0.8174128010118639
Energy: 1.1359041103596113
Energy: 0.8174128010090939
Energy: 1.1359041103634895
Energy: 0.8536274278590266
Energy: 0.9739218597166803
Energy: 0.8536274278590266
Energy: 0.9739218597144642
Energy: 0.8536274278612427
Energy: 0.9739218597072616
Energy: 0.7968783764811898
Energy: 1.1823341696101715
Energy: 0.7968783764867299
Energy: 1.1823341696090632
Energy: 0.7968783764828519
Energy: 1.1823341696096172
Energy: 1.0142514384694696
Energy: 1.4880042488125829
Energy: 1.0142514384661452
Energy: 1.4880042488136909
Energy: 1.0142514384666994
Energy: 1.4880042488125829
Energy: 0.7950132006740476
Energy: 0.7703995308834028
Energy: 0.7950132006712775
Energy: 0.7703995308822947
Energy: 0.7950132006773718
Energy: 0.770399530884511
Energy: 0.7924396571493488
Energy: 0.9822855800011739
Energy: 0.7924396571487949
Energy: 0.9822855800050523
Energy: 0.7924396571476869
Energy: 0.9822855800099881
Energy: 0.7912762736733202
Energy: 1.276701284231719
Energy: 0.7912762736733202
Energy: 1.276701284231719
Energy: 0.7912762736738743
Energy: 1.276701284231719
Energy: 0.7810105479461387
Energy: 1.1451942459169562
Energy: 0.7810105479439227
Energy: 1.1451942459175104
Energy: 0.7810105479444767
Energy: 1.1451942459158484
Energy: 0.7977460942572393
Energy: 0.7700370464780288
Energy: 0.7977460942428348
Energy: 0.7700370464763668
Energy: 0.797746094247267
Energy: 0.7700370464769208
Energy: 0.7967926481668357
Energy: 0.9727820539085499
Energy: 0.7967926481668357
Energy: 0.9727820539091039
Energy: 0.7967926481668357
Energy: 0.9727820539068879
Energy: 0.8001882352814821
Energy: 1.3035811483642314
Energy: 0.8001882352798201
Energy: 1.3035811483642314
Energy: 0.800188235280374
Energy: 1.3035811483636774
Energy: 1.1323901923007074
Energy: 1.1518610144198547
Energy: 1.1323901922990451
Energy: 1.1518610144215167
Energy: 1.1323901923001534
Energy: 1.151861014422625
Energy: 0.7796647057660498
Energy: 1.0594514348092556
Energy: 0.779664705767712
Energy: 1.0594514348136879
Energy: 0.779664705766604
Energy: 1.0594514348125799
Energy: 0.8062278295167586
Energy: 0.8151195887731845
Energy: 0.8062278295184205
Energy: 0.8151195887731845
Energy: 0.8062278295178665
Energy: 0.8151195887737385
Energy: 0.7915272780927124
Energy: 0.980705793342267
Energy: 0.7915272780922088
Energy: 0.9807057933383889
Energy: 0.7915272780922088
Energy: 0.9807057933356187

minimum gb energy = 0.7700370464763668 eV
minimum distance =  2.31561840191529 Angstroms
sigma value = 33


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

Energy: 0.84876275472812
Energy: 0.9116885504336476
Energy: 0.8636220032463291
Energy: 0.9116885504274262
Energy: 0.8487627547215453
Energy: 0.91168855042474
Energy: 0.9097852019610015
Energy: 0.9226051895686331
Energy: 0.9097852019555581
Energy: 0.9226051895697643
Energy: 0.9097852019641122
Energy: 0.9226051895697643
Energy: 0.9233016302820559
Energy: 0.7928177448319782
Energy: 0.9233016302758348
Energy: 0.7928177448292917
Energy: 0.9233016302742794
Energy: 0.7928177448304229
Energy: 0.8762149112832404
Energy: 0.8569404665042609
Energy: 0.8762149112805541
Energy: 0.8569404664945052
Energy: 0.8762149112917944
Energy: 0.8569404664988175
Energy: 0.9064402594913034
Energy: 1.1651438737873234
Energy: 0.906448369819004
Energy: 1.1651438737958777
Energy: 0.9064402595087648
Energy: 1.1651438737919895
Energy: 0.9408079681708224
Energy: 0.8008854521590816
Energy: 0.9408079681692669
Energy: 0.8008854521349748
Energy: 0.9408079681653789
Energy: 0.8008854521353989
Energy: 0.9079565272115173
Energy: 0.8747744407922071
Energy: 0.9079565272076291
Energy: 0.8747744407922071
Energy: 0.9079565272087602
Energy: 0.8747744407956711
Energy: 0.7980456890757598
Energy: 0.845599933412697
Energy: 0.7980456890784461
Energy: 0.8455999334100107
Energy: 0.7980456890843138
Energy: 0.8455999334107884
Energy: 1.0392864199436502
Energy: 0.8763240360679411
Energy: 1.0401592557123303
Energy: 0.876324036065608
Energy: 1.0392864199366514
Energy: 0.8763240360659618
Energy: 0.899857008293638
Energy: 0.9201726950047314
Energy: 0.8998570083033232
Energy: 0.9201726950132147
Energy: 0.899857008301768
Energy: 0.9201726950120837
Energy: 0.8525329666485014
Energy: 0.7924653325120811
Energy: 0.8525329666434822
Energy: 0.7924653325136363
Energy: 0.8525329666528139
Energy: 0.7924653325155452
Energy: 0.9802654700663361
Energy: 0.8557641046402197
Energy: 0.9802654700671138
Energy: 0.8557641045951874
Energy: 0.9802654700748901
Energy: 0.855764104582321
Energy: 0.865889390679904
Energy: 0.9894754255121517
Energy: 0.8658893906833681
Energy: 0.9894754255308152
Energy: 0.8658893906869028
Energy: 0.9894754255277046
Energy: 0.8414211398232316
Energy: 0.8455289999961646
Energy: 0.8414211398221005
Energy: 0.8455290000214734
Energy: 0.8414211398174347
Energy: 0.8455290000210491
Energy: 0.8390540375208639
Energy: 0.8475973791901779
Energy: 0.8390540375461019
Energy: 0.8475973792251009
Energy: 0.8390540375383253
Energy: 0.8475973792181022
Energy: 0.9010213565883484
Energy: 0.8479229644941065
Energy: 0.901021356594923
Energy: 0.8479229644859061
Energy: 0.90102135660581
Energy: 0.847922964476221
Energy: 1.5292306682156398
Energy: 0.8897059087684035
Energy: 1.5292306682304149
Energy: 0.8897059087626065
Energy: 1.5292306682350807
Energy: 0.8897059087804924
Energy: 0.8553632789636457
Energy: 0.9481796943378412
Energy: 0.8551750626833716
Energy: 0.9481796943463953
Energy: 0.8553632789702912
Energy: 0.9481796943471729
Energy: 0.7939233936177407
Energy: 1.012441896085059
Energy: 0.7939233936332935
Energy: 1.012441896089371
Energy: 0.7939233936212047
Energy: 1.0124418960800396
Energy: 1.243424045827855
Energy: 0.8322864676694361
Energy: 1.2434240457582917
Energy: 0.8322864676736779
Energy: 1.2434240455857264
Energy: 0.8322864676741021
Energy: 0.9133006036331992
Energy: 0.8010712373469016
Energy: 0.9133006036339768
Energy: 0.8010712373461237
Energy: 0.9133006036300886
Energy: 0.8010712373542537
Energy: 0.9230096779239633
Energy: 0.8917218792039332
Energy: 0.9225576488897027
Energy: 0.8917218791883804
Energy: 0.9230096779122986
Energy: 0.891721879204711
Energy: 0.8455761967797774
Energy: 0.9162116472740238
Energy: 0.8455761967833122
Energy: 0.9162116472678027
Energy: 0.8455761967918662
Energy: 0.9162116472690046
Energy: 0.8875287324658637
Energy: 0.8792279564077118
Energy: 0.8875287324573097
Energy: 0.8792279564034702
Energy: 0.8875287324592892
Energy: 0.8792279564034702
Energy: 1.0312581524225222
Energy: 0.8935886755881615
Energy: 1.0312581524205426
Energy: 0.8935886753895808
Energy: 1.0312581524003241
Energy: 0.8935886758124043
Energy: 0.8020308622673162
Energy: 0.8391753248285145
Energy: 0.8020308622727597
Energy: 0.8391753248351598
Energy: 0.8020308622867572
Energy: 0.839175324832827
Energy: 0.7908349596404458
Energy: 0.907125579787737
Energy: 0.7908349596497775
Energy: 0.9071255798005329
Energy: 0.7908349596478687
Energy: 0.9071255797896459
Energy: 0.8618970133668595
Energy: 0.8513099962001185
Energy: 0.784856648838305
Energy: 0.8513099962012496
Energy: 0.8618970133793017
Energy: 0.8513099962040067
Energy: 0.9075347854339144
Energy: 1.167800059528162
Energy: 0.9075347854397818
Energy: 1.167800059543644
Energy: 0.9075347854483359
Energy: 1.1678000595464009
Energy: 0.9226906004545459
Energy: 0.7957024511096755
Energy: 0.9226906004514354
Energy: 0.7957024511202091
Energy: 0.9226906004386397
Energy: 0.7957024511026769
Energy: 0.8256544715565224
Energy: 0.8568097079614014
Energy: 0.8256544715487462
Energy: 0.8568097079777317
Energy: 0.825654471559633
Energy: 0.8568097079789336
Energy: 0.8872031923210515
Energy: 1.2941482038762737
Energy: 0.8879287065834549
Energy: 1.2941482038809395
Energy: 0.8872031923074781
Energy: 1.2941482038813636
Energy: 1.101700874044381
Energy: 0.865028584796055
Energy: 1.101700874049471
Energy: 0.8650285848011452
Energy: 1.1017008740513796
Energy: 0.8650285848007209
Energy: 0.8454340568893493
Energy: 0.8392097546449592
Energy: 0.8454340568893493
Energy: 0.8392097546574013
Energy: 0.8454340568827748
Energy: 0.8392097546694193
Energy: 0.7925929133532951
Energy: 0.8389037395811572
Energy: 0.7925929133564056
Energy: 0.8389037395769154
Energy: 0.7925929133525174
Energy: 0.8389037395764912
Energy: 0.9432666981312241
Energy: 0.8959228462733857
Energy: 1.3605528105843
Energy: 0.8959228462644782
Energy: 0.943266698125003
Energy: 0.8959228462640539
Energy: 0.8737477230180642
Energy: 1.1251501192937428
Energy: 0.8737477230095102
Energy: 1.12515011927819
Energy: 0.873747723022306
Energy: 1.1251501192774125
Energy: 0.8807682802056412
Energy: 0.8617931929340966
Energy: 0.8807682802126399
Energy: 0.8617931929267445
Energy: 0.8807682802180127
Energy: 0.8617931929313396
Energy: 0.9830765509885229
Energy: 0.7945012691785692
Energy: 0.9831038350846547
Energy: 0.7945012691886785
Energy: 0.9830765509796153
Energy: 0.7945012691863456
Energy: 0.8293040680602133
Energy: 1.2376699437379464
Energy: 0.8293040680637481
Energy: 1.2376699437142638
Energy: 0.829304068078099
Energy: 1.2376699437154657
Energy: 0.7859606506923504
Energy: 0.8495693569744137
Energy: 0.7859606506912192
Energy: 0.8495693569421772
Energy: 0.7859606506741111
Energy: 0.8495693569452877
Energy: 0.8704983620410749
Energy: 0.8506894844833934
Energy: 0.8704983620515377
Energy: 0.8506894844651542
Energy: 0.8704983620616469
Energy: 0.850689484463599
Energy: 0.8731973608821167
Energy: 0.841711416912658
Energy: 0.8731973608864291
Energy: 0.8417114169146374
Energy: 0.873197360888762
Energy: 0.8417114169076387
Energy: 0.9488357743942267
Energy: 0.8952399067605531
Energy: 0.9488357744008014
Energy: 0.8952399067625324
Energy: 0.9488357743848951
Energy: 0.8952399067621083
Energy: 0.874453838311419
Energy: 0.9358658707654959
Energy: 0.874482000174166
Energy: 0.9358658707487413
Energy: 0.8744538383265474
Energy: 0.9358658707491656
Energy: 0.839574889146811
Energy: 0.9115246959069396
Energy: 0.8395748891499214
Energy: 0.9115246958999409
Energy: 0.8395748891402363
Energy: 0.9115246959014961
Energy: 0.9231857896781613
Energy: 0.7841501957591879
Energy: 0.923185789678515
Energy: 0.7841501957588344
Energy: 0.9231857896769596
Energy: 0.7841501957576327

minimum gb energy = 0.7841501957576327 eV
minimum distance =  2.3180395065415 Angstroms
sigma value = 67


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

Energy: 0.8909035279597697
Energy: 0.9369704433780172
Energy: 0.8909035279592381
Energy: 0.9369704433780172
Energy: 0.8909035279582044
Energy: 0.9369704433785486
Energy: 0.8937159331804483
Energy: 0.9171929069244417
Energy: 0.8937159331804483
Energy: 0.9171929069244417
Energy: 0.8937159331802121
Energy: 0.9171929069241759
Energy: 0.9614504252348188
Energy: 0.9632542281139556
Energy: 1.2649945013948671
Energy: 0.9632542281139556
Energy: 0.9808679029069376
Energy: 0.9632542281144577
Energy: 0.8937501136141874
Energy: 0.917131903218792
Energy: 0.8937501136165205
Energy: 0.917131903218792
Energy: 0.8937501136159889
Energy: 0.9171319032190579
Energy: 0.8909035279600352
Energy: 0.93697044337595
Energy: 0.8909035279584703
Energy: 0.9369704433754186
Energy: 0.8909035279595037
Energy: 0.9369704433762159
Energy: 0.8937159331854094
Energy: 0.9171929069291072
Energy: 0.8937159331851436
Energy: 0.9171929069288415
Energy: 0.8937159331846121
Energy: 0.9171929069291072
Energy: 0.9611538946090812
Energy: 0.9632542281100577
Energy: 0.9611538946090812
Energy: 0.9632542281103235
Energy: 1.2532995285337507
Energy: 0.963254228111859

minimum gb energy = 0.8909035279582044 eV
minimum distance =  2.3249882487041 Angstroms
sigma value = 3


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

Energy: 1.1756458781777297
Energy: 1.1143984384529304
Energy: 1.1756458781777297
Energy: 1.1143984384529304
Energy: 1.1756458781777297
Energy: 1.1143984384529304
Energy: 1.0065413976703037
Energy: 0.9706952910760824
Energy: 1.006541398009655
Energy: 0.970695291083155
Energy: 1.0065413978718056
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Energy: 1.1270531115907096
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Energy: 1.1270531115907096
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Energy: 1.0005502783460702
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Energy: 1.0005502790282448
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Energy: 1.0861631623907575
Energy: 1.1777499484661562
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Energy: 1.118748103530795
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Energy: 1.1773857163330599
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Energy: 0.983088745917227
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Energy: 1.153682176827054
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Energy: 1.0340912227219203
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Energy: 1.1031199062298687
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Energy: 1.163315477012916
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Energy: 0.9893743394882464
Energy: 1.0116386739760912
Energy: 1.0678565346415267
Energy: 1.1424390450687831
Energy: 1.0678565346485993
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Energy: 1.160213508916812
Energy: 1.075614284719442
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Energy: 1.0756142847229784
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Energy: 1.075614284719442
Energy: 1.0243954503569548
Energy: 0.9878113099266709
Energy: 1.02439545247774
Energy: 0.9878113099443521
Energy: 1.024395451014376
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Energy: 1.1903339380892088
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Energy: 1.1569836853962028
Energy: 1.1115546763961697
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Energy: 1.1115546763961697
Energy: 1.1569836853962028
Energy: 1.1115546763961697
Energy: 1.0239193213211033
Energy: 1.1114372167867514
Energy: 1.0239192847124368
Energy: 1.1114372167761428
Energy: 1.0239193333531593
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Energy: 0.9980801597640245
Energy: 1.0084632503709023
Energy: 0.998080159760488
Energy: 1.0084632503638298
Energy: 0.9980801597675606
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Energy: 1.134795910547969
Energy: 1.1598095489788853
Energy: 1.134795910547969
Energy: 1.1598095489788853
Energy: 1.134795910544433
Energy: 1.1598095489824214
Energy: 1.1090164677854364
Energy: 1.1461061444044862
Energy: 1.1090164677854364
Energy: 1.1461061444044862
Energy: 1.1090164677819
Energy: 1.1461061444080223
Energy: 1.0378068758378027
Energy: 1.1146751623058182
Energy: 1.037806875827194
Energy: 1.1146751623093543
Energy: 1.037806875827194
Energy: 1.1146751623093543
Energy: 0.9767124040622962
Energy: 1.1040691988945674
Energy: 0.9767124040622962
Energy: 1.104069198887495
Energy: 0.9767124040622962
Energy: 1.1040691988945674
Energy: 1.1291838079851508
Energy: 1.159558113458632
Energy: 1.1291838079922232
Energy: 1.159558113458632
Energy: 1.1291838079886871
Energy: 1.159558113458632
Energy: 1.0883229126397438
Energy: 1.1335080138871068
Energy: 1.0883229126397438
Energy: 1.1335080138941793
Energy: 1.0883229126397438
Energy: 1.1335080138871068
Energy: 1.1951890359892157
Energy: 1.037569546946971
Energy: 1.1951890359998245
Energy: 1.037569546946971
Energy: 1.1951890359927522
Energy: 1.037569546946971
Energy: 1.0420110545977994
Energy: 1.0001223164939348
Energy: 1.0420110545977994
Energy: 1.0001223160096615
Energy: 1.0420110546013355
Energy: 1.0001223165752042
Energy: 1.1568198121449758
Energy: 1.0794085438459922
Energy: 1.1568198121449758
Energy: 1.0794085438459922
Energy: 1.1568198121449758
Energy: 1.0794085438459922
Energy: 1.1197570015836196
Energy: 1.08677205146957
Energy: 1.1197569980701954
Energy: 1.08677205146957
Energy: 1.119756996709318
Energy: 1.0867720514766428
Energy: 1.1033951131235757
Energy: 0.973717865179226
Energy: 1.1033951131518014
Energy: 0.973717865179226
Energy: 1.1033951131377204
Energy: 0.9737178651827622
Energy: 1.1219304162701322
Energy: 0.9995466589106309
Energy: 1.1219304162701322
Energy: 0.9995466587657089
Energy: 1.1219304162772046
Energy: 0.999546658723274
Energy: 1.1557606361375217
Energy: 1.1281877804398452
Energy: 1.1557606361375217
Energy: 1.1281877804398452
Energy: 1.1557606361375217
Energy: 1.1281877804398452
Energy: 1.0883674760412314
Energy: 1.1397432391518785
Energy: 1.0883674760412314
Energy: 1.139743239158951
Energy: 1.0883674760412314
Energy: 1.1397432391518785
Energy: 1.0069153312308747
Energy: 1.0085551611261596
Energy: 1.0069153312238022
Energy: 1.0085551611402404
Energy: 1.0069153312414836
Energy: 1.0085551611261596
Energy: 1.1240264701586116
Energy: 1.000363286769155
Energy: 1.1240264701586116
Energy: 1.00036328681159
Energy: 1.1240264701586116
Energy: 1.000363286769155

minimum gb energy = 0.9561074046531302 eV
minimum distance =  2.2918434335487 Angstroms
sigma value = 81


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

Energy: 1.149507398165531
Energy: 1.0636525885713453
Energy: 1.1312344583015486
Energy: 1.0636525885810524
Energy: 1.1495073981757233
Energy: 1.0636525885781405
Energy: 1.1203542724077185
Energy: 1.078014101968815
Energy: 1.120354272406748
Energy: 1.0780141019664324
Energy: 1.1203542724043212
Energy: 1.07801410197561
Energy: 0.9853264947742848
Energy: 0.8711728393846495
Energy: 0.985500922746513
Energy: 0.8711728393817374
Energy: 0.9853264947728287
Energy: 0.8711728393836787
Energy: 0.900122443033085
Energy: 1.0545456654225729
Energy: 0.9001224430296876
Energy: 1.0545456654177636
Energy: 0.9001224430369676
Energy: 1.0545456654230585
Energy: 1.193194046025298
Energy: 1.0870081743196085
Energy: 1.1931940460447117
Energy: 1.0870081743108722
Energy: 1.1931940460354902
Energy: 1.087008174313784
Energy: 0.9543323475918376
Energy: 0.9373106250014538
Energy: 0.954332347593779
Energy: 0.9373106250043659
Energy: 0.9543323475913523
Energy: 0.9373106250063071
Energy: 0.9752547763925651
Energy: 0.9379837537087549
Energy: 0.9752547763920796
Energy: 0.9379837537126376
Energy: 0.9752547763930504
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Energy: 1.0707810456731446
Energy: 1.118694811302911
Energy: 1.070473886949458
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Energy: 1.0707810455402043
Energy: 1.118694811182104
Energy: 1.1372232126590553
Energy: 1.1670223190847493
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Energy: 1.1670223190735864
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Energy: 1.1954012069778903
Energy: 0.9452740708632487
Energy: 1.1954012069783757
Energy: 0.9452740708632487
Energy: 1.0132558439220827
Energy: 1.002501799316868
Energy: 1.0132558439249946
Energy: 1.002501799316868
Energy: 1.0132558439279067
Energy: 1.002501799318324
Energy: 0.8706044067119743
Energy: 1.0088233483021753
Energy: 0.8706044067134303
Energy: 1.0088233483012048
Energy: 0.8706044067134303
Energy: 1.0088233482992632
Energy: 1.1710563213744407
Energy: 1.2043863347585875
Energy: 1.1710563213773526
Energy: 1.2043863347488808
Energy: 1.1710563213749259
Energy: 1.2043863347590729
Energy: 1.0822658432055279
Energy: 0.871558730847565
Energy: 1.082265843204557
Energy: 0.8715587308446531
Energy: 1.082265843200189
Energy: 0.8715587308451382
Energy: 0.871101255927347
Energy: 1.075845284581431
Energy: 0.8711012559312299
Energy: 1.0758452845833724
Energy: 0.8711012559409367
Energy: 1.075845284582887
Energy: 1.075650999998423
Energy: 0.9636657003773841
Energy: 1.0756510000032764
Energy: 0.9636657003754427
Energy: 1.0756510000032764
Energy: 0.9636657003764135
Energy: 1.0519445032904517
Energy: 1.1048833833302154
Energy: 1.0818510612936971
Energy: 1.1048833833355542
Energy: 1.0519445029688437
Energy: 1.1048833833370102
Energy: 1.040044671229999
Energy: 1.0386725229360874
Energy: 1.042991147517757
Energy: 1.0386725229302631
Energy: 1.0400446712309697
Energy: 1.0386725229346312
Energy: 0.8719464974972234
Energy: 1.0826224519558418
Energy: 0.8719464974923701
Energy: 1.082622451951959
Energy: 0.8719464974991649
Energy: 1.0826224519514736
Energy: 1.0654487879155639
Energy: 1.0375230905682544
Energy: 1.0654487878738241
Energy: 1.0375230905697104
Energy: 1.0654487878646026
Energy: 1.037523090569225
Energy: 1.1126054650609227
Energy: 1.1901507860339922
Energy: 1.1126054650609227
Energy: 1.1901507860247704
Energy: 1.112605465070144
Energy: 1.1901507860286533
Energy: 0.9940905468651068
Energy: 1.004515265645987
Energy: 0.9287329405564109
Energy: 1.0045152656513259
Energy: 0.9940905468670482
Energy: 1.004515265651811
Energy: 0.9954061097987695
Energy: 0.9004614370010778
Energy: 0.9423437399974312
Energy: 0.9004614370020486
Energy: 0.995406109793916
Energy: 0.9004614370064167
Energy: 1.160185994517909
Energy: 1.201337355715095
Energy: 1.1601859945154822
Energy: 1.2013373557083
Energy: 1.160185994523733
Energy: 1.2013373557073295
Energy: 1.0807999561749653
Energy: 1.0784135847148988
Energy: 1.0807999561778772
Energy: 1.0784135847231495
Energy: 1.080799956188555
Energy: 1.078413584729459
Energy: 0.8708773821449539
Energy: 1.0040538094157287
Energy: 0.8708773821391297
Energy: 1.0040538094128166
Energy: 0.8708773821449539
Energy: 1.0040538094108753
Energy: 1.0395171597604178
Energy: 0.9258206633975125
Energy: 1.0395171597613886
Energy: 0.9258206633892616
Energy: 1.03951715976333
Energy: 0.9258206633839227
Energy: 1.0144930790564168
Energy: 1.1053163057562572
Energy: 1.0144930790462245
Energy: 1.1053163057679054
Energy: 1.0144930790501074
Energy: 1.1053163057679054
Energy: 1.0719823615320179
Energy: 1.1715081428383496
Energy: 1.0757319586638483
Energy: 1.1715081428325256
Energy: 1.0719823608115886
Energy: 1.1715081428334961
Energy: 0.872059824040902
Energy: 0.9801798706816097
Energy: 0.8720598240404168
Energy: 0.9801798706835512
Energy: 0.8720598240331365
Energy: 0.9801798706840364
Energy: 1.0544364398768953
Energy: 0.871322572206287
Energy: 1.0544364398802928
Energy: 0.8713225722053163
Energy: 1.05443643987641
Energy: 0.8713225722087136
Energy: 1.1102883329066127
Energy: 1.0759960158900905
Energy: 1.1102883329051567
Energy: 1.0759959565101227
Energy: 1.1102883329109807
Energy: 1.075995895595757
Energy: 0.8707052007625578
Energy: 1.0404618641177954
Energy: 0.8707052007557629
Energy: 1.0404618641182808
Energy: 0.8707052007625578
Energy: 1.0404618641177954
Energy: 0.871015150451814
Energy: 0.978089988986302
Energy: 0.8710151504489022
Energy: 0.9780899889877581
Energy: 0.8710151504489022
Energy: 0.9780899889877581
Energy: 1.1096913094639507
Energy: 0.9457091558322999
Energy: 1.1114400412028491
Energy: 0.9457091558341969
Energy: 1.1096913094673482
Energy: 0.9457091558337116
Energy: 1.0371769706697709
Energy: 1.1483016888690125
Energy: 1.0371769711466448
Energy: 1.148301688873866
Energy: 1.037176970491737
Energy: 1.1483016888792048
Energy: 1.076088811811911
Energy: 1.1034479751352064
Energy: 1.0760888118099696
Energy: 1.1034479751429718
Energy: 1.0760888117958947
Energy: 1.1034479751444277
Energy: 1.0186591310225468
Energy: 0.9373058209324358
Energy: 1.0186591310269149
Energy: 0.9373058209421427
Energy: 1.0186591310264295
Energy: 0.9373058209397158

minimum gb energy = 0.8706044067119743 eV
minimum distance =  2.29505589612459 Angstroms
sigma value = 43


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

Energy: 1.2279001385185877
Energy: 1.1806914309077694
Energy: 1.227900138520376
Energy: 1.1806914309077694
Energy: 1.2279001385245492
Energy: 1.1806914309077694
Energy: 1.0822950872789159
Energy: 0.9773024191234319
Energy: 1.0822950874314787
Energy: 0.9773024191174702
Energy: 1.08229508737189
Energy: 0.9773024191174702
Energy: 1.1004091307802697
Energy: 1.1808735675856608
Energy: 1.1004091307832504
Energy: 1.1808735675856608
Energy: 1.1004091307808659
Energy: 1.180873567586257
Energy: 1.019441709718062
Energy: 1.0568558413945102
Energy: 1.0194417097210426
Energy: 1.0568558413915563
Energy: 1.019441709708523
Energy: 1.0568558413992795
Energy: 1.1464845102345542
Energy: 1.1968905891467754
Energy: 1.1464845102345542
Energy: 1.1968905891479675
Energy: 1.1464845102345542
Energy: 1.1968905891473716
Energy: 1.1178776245798423
Energy: 1.0583398607859196
Energy: 1.117877624579246
Energy: 1.0583398607793617
Energy: 1.1178776245768614
Energy: 1.058339860776977
Energy: 1.0915253945274406
Energy: 1.129957014419301
Energy: 1.091525394528633
Energy: 1.1299570144240703
Energy: 1.0915253945268444
Energy: 1.1299570144169162
Energy: 1.0071865044816497
Energy: 1.1429674014074758
Energy: 1.0071867775650585
Energy: 1.1429674014038989
Energy: 1.0071871659971385
Energy: 1.1429674014033024
Energy: 1.2266333732420593
Energy: 1.1341585876679519
Energy: 1.2266333732420593
Energy: 1.1341585876679519
Energy: 1.2266333732426555
Energy: 1.1341585876679519
Energy: 1.0518122249833077
Energy: 1.058462117592288
Energy: 1.051812224985096
Energy: 1.05846211758573
Energy: 1.051812224985096
Energy: 1.0584621175869222
Energy: 1.0899537128460979
Energy: 1.0337792109522572
Energy: 1.0899537128484824
Energy: 1.0337792109510648
Energy: 1.0899537128455015
Energy: 1.0337792109534494
Energy: 1.0073387327115497
Energy: 1.1544176624234819
Energy: 1.0073405946596856
Energy: 1.1544176624222897
Energy: 1.0073403315313114
Energy: 1.154417662422886
Energy: 1.1500744101983162
Energy: 1.010973551461171
Energy: 1.1500744102048739
Energy: 1.0113709111872295
Energy: 1.1500744102024896
Energy: 0.9828776540878252
Energy: 0.9643055900831702
Energy: 1.1187786772516013
Energy: 0.9643055900807855
Energy: 1.1187786772516013
Energy: 0.9643055900831702
Energy: 1.1187786772527937
Energy: 1.0862036435544338
Energy: 1.1212250345403763
Energy: 1.0862036435586067
Energy: 1.1212250345397798
Energy: 1.0862036435615874
Energy: 1.1212250345380188
Energy: 1.0794765026890505
Energy: 0.9994314516136831
Energy: 1.0794765027003776
Energy: 1.000008534157782
Energy: 1.079476502694416
Energy: 0.9990195913879285
Energy: 1.168612252117651
Energy: 1.1197247573193845
Energy: 1.1686122521164588
Energy: 1.1197247573187883
Energy: 1.1686122521128819
Energy: 1.1197247573187883
Energy: 1.1374435386498625
Energy: 1.0065278910811897
Energy: 1.137443538651651
Energy: 1.0065278910811897
Energy: 1.1374435386510549
Energy: 1.0065278910835742
Energy: 1.133929196346704
Energy: 1.0403587265248202
Energy: 1.1339291963478964
Energy: 1.0403587265283971
Energy: 1.1339291963443194
Energy: 1.0403587265283971
Energy: 1.2202557606032658
Energy: 1.1201843366083146
Energy: 1.2202557606032658
Energy: 1.1201843366095068
Energy: 1.2202557606032658
Energy: 1.1201843366089108
Energy: 1.07924831793174
Energy: 1.1892873323451922
Energy: 1.0792483179281631
Energy: 1.1892873323445958
Energy: 1.0792483179341246
Energy: 1.1892873323445958
Energy: 1.1083718156957845
Energy: 1.063280751469226
Energy: 1.108371815696977
Energy: 1.063280751469226
Energy: 1.1083718156963809
Energy: 1.0632807514680336
Energy: 0.9647748772000796
Energy: 1.0743223498147798
Energy: 0.9647748772000796
Energy: 1.0743223498213375
Energy: 0.9647748772024641
Energy: 1.0743223498165684
Energy: 1.1553914605261133
Energy: 1.2008798649427246
Energy: 1.1553914605302862
Energy: 1.2008798649421282
Energy: 1.1553914605279016
Energy: 1.2008798649433206
Energy: 1.0079476881161256
Energy: 1.0656202684190292
Energy: 1.0079476882281497
Energy: 1.0656202684202214
Energy: 1.0079476883115848
Energy: 1.0656202684166445
Energy: 1.1358879337136412
Energy: 1.1034094875898497
Energy: 1.1358879337148335
Energy: 1.1034094875898497
Energy: 1.135887933716026
Energy: 1.1034094875892533
Energy: 1.0516144388058968
Energy: 0.9771505812426189
Energy: 1.051614438806493
Energy: 0.9771505812420226
Energy: 1.0516144388082815
Energy: 0.9771505812396379
Energy: 1.2080125171445306
Energy: 1.1362772758604192
Energy: 1.208012517149896
Energy: 1.1362772758610156
Energy: 1.2080125171522809
Energy: 1.1362772758616118
Energy: 1.0072551952656459
Energy: 1.144298396943149
Energy: 1.0072551951446798
Energy: 1.144298396943149
Energy: 1.0072551922670958
Energy: 1.144298396942553
Energy: 1.0581920419143949
Energy: 1.0905531839460354
Energy: 1.0581920419143949
Energy: 1.0905531839466316
Energy: 1.0581920419149913
Energy: 1.0905531839472276
Energy: 1.1187108022447376
Energy: 1.0340073730657517
Energy: 1.1187108022459298
Energy: 1.0340049392236152
Energy: 1.1187108022483145
Energy: 1.0340014430500373

minimum gb energy = 0.9643055900807855 eV
minimum distance =  2.30864349794679 Angstroms
sigma value = 57


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

Energy: 1.2185668120342759
Energy: 1.1272472681844157
Energy: 1.2071512630687082
Energy: 1.1272472681836436
Energy: 1.2185668120358197
Energy: 1.1272472681836436
Energy: 1.0401850911805335
Energy: 0.9501985148320585
Energy: 1.0401850911813053
Energy: 0.9501985148305148
Energy: 1.0401850911774457
Energy: 0.9501985148312868
Energy: 1.1278214389470487
Energy: 1.0797682210921802
Energy: 1.149536993062692
Energy: 1.0797682210883555
Energy: 1.1278214389455048
Energy: 1.079768221090636
Energy: 0.9654873443100073
Energy: 1.0923396560996141
Energy: 0.9654873443107791
Energy: 1.092339656145928
Energy: 0.9654873443138666
Energy: 1.0923396561019298
Energy: 1.3459905754864179
Energy: 1.1575860658475432
Energy: 1.3459905754817865
Energy: 1.157586065902348
Energy: 1.3459905754841022
Energy: 1.1575860658984884
Energy: 0.9962369966194611
Energy: 0.9509420325194623
Energy: 0.9962369966225487
Energy: 0.9509420325264093
Energy: 0.9962369966256363
Energy: 0.9509420325233217
Energy: 1.0649765833418237
Energy: 1.02676336812699
Energy: 1.0649765833364204
Energy: 1.0267633681239023
Energy: 1.0649765833341047
Energy: 1.0267633681239023
Energy: 0.9587154467627012
Energy: 1.0389365640769728
Energy: 0.9587154467611574
Energy: 1.0389365640777446
Energy: 0.9587154467596137
Energy: 1.038936564075429
Energy: 1.2309597330171067
Energy: 1.0813248425296342
Energy: 1.230959733014791
Energy: 1.0813248453111048
Energy: 1.230959733014791
Energy: 1.0813248445179429
Energy: 0.9717289086451164
Energy: 0.9823185231995327
Energy: 0.9766589721552159
Energy: 0.9823185232010766
Energy: 0.9717289086412567
Energy: 0.9823185232018485
Energy: 1.0271729713386555
Energy: 1.099098606660698
Energy: 1.0271729713386555
Energy: 1.09909860666147
Energy: 1.0271729713386555
Energy: 1.0990986066653294
Energy: 1.0563789369755987
Energy: 0.935456876977237
Energy: 1.056378936972511
Energy: 0.9354568769741496
Energy: 1.0563789369701952
Energy: 0.9354568769826405
Energy: 1.1549779390005719
Energy: 1.15807371008888
Energy: 1.154977938999028
Energy: 1.1580737100857925
Energy: 1.1549779390013437
Energy: 1.1580737100850205
Energy: 1.0750906978311792
Energy: 0.9609954326994287
Energy: 1.029317877474563
Energy: 0.9609954326955689
Energy: 1.075090697832723
Energy: 0.960995432696341
Energy: 1.0814384474755545
Energy: 1.0257155522433792
Energy: 1.0168577192383672
Energy: 1.0257155522202572
Energy: 1.081438447479414
Energy: 1.0257155522387829
Energy: 1.1527378503244856
Energy: 1.1574370495058934
Energy: 1.1527378503206258
Energy: 1.1574370495136126
Energy: 1.152737850328345
Energy: 1.1574370495120687
Energy: 0.9748452320064782
Energy: 1.0357597477255724
Energy: 0.9680606574539158
Energy: 1.0357597477278881
Energy: 0.9748452320003032
Energy: 1.0357597477263445
Energy: 1.0461627264257465
Energy: 0.9269185166341327
Energy: 1.046162726426518
Energy: 0.9269185166310451
Energy: 1.0461627264249744
Energy: 0.9269185166302734
Energy: 0.9669500139467485
Energy: 1.0370352726606484
Energy: 0.966950013942889
Energy: 1.0370352726675953
Energy: 0.9669500139475204
Energy: 1.0370352726598764
Energy: 0.9467369947881161
Energy: 1.1573196864512978
Energy: 0.9467369904156899
Energy: 1.157319686448982
Energy: 0.9467369951823816
Energy: 1.1573196864482103
Energy: 1.017732689643377
Energy: 1.0408064414725797
Energy: 1.0177326896495522
Energy: 1.0408064414748954
Energy: 1.0177326896472367
Energy: 1.0408064414741236
Energy: 1.027676045985275
Energy: 1.0188647074265167
Energy: 1.0276760459845031
Energy: 1.0188647074334638
Energy: 1.0276760459829593
Energy: 1.0188647074296042
Energy: 1.125027907030106
Energy: 1.0842572874347294
Energy: 1.1159256847068528
Energy: 1.0842572874393606
Energy: 1.1250279070247025
Energy: 1.0842572873714686
Energy: 1.1475080955669037
Energy: 1.127401695145896
Energy: 1.0431659283145431
Energy: 1.1274016951366332
Energy: 1.1475080955638162
Energy: 1.1274016951358614

minimum gb energy = 0.9269185166302734 eV
minimum distance =  2.20603864206999 Angstroms
sigma value = 17


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

Energy: 1.1061181123636108
Energy: 0.9664111856788593
Energy: 1.1061181123679773
Energy: 0.9664111856777676
Energy: 1.106118112365794
Energy: 0.9664111856744929
Energy: 1.0544901135061384
Energy: 1.0115727102435361
Energy: 1.05449011350723
Energy: 1.011572710246811
Energy: 1.0544901135061384
Energy: 1.0115727102446277
Energy: 1.0821394560350333
Energy: 1.0672170622804666
Energy: 1.0821394560350333
Energy: 1.0672170622793749
Energy: 1.0821394560350333
Energy: 1.0672170622793749
Energy: 1.1633477124718572
Energy: 1.0999275247797928
Energy: 1.1633477124718572
Energy: 1.0999275247787013
Energy: 1.1633477124718572
Energy: 1.0999275247776097
Energy: 1.1816073149932418
Energy: 1.1182063042912513
Energy: 1.1816073149965167
Energy: 1.1182063042912513
Energy: 1.181607314995425
Energy: 1.1182063042879764
Energy: 0.9882302461550497
Energy: 1.0129757300422002
Energy: 0.9882302461561413
Energy: 1.0129757300454751
Energy: 0.9882302461550497
Energy: 1.0129757300389253
Energy: 1.0087126084980222
Energy: 0.9236460022362618
Energy: 1.0087126085002056
Energy: 0.9236460022351701
Energy: 1.0087126084980222
Energy: 0.9236460022373534
Energy: 1.1638379372269565
Energy: 1.2155098842365193
Energy: 1.1638379372269565
Energy: 1.2155098842365193
Energy: 1.1638379372269565
Energy: 1.2155098842354275
Energy: 1.051031420187617
Energy: 1.0097938836841522
Energy: 1.051031420187617
Energy: 1.0097938836852438
Energy: 1.051031420186575
Energy: 1.0097938836830604
Energy: 1.0105098780750927
Energy: 1.008169717322208
Energy: 1.0105098780750927
Energy: 1.008169717322208
Energy: 1.0105098780750927
Energy: 1.008169717322208
Energy: 1.0092689969173656
Energy: 1.047429881002436
Energy: 1.009268996916274
Energy: 1.047429881002436
Energy: 1.0092689969151825
Energy: 1.047429881002436
Energy: 1.1840680716008702
Energy: 1.0099485033972602
Energy: 1.1840680716019618
Energy: 1.0099485033972602
Energy: 1.1840680716008702
Energy: 1.0099485033907105
Energy: 0.8693794490526399
Energy: 1.1391706794269119
Energy: 0.8693794490515483
Energy: 1.1391706794247285
Energy: 0.8693794490526399
Energy: 1.13917067942582
Energy: 0.9748752137498867
Energy: 1.060078642459137
Energy: 0.9748752137531617
Energy: 1.060078642459137
Energy: 0.9748752137509784
Energy: 1.060078642459137
Energy: 0.9873710928905801
Energy: 1.16796769872426
Energy: 0.9873710928873054
Energy: 1.16796769872426
Energy: 0.9873710928927635
Energy: 1.16796769872426
Energy: 0.9872348731795327
Energy: 1.0103644298802743
Energy: 0.9872348731817161
Energy: 1.0103644298769994
Energy: 0.9872348731838991
Energy: 1.0103644298824577
Energy: 1.0100303757327838
Energy: 1.06049243623088
Energy: 1.0100303757327838
Energy: 1.0604924362319716
Energy: 1.0100303757327838
Energy: 1.06049243623088

minimum gb energy = 0.8693794490515483 eV
minimum distance =  2.28481222519092 Angstroms
sigma value = 17


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

Energy: 0.8656926802194034
Energy: 0.8857023432791609
Energy: 0.9042476246259998
Energy: 0.8857023432766316
Energy: 0.8656926802118156
Energy: 0.8857023432749453
Energy: 0.9087032118060536
Energy: 0.9049896091774527
Energy: 0.8881991075621499
Energy: 0.904989609184619
Energy: 0.9087032118081613
Energy: 0.9049896091850405
Energy: 0.9940575239153522
Energy: 0.9402478421854613
Energy: 0.9959327594163733
Energy: 0.9402478421749225
Energy: 0.9940575239111368
Energy: 0.9402478421719715
Energy: 0.8942213690152424
Energy: 0.9007399603664914
Energy: 0.8937657782483988
Energy: 0.9334678829812817
Energy: 0.8942213690135562
Energy: 0.9007399603614328
Energy: 0.9980827483832002
Energy: 0.9474764047285499
Energy: 0.9980827483983761
Energy: 0.9474764047192757
Energy: 0.9980827483979544
Energy: 0.947476404720962
Energy: 0.9339211054228431
Energy: 0.871217531204732
Energy: 0.9345657400483584
Energy: 0.8712175312093692
Energy: 0.9339211054333818
Energy: 0.8712175312110554
Energy: 0.892075965111033
Energy: 0.9139641740489162
Energy: 0.8920759651047099
Energy: 0.913964174042593
Energy: 0.8920759651021806
Energy: 0.913964174037956
Energy: 1.0374255537357533
Energy: 1.1067606771132477
Energy: 1.0374255537357533
Energy: 1.1067606771019043
Energy: 1.0374255537458703
Energy: 1.1067606770985319
Energy: 0.9095818205797679
Energy: 0.9017430208328241
Energy: 0.9095818205801893
Energy: 0.9017430208290301
Energy: 0.9095818205759737
Energy: 0.9017430208298732
Energy: 0.9271212932351319
Energy: 0.8013363316613833
Energy: 0.9271212932359749
Energy: 0.8013363316613833
Energy: 0.9271212932494647
Energy: 0.8013363316634909
Energy: 0.977964767368283
Energy: 1.065440950867649
Energy: 0.9779647691076704
Energy: 1.0654409508655414
Energy: 0.9779647670004625
Energy: 1.0654409508663845
Energy: 0.9730884932026298
Energy: 0.9884513207248098
Energy: 0.973088493195885
Energy: 0.9884513207968564
Energy: 0.9730884931988357
Energy: 0.9884513207248098
Energy: 0.9335464153021424
Energy: 0.9242548172330903
Energy: 0.9335464152903389
Energy: 0.9242548172385704
Energy: 0.9335464152894959
Energy: 0.9242548172373058
Energy: 0.9034680526626342
Energy: 0.9530185883222408
Energy: 0.9034680526588401
Energy: 0.9530185883340442
Energy: 0.9034680524932481
Energy: 0.9530185883509061
Energy: 0.9468579282627225
Energy: 0.935918960145602
Energy: 0.9450281474932665
Energy: 0.9359189601194661
Energy: 0.9468579282631441
Energy: 0.9359189601249461
Energy: 0.8706322966192159
Energy: 0.9800714713157224
Energy: 0.8643118090217832
Energy: 0.9800714713136147
Energy: 0.8706322966175298
Energy: 0.9800714713123501
Energy: 0.8498549461269059
Energy: 0.9691105382894664
Energy: 0.8498549461310831
Energy: 0.9691105382818784
Energy: 0.849854946122269
Energy: 0.9691105382823
Energy: 0.9594379124821123
Energy: 1.1064051764727643
Energy: 0.9594379124770538
Energy: 1.1064051764727643
Energy: 0.9594379124753676
Energy: 1.1064051764748721
Energy: 0.8670847895411274
Energy: 0.9992159411979573
Energy: 0.867084789553774
Energy: 0.9992159412228288
Energy: 0.8670847895546171
Energy: 0.9992159412202994
Energy: 0.8598062968072956
Energy: 0.8380422471715052
Energy: 0.8598062968102463
Energy: 0.9172833186555321
Energy: 0.8598062968119327
Energy: 0.9172833186538459
Energy: 0.8928153433125354
Energy: 0.9989579781290402
Energy: 0.8928153433062122
Energy: 0.9989579781176583
Energy: 0.8928153433062122
Energy: 0.9989579781172367
Energy: 0.9112596858929771
Energy: 1.1064675422949575
Energy: 0.9112596859039375
Energy: 1.106467542290742
Energy: 0.9112596858955064
Energy: 1.1064675422966437
Energy: 0.8667490557534211
Energy: 0.9388819761772208
Energy: 0.8667490554875388
Energy: 0.9388819761645745
Energy: 0.8667490555781334
Energy: 0.9388819761671036
Energy: 0.805436062698542
Energy: 1.0364750617819534
Energy: 0.8054360641994477
Energy: 1.036475061839667
Energy: 0.8054360530177483
Energy: 1.0364750618072462
Energy: 0.9535848904834927
Energy: 0.940493109244787
Energy: 0.9535848904700416
Energy: 0.940493109231719
Energy: 0.9535848904713061
Energy: 0.9404931092397285
Energy: 0.9129784118072339
Energy: 0.9754368738878039
Energy: 0.9033170657322389
Energy: 0.9754368738911763
Energy: 0.9129784117453046
Energy: 0.97543687388949
Energy: 0.9380746103059742
Energy: 0.9234319108822865
Energy: 0.9207230587659309
Energy: 0.9234319108953161
Energy: 0.9380746103295425
Energy: 0.9234319108948945
Energy: 0.9787864167520782
Energy: 0.9869507066969005
Energy: 0.9547130748331913
Energy: 0.9869507066960574
Energy: 0.9787864167508137
Energy: 0.9869507066926851
Energy: 0.987041409220914
Energy: 1.010421609745952
Energy: 0.9121270331698474
Energy: 1.010421609762354
Energy: 0.9870414092217571
Energy: 1.0104216097606677
Energy: 0.927059080910808
Energy: 0.7969103867944477
Energy: 0.9270590809120728
Energy: 0.796910386796977
Energy: 0.9270590809158666
Energy: 0.7969103867982416
Energy: 0.926272603379972
Energy: 0.8912336429612964
Energy: 0.9262726033825012
Energy: 0.8912336429693059
Energy: 0.9262726033938448
Energy: 0.8912336429684626
Energy: 0.9850064966090175
Energy: 1.0773197665239609
Energy: 0.9850064966161838
Energy: 1.0773197665243828
Energy: 0.9850064966157622
Energy: 1.0773197665235394
Energy: 0.9255622545764013
Energy: 0.8853566677950909
Energy: 0.9255622545793523
Energy: 0.8853566677900323
Energy: 0.9255622545713812
Energy: 0.8853566677845522
Energy: 0.9552550491287188
Energy: 0.8647673678349908
Energy: 0.9552550491291405
Energy: 0.8647673678392063
Energy: 0.9552550491228173
Energy: 0.8647673678459511
Energy: 0.9982391626545798
Energy: 0.9480192450366046
Energy: 0.9982391625551325
Energy: 0.9480192450403986
Energy: 0.9982391629516183
Energy: 0.9480192450382908
Energy: 0.8930095505766757
Energy: 0.9342123035621407
Energy: 0.8930095505867546
Energy: 0.93421230356467
Energy: 0.8930095505922346
Energy: 0.9342123035587683
Energy: 1.0082872346839529
Energy: 0.8911592594248234
Energy: 1.008287234815821
Energy: 0.8911592594168138
Energy: 1.008287234664983
Energy: 0.8911592594142845
Energy: 0.9205807383903086
Energy: 0.8975494753089491
Energy: 0.9205807383869745
Energy: 0.8975494753022044
Energy: 0.9205807383869745
Energy: 0.8975494753017828
Energy: 0.904247664637236
Energy: 0.8857023432795823
Energy: 0.9042474232437405
Energy: 0.8857023432778961
Energy: 0.9042476287839665
Energy: 0.8857023432762101
Energy: 0.8881991075642575
Energy: 0.9237482528978904
Energy: 0.8881991075583558
Energy: 0.9221698065633974
Energy: 0.8881991075583558
Energy: 0.9237482528978904
Energy: 0.9883182146488763
Energy: 0.9000621451577059
Energy: 0.9879627974260966
Energy: 0.900062145163186
Energy: 0.9883182146505625
Energy: 0.900062145160235
Energy: 0.8932793364874014
Energy: 0.8933257228802604
Energy: 0.8943240481801111
Energy: 0.8933257228874267
Energy: 0.8932793364979401
Energy: 0.893325722890799
Energy: 0.9980827483996406
Energy: 0.9324501404668604
Energy: 0.998082748394582
Energy: 0.932450140468968
Energy: 0.9980827484009054
Energy: 0.9324501404685465

minimum gb energy = 0.7969103867944477 eV
minimum distance =  2.23040908536895 Angstroms
sigma value = 57


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

Energy: 0.8321086488140765
Energy: 0.8327319814623108
Energy: 0.8634147325890178
Energy: 0.8327319814678018
Energy: 0.8321086487976035
Energy: 0.8327319814629972
Energy: 0.9774453871938823
Energy: 0.8807192190874208
Energy: 0.9428812083962269
Energy: 0.8807192190929118
Energy: 0.977445387222024
Energy: 0.8807192190915392
Energy: 0.9745848405674755
Energy: 0.8835177916198497
Energy: 0.8906835118948295
Energy: 0.8835177916349499
Energy: 0.9745848405777712
Energy: 0.8835177916397546
Energy: 0.831310835825103
Energy: 0.9781697624444583
Energy: 0.8312797252314008
Energy: 0.9781697624568131
Energy: 0.8313108358381442
Energy: 0.9781697624540676
Energy: 0.9449536597548978
Energy: 0.8647271361336365
Energy: 0.9449536597487204
Energy: 0.8647271361308909
Energy: 0.944953659753525
Energy: 0.8647271361281454
Energy: 0.8719153485962107
Energy: 0.8566155679445429
Energy: 0.8722451576781788
Energy: 0.8566155679527795
Energy: 0.8719153486092521
Energy: 0.8566155679548386
Energy: 0.8697443913691366
Energy: 0.9340692141937468
Energy: 0.869744391375314
Energy: 0.9340692142026699
Energy: 0.8697443913808052
Energy: 0.9340692142088473
Energy: 0.9474409685236567
Energy: 0.9802834985281811
Energy: 0.9474409685380708
Energy: 0.9802834985453405
Energy: 0.947440968538757
Energy: 0.9802834985405359
Energy: 0.8219785293696888
Energy: 0.8577614447408711
Energy: 0.8219785293758662
Energy: 0.8577614447346936
Energy: 0.8219785293717479
Energy: 0.857761444736753
Energy: 0.8114865254438017
Energy: 0.87535457582724
Energy: 0.8114865254390595
Energy: 0.8753545758093939
Energy: 0.8114865254376866
Energy: 0.8753545758087077
Energy: 0.9586253230897674
Energy: 0.9783818141117481
Energy: 0.9586253230849627
Energy: 0.978381814124103
Energy: 0.95862532308359
Energy: 0.9783818141289076
Energy: 0.8857162470227053
Energy: 0.8854335321885782
Energy: 0.8857162470426103
Energy: 0.8854335321906376
Energy: 0.8857162470432967
Energy: 0.8854335321899511
Energy: 0.8044869102070638
Energy: 0.9035225081872806
Energy: 0.8044869102050045
Energy: 0.9035225081948308
Energy: 0.8044869101974542
Energy: 0.9035225082016946
Energy: 0.8827178589966173
Energy: 0.9084672352255703
Energy: 0.8827178589883808
Energy: 0.9084672352262567
Energy: 0.882717858976026
Energy: 0.9084672352262567
Energy: 0.9311877483867863
Energy: 0.8703310495192694
Energy: 0.9311877483860997
Energy: 0.8703310495130921
Energy: 0.9311877483751178
Energy: 0.8703310495151513
Energy: 0.8945135806868408
Energy: 0.9131422120847944
Energy: 0.8945135806902726
Energy: 0.9131422120744987
Energy: 0.8945135806991957
Energy: 0.9131422120813625
Energy: 0.964289276656162
Energy: 0.9352785674910467
Energy: 0.8619815983399056
Energy: 0.9352785674814372
Energy: 0.9642892766499845
Energy: 0.9352785674814372
Energy: 0.9855286640844516
Energy: 0.8695817937684971
Energy: 0.8850696197719514
Energy: 0.869581793771929
Energy: 0.9855286640858245
Energy: 0.8695817937712427
Energy: 0.872345202561407
Energy: 0.9324144253209317
Energy: 0.8719271725552071
Energy: 0.9324144253085765
Energy: 0.8723452025662117
Energy: 0.9324144253099494
Energy: 0.9639204221869337
Energy: 0.9698429834921689
Energy: 0.9532454089525734
Energy: 0.9698429834825596
Energy: 0.9639204221910519
Energy: 0.9698429834825596
Energy: 0.9224232891683424
Energy: 1.031989499733486
Energy: 0.9224232893563487
Energy: 1.0319894997472137
Energy: 0.9224232893974693
Energy: 1.031989499744468
Energy: 0.8734371321245964
Energy: 0.9222537255686669
Energy: 0.8902061606100834
Energy: 0.9222537255583713
Energy: 0.8734371321259692
Energy: 0.9222537255583713
Energy: 0.8248017468954596
Energy: 0.8711435346251725
Energy: 0.824801746890655
Energy: 0.8711435346224269
Energy: 0.8248017469036962
Energy: 0.8711435346217405
Energy: 0.8915657401817634
Energy: 0.9287491372816469
Energy: 0.8915657401858817
Energy: 0.9287491372775285
Energy: 0.8915657401858817
Energy: 0.9287491372754694
Energy: 0.829854467769419
Energy: 1.0339381626147186
Energy: 0.8298544677797147
Energy: 1.0339381626250141
Energy: 0.82985446777491
Energy: 1.0339381626250141
Energy: 0.7974692727415074
Energy: 0.8765416706869726
Energy: 0.7974692727463122
Energy: 0.8765416706835406
Energy: 0.7974692727483712
Energy: 0.8765416706835406
Energy: 0.7928405013900682
Energy: 0.9179084799231352
Energy: 0.7928405013708496
Energy: 0.9179084799279399
Energy: 0.7928405015595423
Energy: 0.9179084799224488

minimum gb energy = 0.7928405013708496 eV
minimum distance =  2.24881922690028 Angstroms
sigma value = 43


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

Energy: 0.934168354057017
Energy: 0.7536336470778577
Energy: 0.934168354057017
Energy: 0.7536336470733569
Energy: 0.9341683540535163
Energy: 0.7536336470753573
Energy: 0.7442719147627503
Energy: 0.8034182850238342
Energy: 0.7442719060213456
Energy: 0.8034182850208336
Energy: 0.744271912058385
Energy: 0.8034182850223338
Energy: 0.8727481779200075
Energy: 0.8046878265765219
Energy: 0.8727481779190074
Energy: 0.8046878265760218
Energy: 0.8727481779185072
Energy: 0.8046878265750217
Energy: 0.7468008583284959
Energy: 0.7595565374377442
Energy: 0.7468019925862178
Energy: 0.7595565374422452
Energy: 0.746801369214434
Energy: 0.7595565374392446
Energy: 0.7470181637945895
Energy: 0.7694320752651029
Energy: 0.7470181798532017
Energy: 0.7694320752626024
Energy: 0.747018161902025
Energy: 0.7694320752631024
Energy: 0.7379099298294067
Energy: 0.7867380069350033
Energy: 0.7379099298354079
Energy: 0.7867380069395044
Energy: 0.7379099298369083
Energy: 0.7867380069410046
Energy: 0.7402384393070192
Energy: 0.7467892051962263
Energy: 0.7402384393164755
Energy: 0.7467892051957262
Energy: 0.7402384394214513
Energy: 0.7467892051927256
Energy: 0.7501265155149517
Energy: 0.8208796692394497
Energy: 0.750126502179163
Energy: 0.8208796692414502
Energy: 0.7501265134964523
Energy: 0.8208796692384495
Energy: 0.7172428544974827
Energy: 0.7762984072309759
Energy: 0.7172428545004832
Energy: 0.7762984072239745
Energy: 0.7172428544964824
Energy: 0.7762984072279752
Energy: 0.7451828391873738
Energy: 0.725759307224504
Energy: 0.7451828391918747
Energy: 0.7257593072260042
Energy: 0.7451828391903743
Energy: 0.7257593072335058
Energy: 0.826642899928697
Energy: 0.8058934025776935
Energy: 0.8266428999306974
Energy: 0.8058934025741927
Energy: 0.8266428999301974
Energy: 0.8058934025736928
Energy: 0.7043066380105114
Energy: 0.7754708074333387
Energy: 0.7043066380100113
Energy: 0.7754708074338388
Energy: 0.7043066380110116
Energy: 0.7754708074323385
Energy: 0.7440841245256175
Energy: 0.6983471473762921
Energy: 0.7440841245271178
Energy: 0.6983471473772923
Energy: 0.744084124527618
Energy: 0.6983471473772923
Energy: 0.7594746074717479
Energy: 0.8052482959351867
Energy: 0.7594746074682471
Energy: 0.8052482959241845
Energy: 0.7594746074732481
Energy: 0.8052482959356867
Energy: 0.7215250787277548
Energy: 0.7165807940394298
Energy: 0.7215250787302554
Energy: 0.7165807940444308
Energy: 0.7215250787302554
Energy: 0.7165807940424304
Energy: 0.8160579702149174
Energy: 0.7612227334538962
Energy: 0.8160579702154174
Energy: 0.7612227334463947
Energy: 0.8160579702154174
Energy: 0.7612227334483951
Energy: 0.7514722881453517
Energy: 0.7995087502265888
Energy: 0.7514722881408508
Energy: 0.7995087502156321
Energy: 0.7514722881388505
Energy: 0.799508750219633
Energy: 0.7376367614686126
Energy: 0.7129415711224132
Energy: 0.7376367614671122
Energy: 0.7129415711234134
Energy: 0.7376367614701129
Energy: 0.712941571136416
Energy: 0.7858855402689958
Energy: 0.7767879235566251
Energy: 0.7858855402704963
Energy: 0.7767879235586256
Energy: 0.7858855402704963
Energy: 0.7767879235581255
Energy: 0.8683180891612748
Energy: 0.7112375689145284
Energy: 0.8683180891607747
Energy: 0.7112375689070268
Energy: 0.8683180891602745
Energy: 0.7112375688770207
Energy: 0.7890289317983422
Energy: 0.8657779989249393
Energy: 0.7890289317953416
Energy: 0.8657779989393967
Energy: 0.7890289318008427
Energy: 0.8657779989338956
Energy: 0.8137834118175821
Energy: 0.7449256513505563
Energy: 0.8137834118195826
Energy: 0.7449256513590581
Energy: 0.813783411816582
Energy: 0.7449256513455554
Energy: 0.8108780175517603
Energy: 0.8281760645539875
Energy: 0.8108780175592617
Energy: 0.8281760645549876
Energy: 0.8108780175547609
Energy: 0.8281760645559879
Energy: 0.8156453704327797
Energy: 0.8656466995575401
Energy: 0.8156453704427817
Energy: 0.8656466995635412
Energy: 0.8156453704322798
Energy: 0.865646699567042
Energy: 0.7704829015128639
Energy: 0.7135971824484606
Energy: 0.7704829015123638
Energy: 0.7135971824449598
Energy: 0.7704829015173648
Energy: 0.7135971824494608
Energy: 0.773166151147949
Energy: 0.7560460601263439
Energy: 0.773166151147949
Energy: 0.756046060131845
Energy: 0.7731661511459486
Energy: 0.7560460601293445
Energy: 0.7801692364070425
Energy: 1.1136827073670843
Energy: 0.7417941575544601
Energy: 1.1136827073665843
Energy: 0.7801692364020415
Energy: 1.1136827073665843
Energy: 0.6635337275091178
Energy: 0.7211675163546482
Energy: 0.663533727510118
Energy: 0.7211675164006119
Energy: 0.6635337275081176
Energy: 0.7211675170579723
Energy: 0.7736008046077849
Energy: 0.7204826222465252
Energy: 0.7736008046062847
Energy: 0.7204826222460251
Energy: 0.7736008046102855
Energy: 0.7204826222485256
Energy: 0.7256679166768151
Energy: 0.7078796613810056
Energy: 0.725667916661812
Energy: 0.7078796613830058
Energy: 0.725667916676315
Energy: 0.7078796613840062
Energy: 0.7441426298578118
Energy: 0.8365843192462382
Energy: 0.7441426298558114
Energy: 0.8365843192472386
Energy: 0.7441426298578118
Energy: 0.8365843192472386
Energy: 0.7753364023574123
Energy: 0.7149134947986969
Energy: 0.7753364023574123
Energy: 0.7149134947986969
Energy: 0.7753364023549119
Energy: 0.7149134947981969
Energy: 0.7073264303273066
Energy: 0.7185958603098576
Energy: 0.7073264303253062
Energy: 0.7185958603098576
Energy: 0.707326430324306
Energy: 0.7185958603019015
Energy: 0.8208764444751568
Energy: 0.7994247989428359
Energy: 0.8208764444746567
Energy: 0.799424799063815
Energy: 0.8208764444806579
Energy: 0.7994247989538381
Energy: 0.7739847779156569
Energy: 0.8201703356446387
Energy: 0.7739847779181575
Energy: 0.8201703356446387
Energy: 0.7739847779181575
Energy: 0.8201703356446387
Energy: 0.6571722712384902
Energy: 0.7150778965563412
Energy: 0.65717227123799
Energy: 0.7150778965558412
Energy: 0.6571722712434913
Energy: 0.7150778965483852

minimum gb energy = 0.65717227123799 eV
minimum distance =  2.3042606346069 Angstroms
sigma value = 81


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

Energy: 0.05870215198580198
Energy: 0.1222115352173342
Energy: 0.05870215198580198
Energy: 0.12221153521917169
Energy: 0.05870215198580198
Energy: 0.12221153521917169
Energy: 0.6677045705092745
Energy: 0.059316452232989224
Energy: 0.6677045705074369
Energy: 0.05931645223845993
Energy: 0.6677045705074369
Energy: 0.059316452232989224
Energy: 0.6677598717057361
Energy: 0.05948391457194651
Energy: 0.6677598717057361
Energy: 0.05948391457378399
Energy: 0.6677598717057361
Energy: 0.059483914575621494
Energy: 0.05870215198580198
Energy: 0.12221153521917169
Energy: 0.05870215198580198
Energy: 0.12221153521917169
Energy: 0.05870215198580198
Energy: 0.12221153521917169
Energy: 0.6677045705074369
Energy: 0.05931645223115174
Energy: 0.6677045705092745
Energy: 0.059316452232989224
Energy: 0.6677045705074369
Energy: 0.05931645223115174
Energy: 0.6677598717057361
Energy: 0.05948391457010902
Energy: 0.6677598717057361
Energy: 0.05948391457010902
Energy: 0.6677598717057361
Energy: 0.05948391457194651
Energy: 0.05870215198580198
Energy: 0.12221153521917169
Energy: 0.05870215198580198
Energy: 0.1222115352173342
Energy: 0.05870215198580198
Energy: 0.1222115352173342
Energy: 0.6677045705074369
Energy: 0.05931645223115174
Energy: 0.6677045705074369
Energy: 0.059316452229314254
Energy: 0.6677045705074369
Energy: 0.05931645223666421
Energy: 0.6677598717057361
Energy: 0.05948391457010902
Energy: 0.6677598717057361
Energy: 0.05948391457194651
Energy: 0.6677598717057361
Energy: 0.059483914575621494
Energy: 0.05870215198580198
Energy: 0.1222115352173342
Energy: 0.05870215198580198
Energy: 0.1222115352173342
Energy: 0.05870215198580198
Energy: 0.1222115352173342

minimum gb energy = 0.05870215198580198 eV
minimum distance =  2.4738696711153 Angstroms
sigma value = 3


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

Energy: 0.7597790538305824
Energy: 0.7048994157489897
Energy: 0.7224192537768738
Energy: 0.704899415756138
Energy: 0.7597790538272832
Energy: 0.7048994157572378
Energy: 0.7164157452284379
Energy: 0.6880735120982694
Energy: 0.7164157452311873
Energy: 0.6880735120944201
Energy: 0.7164157452333868
Energy: 0.6880735120938702
Energy: 0.6981754350670474
Energy: 0.6893975488917905
Energy: 0.698175435064298
Energy: 0.6893975488912405
Energy: 0.6981754350648479
Energy: 0.6893975488912405
Energy: 0.6822932315689707
Energy: 0.7180928400594124
Energy: 0.6822932315706204
Energy: 0.7180928400588625
Energy: 0.6822932315750192
Energy: 0.7180928400599624
Energy: 0.6579401107839912
Energy: 0.6343721001237373
Energy: 0.6579401107828914
Energy: 0.6343721001358346
Energy: 0.6579401107883902
Energy: 0.6343721001347349
Energy: 0.6424235408807201
Energy: 0.6824535993412192
Energy: 0.6424235408790705
Energy: 0.6824535993401195
Energy: 0.6424235408763211
Energy: 0.6824535993390196
Energy: 0.680900763491726
Energy: 0.6695885631700947
Energy: 0.6809007634972247
Energy: 0.6695885631662456
Energy: 0.6809007635010738
Energy: 0.669588563168995
Energy: 0.6458940065762574
Energy: 0.6272798567474537
Energy: 0.6458940065823061
Energy: 0.6272798567403054
Energy: 0.6458940065850554
Energy: 0.6272798567386557
Energy: 0.6547151274719699
Energy: 0.6900943448118141
Energy: 0.65471512747142
Energy: 0.6900943448151134
Energy: 0.6547151274692206
Energy: 0.6900943448140135
Energy: 0.6289874943306627
Energy: 0.6543733565160386
Energy: 0.6289874943229644
Energy: 0.6543733565143889
Energy: 0.6289874943235143
Energy: 0.6543733565116396
Energy: 0.694373359043016
Energy: 0.6310335370282939
Energy: 0.6943733590419162
Energy: 0.6310335370332427
Energy: 0.6943733590435659
Energy: 0.6310335370326929
Energy: 0.6822566399889652
Energy: 0.6960187088542801
Energy: 0.6822566399917147
Energy: 0.6960187088537303
Energy: 0.6822566399961136
Energy: 0.6960187088564795
Energy: 0.6287030334226501
Energy: 0.6624997131940419
Energy: 0.6287030334171514
Energy: 0.6624997131967914
Energy: 0.6287030334210004
Energy: 0.6624997131967914
Energy: 0.744491558070116
Energy: 0.6967326444535068
Energy: 0.7444915580717656
Energy: 0.6967326444513073
Energy: 0.7444915580695661
Energy: 0.6967326444529569
Energy: 0.6797201123477711
Energy: 0.7472614916881553
Energy: 0.6797325748434354
Energy: 0.7472614916810068
Energy: 0.6797201123549195
Energy: 0.7472614916832062
Energy: 0.6267380586824608
Energy: 0.6523814786454564
Energy: 0.626738058676962
Energy: 0.6523814786482057
Energy: 0.6267380586758623
Energy: 0.6523814786498553
Energy: 0.7167403709605896
Energy: 0.7154910579523088
Energy: 0.71674037095894
Energy: 0.7154910579495594
Energy: 0.7167403709605896
Energy: 0.7154910579479098
Energy: 0.6823934657802075
Energy: 0.7093336417672478
Energy: 0.6892871483147839
Energy: 0.7093336417639484
Energy: 0.6823934657846065
Energy: 0.7093336417644983
Energy: 0.6788676878139562
Energy: 0.6633555129825544
Energy: 0.6815967368382854
Energy: 0.6633555129765059
Energy: 0.6788676878139562
Energy: 0.6633555129765059
Energy: 0.743375792053581
Energy: 0.6984496166242848
Energy: 0.6492966235382513
Energy: 0.6984496166226352
Energy: 0.7433757920585298
Energy: 0.698449616623735
Energy: 0.7071189412278984
Energy: 0.7031513403167358
Energy: 0.6495507114204055
Energy: 0.7031513403178354
Energy: 0.7071189412234995
Energy: 0.7031513403134365
Energy: 0.705443918833085
Energy: 0.6852439156590234
Energy: 0.6417771805065421
Energy: 0.6852439156508253
Energy: 0.7054439188314353
Energy: 0.6852439156502755
Energy: 0.7510188974353746
Energy: 0.7099943005886046
Energy: 0.751018897434275
Energy: 0.7099943005848054
Energy: 0.7510188974425231
Energy: 0.7099943005842556
Energy: 0.7164340383320326
Energy: 0.6733727929065302
Energy: 0.7164340383347819
Energy: 0.6733727929175276
Energy: 0.7164340383380811
Energy: 0.6733727929158779
Energy: 0.6840963466340939
Energy: 0.6541318542427785
Energy: 0.6840963466357435
Energy: 0.6541318542383795
Energy: 0.6840963466302449
Energy: 0.6541318542383795
Energy: 0.6889030105755445
Energy: 0.6915176731902253
Energy: 0.6889030105716953
Energy: 0.6915176731924246
Energy: 0.6889030105667465
Energy: 0.6915176731924246
Energy: 0.6573421270450419
Energy: 0.6708469548349634
Energy: 0.6573421270483412
Energy: 0.6708469548459608
Energy: 0.6573421270488911
Energy: 0.6708469548437613
Energy: 0.6824746391132522
Energy: 0.6637445593048966
Energy: 0.6824746391132522
Energy: 0.6637445593037968
Energy: 0.6824746391171013
Energy: 0.6637445593037968
Energy: 0.6693054570355385
Energy: 0.6399626485853466
Energy: 0.6693054570360882
Energy: 0.6399626485886458
Energy: 0.6693054570338888
Energy: 0.6399626485869963
Energy: 0.6698381205770221
Energy: 0.6986544346610661
Energy: 0.669838120581421
Energy: 0.6986544346654651
Energy: 0.6698381205808711
Energy: 0.6986544346649152
Energy: 0.6935342811530405
Energy: 0.6516625917167926
Energy: 0.6935342811530405
Energy: 0.6516625917090945
Energy: 0.6935342811459421
Energy: 0.6516625917129436
Energy: 0.6157181392804
Energy: 0.6249951518741469
Energy: 0.6157181392831493
Energy: 0.6249951518680983
Energy: 0.6157181392847989
Energy: 0.6249951518680983
Energy: 0.7077776407829075
Energy: 0.7397811621236059
Energy: 0.7034827093382906
Energy: 0.7397811621126084
Energy: 0.7077776407801581
Energy: 0.7397811621120585

minimum gb energy = 0.6157181392804 eV
minimum distance =  2.3336531076153 Angstroms
sigma value = 67


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

Energy: 0.8879730380251117
Energy: 0.9309648078015763
Energy: 0.8143393211385903
Energy: 0.930964807810195
Energy: 0.8879730380352973
Energy: 0.9309648078086279
Energy: 0.8527541900169163
Energy: 0.8340193361988988
Energy: 0.8527541900098646
Energy: 0.8340193362004656
Energy: 0.8527541900098646
Energy: 0.8340193362028163
Energy: 0.7979556985387803
Energy: 0.834324331270464
Energy: 0.7979556985387803
Energy: 0.8343243312837837
Energy: 0.7979556985426979
Energy: 0.834324331281433
Energy: 0.8443970830091536
Energy: 0.8916791881837858
Energy: 0.8443970830052361
Energy: 0.8916791881768057
Energy: 0.8443970830028856
Energy: 0.8916791881760221
Energy: 0.8329640799137278
Energy: 0.754207685283256
Energy: 0.8329640799199959
Energy: 0.754207685283256
Energy: 0.8329640799192123
Energy: 0.7542076852824725
Energy: 0.7946583024118661
Energy: 0.8372900086660832
Energy: 0.7946583024118661
Energy: 0.8372900086598863
Energy: 0.794658302416567
Energy: 0.8372900086591027
Energy: 0.7429108209297629
Energy: 0.8172010539582754
Energy: 0.7429108209352473
Energy: 0.8172010539543577
Energy: 0.7429108209344639
Energy: 0.8172010539527909
Energy: 0.9015837656714847
Energy: 0.7564291034590974
Energy: 0.9015837656738351
Energy: 0.756429103467716
Energy: 0.9015837656699176
Energy: 0.7564291034637984
Energy: 0.8132736410958766
Energy: 0.8404104128320901
Energy: 0.8132736410927427
Energy: 0.8404104128047384
Energy: 0.8132736410943098
Energy: 0.8404104127616454
Energy: 0.7375108121278223
Energy: 0.834170736646624
Energy: 0.7375108121200584
Energy: 0.8341707366215518
Energy: 0.7375108121137903
Energy: 0.8341707366176342
Energy: 0.9181726525221727
Energy: 0.8409283849773543
Energy: 0.9181726525284407
Energy: 0.8409283849766421
Energy: 0.9181726525253067
Energy: 0.8409283849680235
Energy: 0.8192864949134159
Energy: 0.8940051981143372
Energy: 0.822782653030832
Energy: 0.8940051980978836
Energy: 0.8192864949126324
Energy: 0.8940051981025847
Energy: 0.8181095955088039
Energy: 0.8308442769909186
Energy: 0.8171166848134389
Energy: 0.830844276993269
Energy: 0.818109595496339
Energy: 0.8308442769940525
Energy: 0.9299499966375017
Energy: 0.8279112552647165
Energy: 0.8085602721958497
Energy: 0.8279112552615825
Energy: 0.9299499966335842
Energy: 0.8279112552662835
Energy: 0.8754133688933645
Energy: 0.8434886359818786
Energy: 0.8157892862429011
Energy: 0.843488635974827
Energy: 0.8754133689113853
Energy: 0.843488635977961
Energy: 0.8608690565764486
Energy: 0.8645738885935466
Energy: 0.7636997862502691
Energy: 0.8645738886021651
Energy: 0.8608690565748818
Energy: 0.8645738886013817
Energy: 0.8852195858924852
Energy: 0.8362448047088196
Energy: 0.8852195859018873
Energy: 0.8362448047056854
Energy: 0.8852195859058049
Energy: 0.836244804706469
Energy: 0.8011544283759588
Energy: 0.8145686002560887
Energy: 0.8011544283782381
Energy: 0.8145686002639239
Energy: 0.8011544283774545
Energy: 0.8145686002592227
Energy: 0.8261285996641465
Energy: 0.8072203616222142
Energy: 0.8261285996649301
Energy: 0.8072203616269152
Energy: 0.8261285996711982
Energy: 0.8072203616253483
Energy: 0.8336806113977987
Energy: 0.7455863916400817
Energy: 0.8336806113954481
Energy: 0.7455863916487002
Energy: 0.8336806113970151
Energy: 0.7455863916487002
Energy: 0.8236598608442737
Energy: 0.8354884139470755
Energy: 0.8236598608442737
Energy: 0.8354884139361064
Energy: 0.8236598608458406
Energy: 0.8354884139361064
Energy: 0.8737797894806465
Energy: 0.8319933274695923
Energy: 0.8737797894845639
Energy: 0.8319933274680252
Energy: 0.8737797894916156
Energy: 0.8319933274695923
Energy: 0.8123575385880207
Energy: 0.7475758562712559
Energy: 0.8187906826746484
Energy: 0.747575856277524
Energy: 0.8187906826777824
Energy: 0.7475758562798746

minimum gb energy = 0.7375108121137903 eV
minimum distance =  2.34121878805072 Angstroms
sigma value = 33


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

Energy: 0.8919199791959315
Energy: 0.9468643817718766
Energy: 0.8919199791914582
Energy: 0.9468643817718766
Energy: 0.8919199791914582
Energy: 0.9468643817718766
Energy: 0.8820593223229494
Energy: 0.8308549570675177
Energy: 0.8820593223239435
Energy: 0.8308549570690089
Energy: 0.8820593223214582
Energy: 0.8308549570729852
Energy: 0.9009136353850548
Energy: 0.8285566877697209
Energy: 0.9009136353820726
Energy: 0.828556687769224
Energy: 0.900913635386546
Energy: 0.8285566877712119
Energy: 0.86310292144494
Energy: 0.9574125422642795
Energy: 0.8631029214429521
Energy: 0.9574125422642795
Energy: 0.863102921443449
Energy: 0.9574125422662676
Energy: 0.8826165097490046
Energy: 0.8291731083398866
Energy: 0.8826165097480105
Energy: 0.8291731083418746
Energy: 0.8826165097485077
Energy: 0.8291731083408806
Energy: 0.9320703371422827
Energy: 0.9201262264771798
Energy: 0.9320703371407917
Energy: 0.9201262264766826
Energy: 0.9320703371402945
Energy: 0.9201262264771798
Energy: 0.8661984028059219
Energy: 0.942920474482747
Energy: 0.8661984028054248
Energy: 0.9429204744832439
Energy: 0.8661984028044308
Energy: 0.942920474482747
Energy: 0.9321601627096822
Energy: 0.8857083759478537
Energy: 0.9321601627101793
Energy: 0.8857083759488479
Energy: 0.9321601627101793
Energy: 0.8857083759488479
Energy: 0.8446776475752278
Energy: 0.8998286630975136
Energy: 0.8446776475752278
Energy: 0.8998286630975136
Energy: 0.8446776475762219
Energy: 0.8998286630980107
Energy: 0.8648276869613819
Energy: 0.9093918819107867
Energy: 0.8648276869653583
Energy: 0.8906763713829585
Energy: 0.8648276869663524
Energy: 0.8906763713924023
Energy: 0.893203188409544
Energy: 0.8294640915929415
Energy: 0.893203188410041
Energy: 0.8294640915944326
Energy: 0.8932031884085498
Energy: 0.8294640915979119
Energy: 0.913524532317245
Energy: 0.8765708364652548
Energy: 0.9135245323157538
Energy: 0.8765708364677399
Energy: 0.9135245323162509
Energy: 0.8765708364667458
Energy: 0.8671295630091398
Energy: 0.8588257275619304
Energy: 0.8671295630076488
Energy: 0.8588257275619304
Energy: 0.8671295630106308
Energy: 0.8588257275599422
Energy: 0.872532796871267
Energy: 0.8312197681135892
Energy: 0.872532796871267
Energy: 0.8312197681150805
Energy: 0.872532796871267
Energy: 0.8312197681140864
Energy: 0.8881812953938927
Energy: 0.893503852124369
Energy: 0.8881812953909103
Energy: 0.8935038521238721
Energy: 0.8881812953933956
Energy: 0.8935038521248662
Energy: 0.862522225676156
Energy: 0.8859244918312115
Energy: 0.8625222256771501
Energy: 0.8859244918322056
Energy: 0.8625222256741678
Energy: 0.8859244918336967
Energy: 0.9096702021438935
Energy: 0.828547304693488
Energy: 0.9096702021438935
Energy: 0.8285473046944821
Energy: 0.9096702021433966
Energy: 0.8285473046905057
Energy: 0.9113542366907752
Energy: 0.9072960545002176
Energy: 0.9113542366917693
Energy: 0.9072960544982294
Energy: 0.9113542366922663
Energy: 0.9072960544992235
Energy: 0.8734536855125699
Energy: 0.91539929211774
Energy: 0.8734536855155519
Energy: 0.915399292119231
Energy: 0.8734536855145578
Energy: 0.9153992921162488
Energy: 0.941980384119324
Energy: 0.8308513913967568
Energy: 0.941980384119324
Energy: 0.8308513913942717
Energy: 0.9419803841188269
Energy: 0.8308513913982478
Energy: 0.8663306057086249
Energy: 0.8813056463384354
Energy: 0.8663306057076308
Energy: 0.8813056463379385
Energy: 0.8663306057086249
Energy: 0.8813056463399265
Energy: 0.8938708901683899
Energy: 0.8848716116759104
Energy: 0.893870890169384
Energy: 0.8848716116759104
Energy: 0.8938708901738575
Energy: 0.8848716116759104
Energy: 0.9375969919225264
Energy: 0.8327447670670911
Energy: 0.9375969919240178
Energy: 0.8327447670685821
Energy: 0.9375969919130828
Energy: 0.832744767064606
Energy: 0.8645766813638835
Energy: 0.8673317899438234
Energy: 0.864576681369848
Energy: 0.8673317899448176
Energy: 0.8645766813733273
Energy: 0.8673317899448176
Energy: 0.8657480742411527
Energy: 0.8683247601874403
Energy: 0.8657480742381705
Energy: 0.8683247601874403
Energy: 0.8657480742371764
Energy: 0.8683247601869432
Energy: 0.89333113715686
Energy: 0.866119048535802
Energy: 0.8933311371638185
Energy: 0.8661190485387843
Energy: 0.8933311371663037
Energy: 0.8661190485303347
Energy: 0.8658806758497267
Energy: 0.8840712449412309
Energy: 0.8658806758477385
Energy: 0.8840712449427219
Energy: 0.8658806758477385
Energy: 0.8840712449417278
Energy: 0.8705677079074994
Energy: 0.9360068819750184
Energy: 0.8705677079084934
Energy: 0.9360068819750184
Energy: 0.8705677079074994
Energy: 0.9360068819755153
Energy: 0.9782758189115512
Energy: 0.829214294276859
Energy: 0.9782758189105571
Energy: 0.8292142942738767
Energy: 0.9782758189115512
Energy: 0.829214294275368
Energy: 0.8627774165407249
Energy: 0.9530785820062455
Energy: 0.8627774165461924
Energy: 0.9530785820067424
Energy: 0.8627774165427132
Energy: 0.9530785820052514
Energy: 0.9278107430258924
Energy: 0.9037151690897748
Energy: 0.9278107430263896
Energy: 0.9037151690907689
Energy: 0.9278107430263896
Energy: 0.9037151690907689
Energy: 0.9115481200369359
Energy: 0.8310195043040409
Energy: 0.9115481200374328
Energy: 0.8310195043070233
Energy: 0.9115481200364387
Energy: 0.8310195043060291
Energy: 0.8708104282880513
Energy: 0.882387630793275
Energy: 0.8708104282895426
Energy: 0.8823876307883046
Energy: 0.8708104282900395
Energy: 0.8823876307888016
Energy: 0.8841004189123342
Energy: 0.8310128018787184
Energy: 0.8841004189084029
Energy: 0.8310128018782212
Energy: 0.88410041891134
Energy: 0.8310128018772271
Energy: 0.8668170273235594
Energy: 0.8287029083318579
Energy: 0.8668170273245532
Energy: 0.8287029083318579
Energy: 0.8668170273245532
Energy: 0.8287029083323548
Energy: 0.8673124318907032
Energy: 0.857383727197189
Energy: 0.8673124318907032
Energy: 0.8573837272036506
Energy: 0.867312431887269
Energy: 0.8573837272041478
Energy: 0.890711352098516
Energy: 0.9085995313975398
Energy: 0.890711352097025
Energy: 0.9085995313980367
Energy: 0.890711352098516
Energy: 0.9085995313975398

minimum gb energy = 0.8285473046905057 eV
minimum distance =  2.30566603364474 Angstroms
sigma value = 41


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

Energy: 1.1775533947802026
Energy: 1.143186650949097
Energy: 1.039156400328649
Energy: 1.1431866509531683
Energy: 1.1775533947802026
Energy: 1.1431866509545254
Energy: 1.0641647943724868
Energy: 1.1332224947324634
Energy: 1.0641647943752008
Energy: 1.1332224947283922
Energy: 1.0641647943711297
Energy: 1.133222494727035
Energy: 1.1048455790926732
Energy: 1.1046679758418056
Energy: 1.1048455790940304
Energy: 1.1046679758418056
Energy: 1.1048455790940304
Energy: 1.1046679758445195
Energy: 1.0131154211725908
Energy: 1.1301513500589748
Energy: 1.013115421176662
Energy: 1.1301513500589748
Energy: 1.013115421176662
Energy: 1.1301513500576175
Energy: 1.232092238077224
Energy: 1.0154856781955384
Energy: 1.2320922380745098
Energy: 1.0154856782009667
Energy: 1.2320922380717956
Energy: 1.0154856782009667
Energy: 1.0988936671201328
Energy: 1.1041210971750786
Energy: 1.09889366712149
Energy: 1.1041210971777926
Energy: 1.09889366712149
Energy: 1.1041210971750786
Energy: 1.0094923076631632
Energy: 1.1185403158455554
Energy: 1.0094923076618059
Energy: 1.1185403158441982
Energy: 1.009492307659092
Energy: 1.118540315842841
Energy: 1.1880170302166557
Energy: 1.1085959262200915
Energy: 1.1880170302166557
Energy: 1.1085959262173775
Energy: 1.1880170302193696
Energy: 1.1085959262173775
Energy: 1.2319411487883345
Energy: 1.0146780449760697
Energy: 1.0728882669314987
Energy: 1.0146780449774269
Energy: 1.2319411487896916
Energy: 1.0146780449747126
Energy: 1.157071423244685
Energy: 1.1561606806450462
Energy: 1.0139610616367398
Energy: 1.1561606806369038
Energy: 1.1570714232473993
Energy: 1.1561606806382607
Energy: 1.0648109067518792
Energy: 1.1045322731354208
Energy: 1.064810906749165
Energy: 1.104532273142206
Energy: 1.064810906750522
Energy: 1.104532273142206
Energy: 1.0565898645812775
Energy: 1.143431541195607
Energy: 1.0565898645839917
Energy: 1.143431541195607
Energy: 1.0565898645839917
Energy: 1.1434315411969644
Energy: 1.084446100347299
Energy: 1.1361477838167555
Energy: 1.0844461003432277
Energy: 1.1361477838276124
Energy: 1.0844461003445847
Energy: 1.1361477838262553
Energy: 1.204338399245079
Energy: 0.9873872071300671
Energy: 1.204338399243722
Energy: 0.9873872071287102
Energy: 1.2043383992423646
Energy: 0.9873872071287102

minimum gb energy = 0.9873872071287102 eV
minimum distance =  2.30328233429668 Angstroms
sigma value = 11


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

Energy: 1.261333513622806
Energy: 1.2473277177481112
Energy: 1.261333513631152
Energy: 1.247327717747515
Energy: 1.2613335136245944
Energy: 1.2473277177487072
Energy: 1.1434561045792022
Energy: 1.1561215212911886
Energy: 1.143456104582183
Energy: 1.1561215212899965
Energy: 1.143456104579798
Energy: 1.1561215212905926
Energy: 1.2504339907501871
Energy: 1.1530768613242761
Energy: 1.2504339907519755
Energy: 1.1530768613248723
Energy: 1.2504339907519755
Energy: 1.1530768613242761
Energy: 1.1765028430550328
Energy: 1.2054533968402612
Energy: 1.1765028430562252
Energy: 1.2054533968402612
Energy: 1.1765028430550328
Energy: 1.2054533968402612
Energy: 1.2688594707042709
Energy: 1.1632347262372962
Energy: 1.2688594707030785
Energy: 1.1632347262372962
Energy: 1.268859470701886
Energy: 1.1632347262366998
Energy: 1.1453410569896885
Energy: 1.2051722532422207
Energy: 1.1453410569825346
Energy: 1.2051722532422207
Energy: 1.1453410569819384
Energy: 1.2051722532410285
Energy: 1.162931416153347
Energy: 1.2784558185054302
Energy: 1.162931416153943
Energy: 1.2784558185048338
Energy: 1.1629314161557316
Energy: 1.2784558185054302
Energy: 1.2117603821288345
Energy: 1.1744872077084172
Energy: 1.2117603821347962
Energy: 1.1744872077084172
Energy: 1.2117603821318153
Energy: 1.174487207707225
Energy: 1.2359868537507672
Energy: 1.181563782120401
Energy: 1.2359868537513636
Energy: 1.1815637821209974
Energy: 1.2359868537513636
Energy: 1.1815637821209974
Energy: 1.1635368285237713
Energy: 1.2962835063007703
Energy: 1.1635368285237713
Energy: 1.2962835063007703
Energy: 1.1635368285243675
Energy: 1.296283506300174
Energy: 1.1744425860778838
Energy: 1.159004590902414
Energy: 1.1744425860778838
Energy: 1.1590045909047988
Energy: 1.1744425860778838
Energy: 1.1590045909036064
Energy: 1.203319232900697
Energy: 1.2050588566541038
Energy: 1.2033192329001006
Energy: 1.2050588566541038
Energy: 1.2033192329030813
Energy: 1.2050588566529115
Energy: 1.174714782216327
Energy: 1.195969652527043
Energy: 1.174714782215731
Energy: 1.1959696525264465
Energy: 1.1747147822151347
Energy: 1.195969652527043
Energy: 1.2451365546017679
Energy: 1.1644868335964125
Energy: 1.2451365546005755
Energy: 1.1644868335958165
Energy: 1.2451365546017679
Energy: 1.164486833594028
Energy: 1.2032480249323219
Energy: 1.1980172624685406
Energy: 1.203248024931726
Energy: 1.198017262473906
Energy: 1.2032480249263606
Energy: 1.1980172624703291
Energy: 1.1635686253359716
Energy: 1.2837692704874177
Energy: 1.1635686253354025
Energy: 1.2837692704874177
Energy: 1.1635686253395485
Energy: 1.2837692704868215
Energy: 1.177876904380398
Energy: 1.161286757889217
Energy: 1.1778769043786095
Energy: 1.1612867578886208
Energy: 1.1778769043792057
Energy: 1.1612867578880246
Energy: 1.2011440440549341
Energy: 1.1955109514586861
Energy: 1.201144044053742
Energy: 1.1955109514586861
Energy: 1.2011440440543377
Energy: 1.1955109514592823
Energy: 1.1678207916161458
Energy: 1.1823071975477621
Energy: 1.1678207916161458
Energy: 1.1823071975441852
Energy: 1.1678207916161458
Energy: 1.18230719754657
Energy: 1.2717783229951682
Energy: 1.1487495283106988
Energy: 1.2717783229951682
Energy: 1.1487495283142486
Energy: 1.2717783229957644
Energy: 1.1487495283160372
Energy: 1.1528737931066504
Energy: 1.1986073583294983
Energy: 1.152873793106054
Energy: 1.1986073583318828
Energy: 1.1528737931108233
Energy: 1.1986073583342676
Energy: 1.192728336096084
Energy: 1.23063694640006
Energy: 1.1927283360877379
Energy: 1.2306369464018485
Energy: 1.1927283360817764
Energy: 1.230636946399464
Energy: 1.2270347203321141
Energy: 1.1530349041425247
Energy: 1.2270347203291334
Energy: 1.1530349041425247
Energy: 1.2270347203291334
Energy: 1.153034904143121
Energy: 1.2515398169473038
Energy: 1.1540474711296205
Energy: 1.2515398169478997
Energy: 1.1540474711326012
Energy: 1.2515398169478997
Energy: 1.1540474711314088
Energy: 1.1587841360470288
Energy: 1.2467293890322722
Energy: 1.1587841360464326
Energy: 1.2467293890328683
Energy: 1.1587841360470288
Energy: 1.2467293890328683
Energy: 1.2195193075363675
Energy: 1.1635778957743586
Energy: 1.2195193075363675
Energy: 1.1635778957737621
Energy: 1.2195193075363675
Energy: 1.1635778957743586
Energy: 1.1641974958886712
Energy: 1.2436684734362042
Energy: 1.1641974958892674
Energy: 1.2436684734373966
Energy: 1.1641974958886712
Energy: 1.2436684734362042
Energy: 1.1694815550871673
Energy: 1.2019167572398624
Energy: 1.1694815550865714
Energy: 1.20191675723867
Energy: 1.1694815550877635
Energy: 1.201916757241651
Energy: 1.2339628170395074
Energy: 1.1620905269162838
Energy: 1.2339628170311612
Energy: 1.1620905269138988
Energy: 1.2339628170371228
Energy: 1.1620905269138988
Energy: 1.1854222678290773
Energy: 1.1352917701578178
Energy: 1.1854222678296733
Energy: 1.1352917701578178
Energy: 1.185422267828481
Energy: 1.1352917701572218
Energy: 1.1624844200001807
Energy: 1.2475769997337272
Energy: 1.1624844199995843
Energy: 1.24757699973015
Energy: 1.1624844200001807
Energy: 1.247576999733131

minimum gb energy = 1.1352917701572218 eV
minimum distance =  2.25170990477367 Angstroms
sigma value = 57


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

Energy: 1.145002215513038
Energy: 1.2707765363560595
Energy: 1.145002215513038
Energy: 1.2707765363549988
Energy: 1.145002215511977
Energy: 1.2707765363549988
Energy: 1.1471426282497603
Energy: 1.246849332594826
Energy: 1.1471426282455168
Energy: 1.2468493325937653
Energy: 1.1471426282550645
Energy: 1.2468493326022523
Energy: 1.2859208096723032
Energy: 1.1678009503465872
Energy: 1.2859208096733639
Energy: 1.1678009503465872
Energy: 1.2859208096669987
Energy: 1.1678009503465872
Energy: 1.1335911333164068
Energy: 1.1803167701681196
Energy: 1.1335911333164068
Energy: 1.1728154931246009
Energy: 1.1335911333164068
Energy: 1.1728154931267227
Energy: 1.2860663565757973
Energy: 1.167754462659721
Energy: 1.2860663565736756
Energy: 1.167754462659721
Energy: 1.2860663565779191
Energy: 1.1677544626586598
Energy: 1.147396762793467
Energy: 1.2484625140773395
Energy: 1.147396762717132
Energy: 1.254887500917992
Energy: 1.1473967627775539
Energy: 1.2548875009190528
Energy: 1.145002215511977
Energy: 1.2707765363539378
Energy: 1.145002215511977
Energy: 1.2707765363549988
Energy: 1.1450022155140989
Energy: 1.2707765363539378
Energy: 1.147142628250821
Energy: 1.2468493325927041
Energy: 1.1471426282486992
Energy: 1.2468493325927041
Energy: 1.1471426282444557
Energy: 1.2468493325969476
Energy: 1.2859208096754857
Energy: 1.1678009503476476
Energy: 1.2859208096701813
Energy: 1.1678009503476476
Energy: 1.2859208096669987
Energy: 1.1678009503476476
Energy: 1.1335911333142852
Energy: 1.1800855032252073
Energy: 1.1335911333132243
Energy: 1.1800855032315725
Energy: 1.1335911333132243
Energy: 1.1800855032368767
Energy: 1.2860663565789798
Energy: 1.1677544626629035
Energy: 1.2860663565800408
Energy: 1.1677544626629035
Energy: 1.286066356576858
Energy: 1.1677544626629035
Energy: 1.1473967627595187
Energy: 1.254887500917992
Energy: 1.1473967627595187
Energy: 1.254887500916931
Energy: 1.1473967627627015
Energy: 1.254887500917992
Energy: 1.145002215511977
Energy: 1.2707765363549988
Energy: 1.145002215513038
Energy: 1.2707765363539378
Energy: 1.145002215513038
Energy: 1.2707765363539378
Energy: 1.1471426282550645
Energy: 1.2468493325927041
Energy: 1.147142628251882
Energy: 1.246849332594826
Energy: 1.1471426282465775
Energy: 1.2468493325969476
Energy: 1.2859208096744248
Energy: 1.1678009503465872
Energy: 1.285920809664877
Energy: 1.1678009503465872
Energy: 1.2859208096638162
Energy: 1.1678009503465872
Energy: 1.1335911333185287
Energy: 1.1800855032305113
Energy: 1.1335911333164068
Energy: 1.1800855032294508
Energy: 1.1335911333164068
Energy: 1.1800855032368767
Energy: 1.2860663565747363
Energy: 1.167754462659721
Energy: 1.2860663565789798
Energy: 1.1677544626586598
Energy: 1.2860663565736756
Energy: 1.1677544626586598

minimum gb energy = 1.1335911333132243 eV
minimum distance =  2.28900832238917 Angstroms
sigma value = 9


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

Energy: 1.273332618180839
Energy: 1.252906420207416
Energy: 1.273332618179107
Energy: 1.252906420207416
Energy: 1.2733326181799731
Energy: 1.2529064202056834
Energy: 1.255290375660212
Energy: 1.2395368454083775
Energy: 1.255290375660212
Energy: 1.2395368454083775
Energy: 1.2552903756576133
Energy: 1.2395368454083775
Energy: 1.38280160868915
Energy: 1.2379823478170249
Energy: 1.3458744148463095
Energy: 1.2379823478170249
Energy: 1.38280160868915
Energy: 1.2379823478170249
Energy: 1.1914192325484396
Energy: 1.3638147567320063
Energy: 1.1914192325484396
Energy: 1.3638147567320063
Energy: 1.1914192325475732
Energy: 1.3638147567328724
Energy: 1.2722542092312057
Energy: 1.236309832871968
Energy: 1.2722542092320723
Energy: 1.236309832871968
Energy: 1.2722542092320723
Energy: 1.236309832871968
Energy: 1.2363392780699756
Energy: 1.200812842772775
Energy: 1.2363392780708415
Energy: 1.200812842772775
Energy: 1.2363392780708415
Energy: 1.200812842773641
Energy: 1.1875777962025031
Energy: 1.296082875550304
Energy: 1.1875777962025031
Energy: 1.2960828755485716
Energy: 1.1875777962025031
Energy: 1.2960828755494378
Energy: 1.1841390058136463
Energy: 1.3125421488964315
Energy: 1.1841390058136463
Energy: 1.3125421488946993
Energy: 1.1841390058145123
Energy: 1.312542148893833
Energy: 1.3806532043844275
Energy: 1.236553548476938
Energy: 1.3806532043878923
Energy: 1.236553548476938
Energy: 1.3806532043844275
Energy: 1.2365535484760721
Energy: 1.1918058027186618
Energy: 1.293014571223026
Energy: 1.1918058027186618
Energy: 1.2930145712247585
Energy: 1.1918058027186618
Energy: 1.2930145712238923
Energy: 1.3137749870707522
Energy: 1.2673851669157012
Energy: 1.3137749870698858
Energy: 1.2673851669148353
Energy: 1.3137749870698858
Energy: 1.2673851669165679
Energy: 1.2929764407427888
Energy: 1.2112572456437176
Energy: 1.2929764407427888
Energy: 1.2112572456428516
Energy: 1.2929764407375917
Energy: 1.2112572456437176
Energy: 1.1853603591816488
Energy: 1.2904860065906765
Energy: 1.1853603591825153
Energy: 1.2904860065915427
Energy: 1.1853603591816488
Energy: 1.2904860065906765
Energy: 1.259735745399135
Energy: 1.3398190405521555
Energy: 1.259735745399135
Energy: 1.3398190405538877
Energy: 1.259735745399135
Energy: 1.3398190405530215
Energy: 1.27026506395913
Energy: 1.2075046715815516
Energy: 1.2702650639599964
Energy: 1.2075046715815516
Energy: 1.2702650639599964
Energy: 1.2075046715824178
Energy: 1.25256187065835
Energy: 1.2717590391348013
Energy: 1.25256187065835
Energy: 1.2717590391348013
Energy: 1.25256187065835
Energy: 1.2717590391330689
Energy: 1.2560195570731034
Energy: 1.2969221854533879
Energy: 1.2560195570739694
Energy: 1.2969221854542539
Energy: 1.2560195570739694
Energy: 1.2969221854542539
Energy: 1.4459843344533176
Energy: 1.2107026014510205
Energy: 1.445984334450719
Energy: 1.2107026014510205
Energy: 1.4459843344524514
Energy: 1.2107026014510205
Energy: 1.2254639935167713
Energy: 1.3412233714517132
Energy: 1.2254639935185039
Energy: 1.3412233714517132
Energy: 1.2254639935185039
Energy: 1.3412233714525794
Energy: 1.2233155594138025
Energy: 1.2378611044595265
Energy: 1.223315559414669
Energy: 1.2378611044586603
Energy: 1.2233155594138025
Energy: 1.2378611044586603
Energy: 1.294543417334041
Energy: 1.2183060670829948
Energy: 1.294543417334041
Energy: 1.2183060670829948
Energy: 1.294543417334041
Energy: 1.218306067083861

minimum gb energy = 1.1841390058136463 eV
minimum distance =  2.28240995543648 Angstroms
sigma value = 27


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

Energy: 1.4372678208739602
Energy: 1.283303169370565
Energy: 1.315663213273892
Energy: 1.2833031693472003
Energy: 1.4372678208666587
Energy: 1.2833031693727555
Energy: 1.2920896148117926
Energy: 1.1565366412256357
Energy: 1.2920896148154433
Energy: 1.1565366412292861
Energy: 1.2920896148154433
Energy: 1.1565366412263658
Energy: 1.2941760325720442
Energy: 1.15875207508532
Energy: 1.294176032569854
Energy: 1.1587520750860503
Energy: 1.2941760325713143
Energy: 1.15875207508532
Energy: 1.1670138876027931
Energy: 1.2751510231685945
Energy: 1.1670138876159357
Energy: 1.2751510231700547
Energy: 1.1670138876108247
Energy: 1.2751510231693248
Energy: 1.1513594496130914
Energy: 1.319204141598299
Energy: 1.1513594496152817
Energy: 1.3192041415953781
Energy: 1.151359449611631
Energy: 1.3192041415931879
Energy: 1.3041891832928658
Energy: 1.3248120007339579
Energy: 1.2878563070376934
Energy: 1.3248120007412596
Energy: 1.3041891832892147
Energy: 1.3248120007405293
Energy: 1.1596973309794198
Energy: 1.2693287660704824
Energy: 1.159697330973579
Energy: 1.2693287660734027
Energy: 1.159697330969231
Energy: 1.2693287660748631
Energy: 1.2140486214030917
Energy: 1.2923737177337562
Energy: 1.2140486214052821
Energy: 1.2923737177366437
Energy: 1.2140486214060122
Energy: 1.2923737177344865
Energy: 1.3093177070169342
Energy: 1.156421308697201
Energy: 1.3119072259439721
Energy: 1.156421308685519
Energy: 1.309317707025696
Energy: 1.1564213086891695
Energy: 1.317391920173743
Energy: 1.1486523242313287
Energy: 1.3161860450519052
Energy: 1.1486523242415507
Energy: 1.3173919201715525
Energy: 1.1486523242386302
Energy: 1.3433721999366697
Energy: 1.3170007407461348
Energy: 1.3403313912614867
Energy: 1.3170007407446744
Energy: 1.3433721999344794
Energy: 1.3170007407461348
Energy: 1.2678588502126371
Energy: 1.156708680737135
Energy: 1.2678588502162882
Energy: 1.1567086806838676
Energy: 1.2678588502155579
Energy: 1.1567086807291034
Energy: 1.3010727472479653
Energy: 1.2190012533586496
Energy: 1.3010727472421244
Energy: 1.2190012533564591
Energy: 1.301072747235553
Energy: 1.219001253354999
Energy: 1.1509896673743059
Energy: 1.319162488970341
Energy: 1.1509896673757662
Energy: 1.3191624889623095
Energy: 1.1509896673721152
Energy: 1.3191624889615794
Energy: 1.3114828639447735
Energy: 1.3234434179285746
Energy: 1.3006820256986649
Energy: 1.3234434179336856
Energy: 1.3114828639498848
Energy: 1.3234434179344157
Energy: 1.1545176875426693
Energy: 1.3205890240341815
Energy: 1.1545176875382883
Energy: 1.3205890240451337
Energy: 1.1545176875390182
Energy: 1.3205890240436735
Energy: 1.1937251692068098
Energy: 1.3402681222124366
Energy: 1.1937251692024289
Energy: 1.3402681222146269
Energy: 1.1937251692046194
Energy: 1.340268122213897
Energy: 1.2425311369829
Energy: 1.149867713485788
Energy: 1.2425311369770586
Energy: 1.149867713485788
Energy: 1.2425311369661065
Energy: 1.149867713485788
Energy: 1.340933317403671
Energy: 1.1571885308154508
Energy: 1.3009645749413978
Energy: 1.1571885308205616
Energy: 1.3409333174073221
Energy: 1.1571885308205616
Energy: 1.4372678208724998
Energy: 1.2833031697281696
Energy: 1.315663213334461
Energy: 1.2833031698514976
Energy: 1.4372678208703096
Energy: 1.2833031697777861
Energy: 1.2920896148125227
Energy: 1.1565366412292861
Energy: 1.2920896148161736
Energy: 1.156536641232937
Energy: 1.2920896148154433
Energy: 1.156536641233667
Energy: 1.2941760325786156
Energy: 1.1587520750823996
Energy: 1.2941760325800757
Energy: 1.1587520750823996
Energy: 1.2941760325742346
Energy: 1.1587520750823996
Energy: 1.1670138876027931
Energy: 1.2751510231700547
Energy: 1.1670138876115548
Energy: 1.275151023171515
Energy: 1.1670138876093645
Energy: 1.2751510231700547
Energy: 1.1513594496065198
Energy: 1.3192041415968385
Energy: 1.1513594496072501
Energy: 1.319204141594648
Energy: 1.1513594496072501
Energy: 1.3192041415968385
Energy: 1.3041891832914054
Energy: 1.3248120007354183
Energy: 1.2878563070362332
Energy: 1.3248120007412596
Energy: 1.3041891832892147
Energy: 1.3248120007397992

minimum gb energy = 1.1486523242313287 eV
minimum distance =  2.21996549891149 Angstroms
sigma value = 19


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

Energy: 1.2881784330856505
Energy: 1.295567676311387
Energy: 1.2881784330894321
Energy: 1.2955676763120174
Energy: 1.2881784330925834
Energy: 1.2955676763120174
Energy: 1.273723563363798
Energy: 1.2187956099993182
Energy: 1.27372356336566
Energy: 1.218795609998688
Energy: 1.2737235633650301
Energy: 1.2187956099999486
Energy: 1.2891991730857626
Energy: 1.1927878448463012
Energy: 1.2891991730889139
Energy: 1.1927878448463012
Energy: 1.2891991730851322
Energy: 1.1927878448469313
Energy: 1.2018203769198008
Energy: 1.2581997187938234
Energy: 1.201820376920431
Energy: 1.2581997187931933
Energy: 1.2018203769198008
Energy: 1.2581997187931933
Energy: 1.2103240593794964
Energy: 1.258977391738376
Energy: 1.2103240593807567
Energy: 1.2589773917390064
Energy: 1.210324059376975
Energy: 1.2589773917396365
Energy: 1.2757245516328015
Energy: 1.2246989273643512
Energy: 1.2757245516346922
Energy: 1.2246989273649813
Energy: 1.2757245516346922
Energy: 1.224698927363721
Energy: 1.1964249921254493
Energy: 1.2532033017052144
Energy: 1.1964249921248191
Energy: 1.2532033017045845
Energy: 1.1964249921248191
Energy: 1.253203301706475
Energy: 1.2156388277901429
Energy: 1.2565226649353376
Energy: 1.2156388277895127
Energy: 1.2565226649359678
Energy: 1.2156388277882524
Energy: 1.2565226649365981
Energy: 1.3251507940207967
Energy: 1.2064765791181242
Energy: 1.325150794021427
Energy: 1.2064765791168637
Energy: 1.3251507940207967
Energy: 1.2064765791162335
Energy: 1.2240025945800128
Energy: 1.2350649299917562
Energy: 1.224002594578122
Energy: 1.2350649299923864
Energy: 1.2240025945787523
Energy: 1.2350649299917562
Energy: 1.1983917645053668
Energy: 1.3044999150064636
Energy: 1.1983917645041062
Energy: 1.3044999149982703
Energy: 1.1983917645053668
Energy: 1.3044999150020518
Energy: 1.2924932913939804
Energy: 1.1978902270176939
Energy: 1.2924932913927198
Energy: 1.1978902270176939
Energy: 1.2924932913914595
Energy: 1.1978902270176939
Energy: 1.2037225358771317
Energy: 1.226670155171068
Energy: 1.2037225358740091
Energy: 1.2266701551704375
Energy: 1.2037225358752697
Energy: 1.2266701551704375
Energy: 1.2146678169160237
Energy: 1.2567997491989458
Energy: 1.2146678169160237
Energy: 1.2567997491989458
Energy: 1.2146678169153935
Energy: 1.2567997491976852
Energy: 1.288603614178952
Energy: 1.1975253629020621
Energy: 1.2886036141795825
Energy: 1.1975253629014317
Energy: 1.2886036141808428
Energy: 1.1975253629026923
Energy: 1.2697198831775853
Energy: 1.1925063417184478
Energy: 1.2697198831801064
Energy: 1.1925063417184478
Energy: 1.2697198831807368
Energy: 1.1925063417178177
Energy: 1.1982963928627184
Energy: 1.273464225669364
Energy: 1.1982963928614578
Energy: 1.2734642256706243
Energy: 1.1982963928627184
Energy: 1.2734642256687339
Energy: 1.267933937555692
Energy: 1.230126770967061
Energy: 1.2679339375550618
Energy: 1.2301267709664305
Energy: 1.2679339375544316
Energy: 1.230126770967061
Energy: 1.2647826484229032
Energy: 1.2238343068523427
Energy: 1.2647826484191216
Energy: 1.2238343068536033
Energy: 1.2647826484210123
Energy: 1.2238343068536033
Energy: 1.2076997930629716
Energy: 1.2756600480422924
Energy: 1.2076997930623412
Energy: 1.2756600480397713
Energy: 1.2076997930629716
Energy: 1.2756600480410318
Energy: 1.1814411101758444
Energy: 1.288236283700539
Energy: 1.1814411101758444
Energy: 1.2882362836961272
Energy: 1.1814411101764746
Energy: 1.2882362836973877
Energy: 1.3369340517374768
Energy: 1.1884639145071154
Energy: 1.3369340517374768
Energy: 1.1884639145077458
Energy: 1.3369340517374768
Energy: 1.1884639145064853
Energy: 1.2485093876208866
Energy: 1.2322632950928696
Energy: 1.2485093876208866
Energy: 1.2322632950884864
Energy: 1.248509387621517
Energy: 1.2322632950922392
Energy: 1.2521758678687418
Energy: 1.288929267344652
Energy: 1.2521758678681116
Energy: 1.2889292673427615
Energy: 1.2521758678700023
Energy: 1.2889292673440218
Energy: 1.3110228195426938
Energy: 1.186960400364152
Energy: 1.3110228195426938
Energy: 1.186960400364152
Energy: 1.311022819543324
Energy: 1.1869604003647822
Energy: 1.2409730123105234
Energy: 1.2238140661572894
Energy: 1.2409730123105234
Energy: 1.22381406615855
Energy: 1.240973012311784
Energy: 1.2238140661579195
Energy: 1.192083113578072
Energy: 1.2705201392905776
Energy: 1.1920831135774417
Energy: 1.2705201392893168
Energy: 1.192083113578072
Energy: 1.2705201392899472
Energy: 1.2800384775411342
Energy: 1.2305466630113395
Energy: 1.280038477543025
Energy: 1.2305466630081883
Energy: 1.2800384775398734
Energy: 1.2305466630081883
Energy: 1.2416955706647346
Energy: 1.2232897191885355
Energy: 1.2416955706659951
Energy: 1.223289719189796
Energy: 1.2416955706653647
Energy: 1.2232897191879053

minimum gb energy = 1.1814411101758444 eV
minimum distance =  2.2698002688514 Angstroms
sigma value = 101


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

Energy: 1.2428018218501755
Energy: 1.2084052086617791
Energy: 1.242801821843527
Energy: 1.2084052086628871
Energy: 1.2428018218529455
Energy: 1.2084052086540227
Energy: 1.2063735818562933
Energy: 1.1774347538842929
Energy: 1.2063735818607253
Energy: 1.186906157286031
Energy: 1.2063735818623877
Energy: 1.1869061572937876
Energy: 1.1882844180140162
Energy: 1.189249679321133
Energy: 1.1882844180140162
Energy: 1.189249679320579
Energy: 1.18828441801457
Energy: 1.189249679321687
Energy: 1.1742259458489264
Energy: 1.3039562223746728
Energy: 1.1742259458500344
Energy: 1.1827111967209067
Energy: 1.1742259458494804
Energy: 1.1827111967203525
Energy: 1.1826785941731501
Energy: 1.201065517447385
Energy: 1.182678594172596
Energy: 1.201065517447939
Energy: 1.1826785941759201
Energy: 1.201065517448493
Energy: 1.1762627140931807
Energy: 1.1894745092379462
Energy: 1.1762627140937347
Energy: 1.1894745092362842
Energy: 1.1762627140887485
Energy: 1.1894745092351762
Energy: 1.1785171719134855
Energy: 1.2431439288037909
Energy: 1.1785171719118235
Energy: 1.2431439288010206
Energy: 1.1785171719118235
Energy: 1.2431439287999126
Energy: 1.1598653027593389
Energy: 1.2789199823724917
Energy: 1.1598653027571229
Energy: 1.2146950484885062
Energy: 1.1598653027560146
Energy: 1.2146950484763177
Energy: 1.1752052454230524
Energy: 1.1831405231097403
Energy: 1.1752052454224982
Energy: 1.1831405231097403
Energy: 1.1752052454224982
Energy: 1.1831405231097403
Energy: 1.1816264051747027
Energy: 1.2122002262529474
Energy: 1.181626405181905
Energy: 1.2124386474564761
Energy: 1.1816264051724865
Energy: 1.2122002262579339
Energy: 1.1730545069387128
Energy: 1.358296378363965
Energy: 1.1730545069403748
Energy: 1.358296378365627
Energy: 1.1730545069387128
Energy: 1.3582963783667352
Energy: 1.2519873217553017
Energy: 1.1776251614227713
Energy: 1.2519873217597337
Energy: 1.1776251614205553
Energy: 1.251987321760842
Energy: 1.177625161423879
Energy: 1.2633693434439897
Energy: 1.1913190230017887
Energy: 1.2633693434456517
Energy: 1.1913190230012347
Energy: 1.2633693434445437
Energy: 1.1913190229995725
Energy: 1.2067979650461411
Energy: 1.2689919673157992
Energy: 1.2067979650472491
Energy: 1.247990318607425
Energy: 1.2067979650494653
Energy: 1.2479903186052093
Energy: 1.2074355650034712
Energy: 1.1903937164972884
Energy: 1.2074355650023632
Energy: 1.1903937164967346
Energy: 1.2074355650029174
Energy: 1.1903937164972884
Energy: 1.1880424328741581
Energy: 1.1844302986585182
Energy: 1.188042432875266
Energy: 1.1844302986596262
Energy: 1.1880424328708339
Energy: 1.184430298655748
Energy: 1.1610134800254825
Energy: 1.2473882128112612
Energy: 1.1610134800254825
Energy: 1.2473882128129232
Energy: 1.1610134800260365
Energy: 1.2473882128118152
Energy: 1.1776016005637024
Energy: 1.208633006877506
Energy: 1.1776016005642564
Energy: 1.2086330068708577
Energy: 1.1776016005642564
Energy: 1.2086330068708577
Energy: 1.1771810496060728
Energy: 1.18313749874916
Energy: 1.177181049612167
Energy: 1.18313749874916
Energy: 1.1771810496077348
Energy: 1.18313749874916
Energy: 1.1903849185683875
Energy: 1.1832296914880092
Energy: 1.1903849185683875
Energy: 1.183229691481915
Energy: 1.1903849185661715
Energy: 1.1832296914891172
Energy: 1.1535908127791057
Energy: 1.4005722591828342
Energy: 1.1535908127818757
Energy: 1.4005722591828342
Energy: 1.153590812783538
Energy: 1.4005722591828342
Energy: 1.248709251968753
Energy: 1.1874310867468991
Energy: 1.248709251963213
Energy: 1.1874310867468991
Energy: 1.2487092519571186
Energy: 1.1874310867452371
Energy: 1.2783252042707591
Energy: 1.1935326185886068
Energy: 1.2783252042702054
Energy: 1.1935326185897148
Energy: 1.2783252042713131
Energy: 1.1935326185886068
Energy: 1.1740347860632512
Energy: 1.2420501761214893
Energy: 1.1740347860632512
Energy: 1.242050176120935
Energy: 1.1740347860632512
Energy: 1.242050176120935
Energy: 1.2499034580736323
Energy: 1.2171866683778543
Energy: 1.2499034580747406
Energy: 1.2171866683773005
Energy: 1.2499034580786184
Energy: 1.2171866683778543
Energy: 1.2340595487495503
Energy: 1.1855319900614336
Energy: 1.2340595487489965
Energy: 1.1855319900614336
Energy: 1.2340595487484425
Energy: 1.1855319900586634
Energy: 1.21126301782807
Energy: 1.2464455540484318
Energy: 1.2112630178275163
Energy: 1.2464455540484318
Energy: 1.21126301782807
Energy: 1.2464455540473236
Energy: 1.2077820800599581
Energy: 1.199180440179428
Energy: 1.2077820800610664
Energy: 1.199180440182752
Energy: 1.207782080059404
Energy: 1.199180440181644
Energy: 1.2428177449116347
Energy: 1.1833918967787815
Energy: 1.2428177449110807
Energy: 1.1833918967782278
Energy: 1.2428177449116347
Energy: 1.1833918967776735
Energy: 1.1773387364016126
Energy: 1.2129809695404867
Energy: 1.1773387364010586
Energy: 1.2129809695343923
Energy: 1.1773387364016126
Energy: 1.2129809695377165
Energy: 1.1745861755800746
Energy: 1.2494420000608335
Energy: 1.1745861755795208
Energy: 1.2494420000602793
Energy: 1.1745861755800746
Energy: 1.2494420000602793
Energy: 1.274104093305659
Energy: 1.1913233853366547
Energy: 1.274104093303443
Energy: 1.1913233853349925
Energy: 1.2741040933028889
Energy: 1.1913233853372085
Energy: 1.274843032870078
Energy: 1.1932461001839192
Energy: 1.2748430328689697
Energy: 1.1932461001850272
Energy: 1.274843032870078
Energy: 1.1932461001839192

minimum gb energy = 1.1535908127791057 eV
minimum distance =  2.27650197483476 Angstroms
sigma value = 33


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

Energy: 0.7709245047804701
Energy: 1.0125094612569154
Energy: 0.018374808368114125
Energy: 1.012509461257376
Energy: 0.7709245047822603
Energy: 1.0125094612564551
Energy: 0.7721732692424961
Energy: 0.3520352226016276
Energy: 0.01870908601600493
Energy: 0.35203522260119297
Energy: 0.7721732692433656
Energy: 0.35203522260073256
Energy: 1.012784971779603
Energy: 0.3497038214443522
Energy: 0.018440901046393093
Energy: 0.3497038214416414
Energy: 0.018629718096080917
Energy: 0.3497038214434571
Energy: 0.7721732692393249
Energy: 0.3520352226034434
Energy: 0.01870908601692557
Energy: 0.35203522260029785
Energy: 0.7721732692429052
Energy: 0.35203522260119297

minimum gb energy = 0.018374808368114125 eV
minimum distance =  2.43257136409439 Angstroms
sigma value = 1