Model name: model_name=EAM_Dynamo_VailheFarkas_1997_CoAl__MO_284963179498_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049696564674378
cohesive_energy=3.3687229668997767
mass=26.981538
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: 0.010373311280600137
Energy: 0.1816753809876132
Energy: 0.010373311280378007
Energy: 0.1816753809876132
Energy: 0.010373311280128111
Energy: 0.1816753809876132
Energy: 0.18167538098786307
Energy: 0.31732125263345207
Energy: 0.18167538098786307
Energy: 0.3173212526339241
Energy: 0.1816753809876132
Energy: 0.31732125263345207
Energy: 0.010373311280128111
Energy: 0.18167538098786307
Energy: 0.010373311279878216
Energy: 0.18167538098786307
Energy: 0.010373311279878216
Energy: 0.18167538098808522
Energy: 0.18167538098786307
Energy: 0.3173212526339241
Energy: 0.18167538098786307
Energy: 0.3173212526337019
Energy: 0.18167538098786307
Energy: 0.3173212526339241
Energy: 0.010373311280128111
Energy: 0.18167538098786307
Energy: 0.010373311279878216
Energy: 0.1816753809876132
Energy: 0.01037331127962832
Energy: 0.1816753809876132
Energy: 0.18167538098786307
Energy: 0.3173212526337019
Energy: 0.18167538098786307
Energy: 0.3173212526337019
Energy: 0.1816753809876132
Energy: 0.3173212526337019

minimum gb energy = 0.01037331127962832 eV
minimum distance =  2.59168595889794 Angstroms
sigma value = 1


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

Energy: 0.38358502455234383
Energy: 0.3797743413942767
Energy: 0.38358502455174226
Energy: 0.3797743413942767
Energy: 0.38358502455174226
Energy: 0.37977434139487826
Energy: 0.3871497232095929
Energy: 0.359125428027788
Energy: 0.3871497232095929
Energy: 0.35912542802718644
Energy: 0.3871497232095929
Energy: 0.359125428027788
Energy: 0.37877666959062933
Energy: 0.3784194160009062
Energy: 0.3787766695918324
Energy: 0.3784194160009062
Energy: 0.3787766695900551
Energy: 0.37841941600030465
Energy: 0.4020206694891684
Energy: 0.36166810896196516
Energy: 0.4020206694879654
Energy: 0.36166810896196516
Energy: 0.4020206694879654
Energy: 0.36166810896196516
Energy: 0.36972905124358396
Energy: 0.3834299556852206
Energy: 0.3697290512429824
Energy: 0.3834299556852206
Energy: 0.3697290512429824
Energy: 0.3834299556852206
Energy: 0.37645148354214664
Energy: 0.3540734656708511
Energy: 0.37645148354214664
Energy: 0.35407346567024955
Energy: 0.37645148354274816
Energy: 0.35407346567024955
Energy: 0.36727236234349114
Energy: 0.37659989109378517
Energy: 0.36727236231822696
Energy: 0.37659989109378517
Energy: 0.36727236234649885
Energy: 0.37659989109378517
Energy: 0.36567200157554935
Energy: 0.39737400277377466
Energy: 0.3656720015761509
Energy: 0.39737400277377466
Energy: 0.3656720015761509
Energy: 0.39737400277377466
Energy: 0.37698090664624456
Energy: 0.37433297991387926
Energy: 0.37698090664564304
Energy: 0.37433297991387926
Energy: 0.3769809066474476
Energy: 0.37433297991387926
Energy: 0.350476232531876
Energy: 0.39580603396349306
Energy: 0.35047623253067295
Energy: 0.39580603396349306
Energy: 0.350476232531876
Energy: 0.39580603396349306
Energy: 0.3918619561416979
Energy: 0.35170615246141773
Energy: 0.3918619561422721
Energy: 0.35170615246141773
Energy: 0.3918619561422721
Energy: 0.35170615246141773
Energy: 0.35128757928855625
Energy: 0.3974593962295644
Energy: 0.35128757928795473
Energy: 0.39745939622896287
Energy: 0.35128757928795473
Energy: 0.39745939622896287
Energy: 0.38643697637801006
Energy: 0.3520395380381602
Energy: 0.38643697637801006
Energy: 0.35203953803876165
Energy: 0.38643697637801006
Energy: 0.3520395380381602
Energy: 0.3588263430960622
Energy: 0.3745092574682943
Energy: 0.3588263430960622
Energy: 0.37450925746769276
Energy: 0.3588263430960622
Energy: 0.37450925746769276
Energy: 0.4037137241196922
Energy: 0.3521869242949108
Energy: 0.40371372411909073
Energy: 0.35218692429551224
Energy: 0.40371372411909073
Energy: 0.3521869242961138
Energy: 0.40180363918794404
Energy: 0.383069378852541
Energy: 0.40180363918794404
Energy: 0.3830693788531425
Energy: 0.40180363918794404
Energy: 0.3830693788531425
Energy: 0.37265977402122263
Energy: 0.37419156609302984
Energy: 0.37265977402122263
Energy: 0.37419156609302984
Energy: 0.3726597740218241
Energy: 0.37419156609302984
Energy: 0.3737355583182127
Energy: 0.3691692265843151
Energy: 0.37373555831700966
Energy: 0.36916922658371354
Energy: 0.3737355583182127
Energy: 0.3691692265843151
Energy: 0.35394159921450097
Energy: 0.3706780041207517
Energy: 0.3539415992151025
Energy: 0.3706780041207517
Energy: 0.3539415992151025
Energy: 0.3706780041213532
Energy: 0.37767549710069737
Energy: 0.3539333682783813
Energy: 0.37767549710129894
Energy: 0.35393336827717825
Energy: 0.37767549710129894
Energy: 0.35393336827717825
Energy: 0.35478387718542265
Energy: 0.38460088876432585
Energy: 0.3547838771860242
Energy: 0.3846008887637243
Energy: 0.3547838771860242
Energy: 0.38460088876432585
Energy: 0.3783076066483408
Energy: 0.37413130605295003
Energy: 0.3783076066483408
Energy: 0.37413130605295003
Energy: 0.3783076066483408
Energy: 0.37413130605295003
Energy: 0.3518913448228972
Energy: 0.38717238880202304
Energy: 0.35189134482229567
Energy: 0.38717238880142146
Energy: 0.3518913448228972
Energy: 0.38717238880202304

minimum gb energy = 0.35047623253067295 eV
minimum distance =  2.62688919284307 Angstroms
sigma value = 33


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

Energy: 0.36832003545375824
Energy: 0.369474644014101
Energy: 0.36832003545444253
Energy: 0.36947464401444313
Energy: 0.36832003545512676
Energy: 0.36947464401444313
Energy: 0.3852316293399301
Energy: 0.35490913764237436
Energy: 0.3852316293392458
Energy: 0.35490913764237436
Energy: 0.38523162934129873
Energy: 0.35490913764237436
Energy: 0.3452464692464514
Energy: 0.3537444951944349
Energy: 0.345246469245425
Energy: 0.35374449519375056
Energy: 0.3452464692467936
Energy: 0.35374449522762325
Energy: 0.36650461791880184
Energy: 0.37202088216974877
Energy: 0.36650461791811756
Energy: 0.3720208821694067
Energy: 0.3665046179194861
Energy: 0.3720208821704331
Energy: 0.353262485963033
Energy: 0.3826876868433985
Energy: 0.3532624859633752
Energy: 0.3826876868433985
Energy: 0.35326248596234877
Energy: 0.3826876868433985
Energy: 0.3538197149242832
Energy: 0.34059735344124925
Energy: 0.3538197149246253
Energy: 0.34059735343885417
Energy: 0.3538197149229146
Energy: 0.34059735344090714
Energy: 0.37384667890650447
Energy: 0.36627496004358223
Energy: 0.3738466789071888
Energy: 0.36627496004358223
Energy: 0.3738466789061623
Energy: 0.36627496004358223
Energy: 0.3418894231636347
Energy: 0.3678793655968425
Energy: 0.34188942316534543
Energy: 0.3678793655978689
Energy: 0.34188942316397686
Energy: 0.3678793655978689
Energy: 0.36891442542173397
Energy: 0.34181993692464063
Energy: 0.3689144254213918
Energy: 0.3418199369249828
Energy: 0.3689144254193389
Energy: 0.3418199369249828
Energy: 0.34722442922254776
Energy: 0.3783121869731656
Energy: 0.3472244292222056
Energy: 0.3783121869728234
Energy: 0.3472244292222056
Energy: 0.3783121869731656
Energy: 0.38112831786424023
Energy: 0.34338061169872824
Energy: 0.38112831786321383
Energy: 0.34338061169872824
Energy: 0.38112831786389817
Energy: 0.34338061169872824
Energy: 0.340156807417058
Energy: 0.364938062062621
Energy: 0.3401568074177423
Energy: 0.36493806206501606
Energy: 0.34015680741842663
Energy: 0.36493806206467383
Energy: 0.36751528135430683
Energy: 0.343566736564862
Energy: 0.3675152813536225
Energy: 0.343566736564862
Energy: 0.3675152813529382
Energy: 0.34356673656520414
Energy: 0.3663771829794611
Energy: 0.37115166861117493
Energy: 0.3663771829798032
Energy: 0.3711516686118593
Energy: 0.3663771829791189
Energy: 0.37115166861117493
Energy: 0.3678948836538787
Energy: 0.35314960182758465
Energy: 0.3678948836583266
Energy: 0.3531496018279268
Energy: 0.36789488365422085
Energy: 0.3531496018279268
Energy: 0.34160496058955986
Energy: 0.3562083632245651
Energy: 0.3416049605878491
Energy: 0.35620836322490734
Energy: 0.34160496058955986
Energy: 0.3562083632245651
Energy: 0.3695955843836827
Energy: 0.36774283781515843
Energy: 0.36959558438265616
Energy: 0.36774283781515843
Energy: 0.36959558438265616
Energy: 0.36774283781584277
Energy: 0.3532019273000529
Energy: 0.3404735858914989
Energy: 0.35320192729936856
Energy: 0.34047358589286747
Energy: 0.3532019272959471
Energy: 0.34047358589286747
Energy: 0.35289183007503844
Energy: 0.36666097289745464
Energy: 0.35289183007469627
Energy: 0.3666609728871902
Energy: 0.35289183007435415
Energy: 0.36666097289437527
Energy: 0.37025068754967966
Energy: 0.3674644440152604
Energy: 0.37025068754933754
Energy: 0.36746444401491823
Energy: 0.37025068755002183
Energy: 0.36746444401457606
Energy: 0.3405958512079047
Energy: 0.3966559779054047
Energy: 0.3405958512068783
Energy: 0.3966559779057468
Energy: 0.34059585120585184
Energy: 0.3966559779057468
Energy: 0.3534894662957418
Energy: 0.34164393852453345
Energy: 0.35348946630190053
Energy: 0.3416439385241913
Energy: 0.3534894663012162
Energy: 0.34164393852453345
Energy: 0.3417440862541213
Energy: 0.38082671458776335
Energy: 0.3417440862541213
Energy: 0.38082671458875866
Energy: 0.3417440862548056
Energy: 0.38082671458875866
Energy: 0.3760974713565191
Energy: 0.3522540050938239
Energy: 0.37609747135788774
Energy: 0.3522540050934817
Energy: 0.3760974713575456
Energy: 0.3522540050938239
Energy: 0.34534317179213
Energy: 0.38097402640061606
Energy: 0.34534317179076135
Energy: 0.38097402640027395
Energy: 0.34534317179076135
Energy: 0.38097402640061606
Energy: 0.36624401544914664
Energy: 0.3749254035339661
Energy: 0.36624401545017315
Energy: 0.37492540353259746
Energy: 0.36624401545051527
Energy: 0.37492540353362386
Energy: 0.36634517609735745
Energy: 0.37485452392652396
Energy: 0.3663451760966731
Energy: 0.3748545239221071
Energy: 0.3663451760976996
Energy: 0.3748545239207386
Energy: 0.34533500333606754
Energy: 0.38090490531394394
Energy: 0.3453350033367518
Energy: 0.38090490531394394
Energy: 0.34533500333606754
Energy: 0.38090490531394394
Energy: 0.37617877437048486
Energy: 0.35233192693617943
Energy: 0.37617877437082703
Energy: 0.35233192693617943
Energy: 0.37617877437048486
Energy: 0.35233192693617943
Energy: 0.34174337734085586
Energy: 0.38087110041912486
Energy: 0.3417433773418823
Energy: 0.3808711004177563
Energy: 0.3417433773411981
Energy: 0.38087110041707195
Energy: 0.3536665652782242
Energy: 0.3416456221457586
Energy: 0.3536665652860936
Energy: 0.3416456221457586
Energy: 0.35366656529088375
Energy: 0.3416456221457586
Energy: 0.34062592167478306
Energy: 0.3990409643489108
Energy: 0.3406259216758095
Energy: 0.3990409643489108
Energy: 0.34062592167478306
Energy: 0.3990409643489108
Energy: 0.3702759885193273
Energy: 0.3675266505020353
Energy: 0.37027598851898513
Energy: 0.3675266505023774
Energy: 0.3702759885193273
Energy: 0.36752665050169314
Energy: 0.3527625908845651
Energy: 0.36668462115071426
Energy: 0.3527625908849073
Energy: 0.36668462115139855
Energy: 0.35276259088422296
Energy: 0.36668462115310924
Energy: 0.3532443036678833
Energy: 0.3404494551247062
Energy: 0.35324430366856757
Energy: 0.3404494551257326
Energy: 0.3532443036678833
Energy: 0.3404494551305227
Energy: 0.3705235001664739
Energy: 0.36773461821358666
Energy: 0.3705235001661317
Energy: 0.36773461821358666
Energy: 0.3705235001664739
Energy: 0.36773461821358666
Energy: 0.34168231396860516
Energy: 0.3561971183374018
Energy: 0.3416823139710002
Energy: 0.3561971183374018
Energy: 0.3416823139603936
Energy: 0.3561971183374018
Energy: 0.36786438706146285
Energy: 0.3531974972094024
Energy: 0.3678643870611206
Energy: 0.3531974972104289
Energy: 0.3678643870638578
Energy: 0.3531974972097446
Energy: 0.36639821742633333
Energy: 0.3713730357198556
Energy: 0.36639821742872836
Energy: 0.3713730357195134
Energy: 0.36639821742838624
Energy: 0.3713730357195134
Energy: 0.36738783479256876
Energy: 0.343574855664383
Energy: 0.36738783479256876
Energy: 0.3435748556647251
Energy: 0.3673878347929109
Energy: 0.34357485566404083
Energy: 0.3401284167550539
Energy: 0.3650685365679436
Energy: 0.34012841675402744
Energy: 0.3650685365669172
Energy: 0.3401284167547118
Energy: 0.36506853656349564

minimum gb energy = 0.34012841675402744 eV
minimum distance =  2.69801012632159 Angstroms
sigma value = 51


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

Energy: 0.3755860448519645
Energy: 0.36977061549905876
Energy: 0.37558604485275726
Energy: 0.36977061549905876
Energy: 0.3755860448519645
Energy: 0.36977061549905876
Energy: 0.3862421205437891
Energy: 0.35616965729138417
Energy: 0.3862421205445818
Energy: 0.35616965729138417
Energy: 0.3862421205437891
Energy: 0.35616965729138417
Energy: 0.3602210579530826
Energy: 0.37211568575077475
Energy: 0.3602210579538753
Energy: 0.372115685749982
Energy: 0.3602210579530826
Energy: 0.3721156857491893
Energy: 0.36425500610227346
Energy: 0.34916993549753234
Energy: 0.36425500610227346
Energy: 0.3491699354967396
Energy: 0.36425500610227346
Energy: 0.3491699354967396
Energy: 0.3752099835328964
Energy: 0.3609618876910153
Energy: 0.3752099835328964
Energy: 0.3609618876910153
Energy: 0.3752099835328964
Energy: 0.3609618876918081
Energy: 0.39083241625447535
Energy: 0.3684760490020617
Energy: 0.39083241625368265
Energy: 0.3684760490020617
Energy: 0.39083241625447535
Energy: 0.3684760490020617
Energy: 0.36763976991021646
Energy: 0.3633724953291583
Energy: 0.36763976991021646
Energy: 0.3633724953291583
Energy: 0.36763976991021646
Energy: 0.3633724953291583
Energy: 0.3503397736701017
Energy: 0.36085100817555343
Energy: 0.3503397736701017
Energy: 0.36085100817555343
Energy: 0.3503397736701017
Energy: 0.36085100817555343
Energy: 0.39206304153067073
Energy: 0.3473630590547597
Energy: 0.39206304152908517
Energy: 0.3473630590547597
Energy: 0.39206304152908517
Energy: 0.3473630590547597
Energy: 0.35573553009210235
Energy: 0.3888719744256643
Energy: 0.35573553009210235
Energy: 0.38887197442249327
Energy: 0.35573553009210235
Energy: 0.3888719744256643
Energy: 0.3988155927025876
Energy: 0.3461637830845478
Energy: 0.3988155927033803
Energy: 0.3461637830845478
Energy: 0.3988155927033803
Energy: 0.3461637830845478
Energy: 0.3760626750486685
Energy: 0.3703618554206337
Energy: 0.3760626750486685
Energy: 0.3703618554206337
Energy: 0.3760626750486685
Energy: 0.3703618554198409
Energy: 0.3877143751664374
Energy: 0.35454527635580885
Energy: 0.3877143751664374
Energy: 0.3545452763566016
Energy: 0.387714375168023
Energy: 0.35454527635580885
Energy: 0.3641883228877922
Energy: 0.3523352606884997
Energy: 0.3641883228869995
Energy: 0.3523352606884997
Energy: 0.3641883228877922
Energy: 0.3523352606884997
Energy: 0.37132241713154845
Energy: 0.3666727718435982
Energy: 0.37132241713154845
Energy: 0.36667277184280556
Energy: 0.37132241713154845
Energy: 0.36667277184280556
Energy: 0.37801518678642504
Energy: 0.36870057771870324
Energy: 0.37801518678721785
Energy: 0.36870057771870324
Energy: 0.37801518678642504
Energy: 0.36870057771870324
Energy: 0.3746613740329601
Energy: 0.38873123020384065
Energy: 0.3746613740242398
Energy: 0.38873123020384065
Energy: 0.3746613740329601
Energy: 0.38873123020384065
Energy: 0.36673384751398086
Energy: 0.3600836138584361
Energy: 0.36673384751398086
Energy: 0.3600836138584361
Energy: 0.36673384751398086
Energy: 0.3600836138584361

minimum gb energy = 0.3461637830845478 eV
minimum distance =  2.57879383744758 Angstroms
sigma value = 19


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

Energy: 0.31360531368718614
Energy: 0.3249007997103624
Energy: 0.31360531368718614
Energy: 0.3249007997103624
Energy: 0.31360531368718614
Energy: 0.3249007997103624
Energy: 0.3419942638567666
Energy: 0.3609281924539205
Energy: 0.34199426385958803
Energy: 0.3609281924539205
Energy: 0.3419942638567666
Energy: 0.3609281924539205
Energy: 0.31177093915873594
Energy: 0.3588651613425726
Energy: 0.31177093915920623
Energy: 0.3588651613425726
Energy: 0.31177093915873594
Energy: 0.35886516134163216
Energy: 0.33137009079884194
Energy: 0.31324255514305815
Energy: 0.3313700907983717
Energy: 0.31324255514305815
Energy: 0.3313700907979014
Energy: 0.31324255514305815
Energy: 0.3112476873182359
Energy: 0.31345820042205624
Energy: 0.31124768731870617
Energy: 0.3134582004225265
Energy: 0.31124768731870617
Energy: 0.31345820042205624
Energy: 0.31133753921860485
Energy: 0.3135218707662266
Energy: 0.3113375392176644
Energy: 0.3135218707662266
Energy: 0.3113375392181346
Energy: 0.3135218707662266
Energy: 0.3313810698555346
Energy: 0.3115474000193565
Energy: 0.33138106985600485
Energy: 0.3115474000198267
Energy: 0.33138106985600485
Energy: 0.3115474000193565
Energy: 0.3116571018872519
Energy: 0.35875235406727735
Energy: 0.3116571018872519
Energy: 0.3587523540677476
Energy: 0.3116571018872519
Energy: 0.3587523540682178
Energy: 0.3420709748673895
Energy: 0.36099805818277164
Energy: 0.34207097486268717
Energy: 0.36099805818277164
Energy: 0.34207097486268717
Energy: 0.36099805818277164
Energy: 0.31360531368718614
Energy: 0.3249007997103624
Energy: 0.3136053136867159
Energy: 0.32490079970989216
Energy: 0.31360531368718614
Energy: 0.3249007997103624
Energy: 0.3419942638586476
Energy: 0.3609281924539205
Energy: 0.3419942638591178
Energy: 0.3609281924539205
Energy: 0.3419942638577071
Energy: 0.3609281924539205
Energy: 0.31177093915920623
Energy: 0.3588651613425726
Energy: 0.31177093915920623
Energy: 0.3588651613421024
Energy: 0.31177093915920623
Energy: 0.3588651613421024
Energy: 0.3313700907974312
Energy: 0.31324255514305815
Energy: 0.33137009079884194
Energy: 0.31324255514305815
Energy: 0.33137009079884194
Energy: 0.31324255514305815
Energy: 0.31124768731870617
Energy: 0.3134582004211158
Energy: 0.3112476873172954
Energy: 0.31345820042205624
Energy: 0.3112476873177657
Energy: 0.31345820043428246
Energy: 0.31133753921860485
Energy: 0.3135218707676374
Energy: 0.3113375392181346
Energy: 0.3135218707676374
Energy: 0.3113375392181346
Energy: 0.3135218707671671
Energy: 0.33138106985459415
Energy: 0.3115474000193565
Energy: 0.3313810698555346
Energy: 0.3115474000193565
Energy: 0.3313810698555346
Energy: 0.31154740001888626
Energy: 0.3116571018877221
Energy: 0.3587523540597535
Energy: 0.3116571018872519
Energy: 0.3587523540691583
Energy: 0.3116571018872519
Energy: 0.35875235406351547
Energy: 0.3420709748673895
Energy: 0.36099805818277164
Energy: 0.34207097486362764
Energy: 0.36099805818277164
Energy: 0.3420709748833776
Energy: 0.36099805818277164
Energy: 0.31360531368718614
Energy: 0.32490079971083263
Energy: 0.3136053136876564
Energy: 0.32490079971130287
Energy: 0.3136053136876564
Energy: 0.3249007997103624
Energy: 0.3419942638577071
Energy: 0.3609281924539205
Energy: 0.3419942638577071
Energy: 0.3609281924539205
Energy: 0.3419942638567666
Energy: 0.3609281924539205
Energy: 0.3117709391596764
Energy: 0.3588651613411619
Energy: 0.3117709391596764
Energy: 0.3588651613411619
Energy: 0.3117709391596764
Energy: 0.35886516134163216
Energy: 0.3313700907979014
Energy: 0.31324255514305815
Energy: 0.3313700907983717
Energy: 0.31324255514305815
Energy: 0.33137009079884194
Energy: 0.31324255514305815
Energy: 0.3112476873177657
Energy: 0.3134582004201753
Energy: 0.3112476873177657
Energy: 0.3134582004239372
Energy: 0.3112476873177657
Energy: 0.313458200421586
Energy: 0.3113375392181346
Energy: 0.31352187076810756
Energy: 0.3113375392181346
Energy: 0.31352187076810756
Energy: 0.31133753921860485
Energy: 0.3135218707676374
Energy: 0.33138106985506444
Energy: 0.31154740001888626
Energy: 0.33138106985600485
Energy: 0.3115474000193565
Energy: 0.33138106985600485
Energy: 0.3115474000193565
Energy: 0.3116571018872519
Energy: 0.35875235405881306
Energy: 0.3116571018872519
Energy: 0.3587523540710393
Energy: 0.3116571018872519
Energy: 0.35875235406022377
Energy: 0.34207097487209187
Energy: 0.36099805818277164
Energy: 0.3420709748659788
Energy: 0.36099805818277164
Energy: 0.34207097486315735
Energy: 0.36099805818277164
Energy: 0.31360531368718614
Energy: 0.32490079971083263
Energy: 0.31360531368718614
Energy: 0.32490079970989216
Energy: 0.31360531368718614
Energy: 0.32490079970989216
Energy: 0.3419942638591178
Energy: 0.3609281924539205
Energy: 0.3419942638586476
Energy: 0.3609281924539205
Energy: 0.3419942638567666
Energy: 0.3609281924539205
Energy: 0.3117709391596764
Energy: 0.3588651613425726
Energy: 0.3117709391596764
Energy: 0.3588651613425726
Energy: 0.3117709391601467
Energy: 0.3588651613421024

minimum gb energy = 0.3112476873172954 eV
minimum distance =  2.63354183709385 Angstroms
sigma value = 27


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

Energy: 0.31459424195191754
Energy: 0.3022247347858248
Energy: 0.31459424195191754
Energy: 0.30222473478467293
Energy: 0.31459424195191754
Energy: 0.3022247347858248
Energy: 0.35772919454819774
Energy: 0.2981689366428311
Energy: 0.35772919452631274
Energy: 0.2981689366428311
Energy: 0.3577291945412867
Energy: 0.2981689366428311
Energy: 0.30844358330202704
Energy: 0.35016764688525825
Energy: 0.30844358330087523
Energy: 0.3501676468887139
Energy: 0.30844358330202704
Energy: 0.3501676468887139
Energy: 0.3172184630260052
Energy: 0.2980823912419688
Energy: 0.31721846302485335
Energy: 0.2980823912419688
Energy: 0.3172184630225497
Energy: 0.2980823912419688
Energy: 0.36203638818193923
Energy: 0.2939516133389903
Energy: 0.36203638818193923
Energy: 0.2939516133389903
Energy: 0.36203638818193923
Energy: 0.2939516133389903
Energy: 0.33755941175372894
Energy: 0.3552322101053508
Energy: 0.33755941175372894
Energy: 0.3552322101053508
Energy: 0.33755941175257714
Energy: 0.3552322101053508
Energy: 0.3321857163173297
Energy: 0.31489370494267255
Energy: 0.3321857163173297
Energy: 0.31489370494267255
Energy: 0.3321857163173297
Energy: 0.31489370494267255
Energy: 0.31913463360145167
Energy: 0.30439888192512193
Energy: 0.31913463360145167
Energy: 0.30439888192512193
Energy: 0.31913463360145167
Energy: 0.30439888192397013
Energy: 0.3324055807917384
Energy: 0.30882930951986864
Energy: 0.3324055807894347
Energy: 0.30882930951986864
Energy: 0.3324055807928902
Energy: 0.3088293095187168
Energy: 0.3302775452430644
Energy: 0.366246820254531
Energy: 0.33027754524421626
Energy: 0.366246820254531
Energy: 0.33027754524421626
Energy: 0.366246820254531
Energy: 0.30263688823555224
Energy: 0.29386967888180626
Energy: 0.3562350181247015
Energy: 0.29386967888180626
Energy: 0.3562350181258534
Energy: 0.29386967888180626
Energy: 0.35254619431275425
Energy: 0.3315751834955658
Energy: 0.35254619431275425
Energy: 0.3315751834944139
Energy: 0.35254619431275425
Energy: 0.3315751834944139

minimum gb energy = 0.29386967888180626 eV
minimum distance =  2.58234243861289 Angstroms
sigma value = 9


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

Energy: 0.3073420741696189
Energy: 0.30328057178767026
Energy: 0.30734207416767706
Energy: 0.3032805717844339
Energy: 0.30734207416864795
Energy: 0.3032805717786084
Energy: 0.33268416712223503
Energy: 0.3011533866811592
Energy: 0.33268416721153016
Energy: 0.3011533866805119
Energy: 0.3326841670814858
Energy: 0.29000206830239567
Energy: 0.28027053168152394
Energy: 0.3146529479866578
Energy: 0.2802705316821712
Energy: 0.3146529479759777
Energy: 0.28027053168184757
Energy: 0.3146529479824505
Energy: 0.28647619967084775
Energy: 0.2805707689253822
Energy: 0.2864761996705241
Energy: 0.2805707689257058
Energy: 0.28647619967149507
Energy: 0.2805707689257058
Energy: 0.29735939073240797
Energy: 0.2881179656365694
Energy: 0.2973593907327316
Energy: 0.28811796563721664
Energy: 0.29735939073305523
Energy: 0.2881179656349512
Energy: 0.307853017684962
Energy: 0.30871217188883754
Energy: 0.307853017684962
Energy: 0.30871217188689576
Energy: 0.307853017684962
Energy: 0.2969576938836962
Energy: 0.28761898952271087
Energy: 0.3090396999367742
Energy: 0.2876189895210927
Energy: 0.30903969993709784
Energy: 0.2876189895230345
Energy: 0.30903969993709784
Energy: 0.26804419379167527
Energy: 0.3329614095385952
Energy: 0.2680441937923225
Energy: 0.3329614095382716
Energy: 0.26804419379135164
Energy: 0.3329614095385952
Energy: 0.27283756390784303
Energy: 0.2873684333726694
Energy: 0.27283756391010844
Energy: 0.28736843336975665
Energy: 0.2728375639065484
Energy: 0.2873684333713748
Energy: 0.29037156992247426
Energy: 0.28938647865660305
Energy: 0.29037156992247426
Energy: 0.289386478605468
Energy: 0.29037156992247426
Energy: 0.28938647869120304
Energy: 0.28975728030127995
Energy: 0.27865448124552106
Energy: 0.2897572803016036
Energy: 0.27865448124552106
Energy: 0.28975728030127995
Energy: 0.27865448124552106
Energy: 0.2832538960608268
Energy: 0.29946398762438525
Energy: 0.28325389605920853
Energy: 0.2994639876247089
Energy: 0.28325389605985585
Energy: 0.29946398762438525
Energy: 0.29962913102312266
Energy: 0.29150986286384806
Energy: 0.29962913069250996
Energy: 0.2915098628635244
Energy: 0.2996291462737016
Energy: 0.2915098628635244
Energy: 0.31202436184894383
Energy: 0.28431281248961443
Energy: 0.312024361847973
Energy: 0.2843128124847598
Energy: 0.31202436184862026
Energy: 0.28431281248508344
Energy: 0.27980653797028693
Energy: 0.29823215349710736
Energy: 0.27980653797093424
Energy: 0.29823215349840193
Energy: 0.2798065379712579
Energy: 0.2982321534980783
Energy: 0.30178731230863437
Energy: 0.30207162211772326
Energy: 0.30178731230992895
Energy: 0.302071622117076
Energy: 0.3017873123096053
Energy: 0.3020716221183706
Energy: 0.32111956801413555
Energy: 0.32129175755436024
Energy: 0.3211195680138119
Energy: 0.32129175755500755
Energy: 0.3211195680144592
Energy: 0.32129175755530176
Energy: 0.2865336402782319
Energy: 0.2865558453026945
Energy: 0.28653364027920286
Energy: 0.2865558453026945
Energy: 0.2865336402785556
Energy: 0.28655584530237094
Energy: 0.2707456458539472
Energy: 0.3021107596165674
Energy: 0.27074564585556543
Energy: 0.30211076943659004
Energy: 0.2707456458539472
Energy: 0.30211076033569484
Energy: 0.3727256622544349
Energy: 0.2887183813678236
Energy: 0.372725662253464
Energy: 0.28871838136749994
Energy: 0.37272566225475856
Energy: 0.28871838136620537
Energy: 0.2707694089341376
Energy: 0.3038615810827221
Energy: 0.27076940893381396
Energy: 0.30386158107886785
Energy: 0.2707694089344613
Energy: 0.30386158108045663
Energy: 0.28657168905453734
Energy: 0.2866011974703505
Energy: 0.28657168905453734
Energy: 0.28660119747099777
Energy: 0.2865716890542137
Energy: 0.28660119747099777
Energy: 0.3220034063997707
Energy: 0.32103245578435535
Energy: 0.32200340639782893
Energy: 0.3210324557850026
Energy: 0.32200340639588704
Energy: 0.3210324557850026
Energy: 0.3018246076475311
Energy: 0.3066265299518096
Energy: 0.3018246076455893
Energy: 0.306626529950515
Energy: 0.3018246076472075
Energy: 0.30662652995083867
Energy: 0.2796529318301698
Energy: 0.29817226185138995
Energy: 0.27965293182887524
Energy: 0.29817226185074264
Energy: 0.2796529318301698
Energy: 0.2981722618510663
Energy: 0.3122903367844336
Energy: 0.324298544262596
Energy: 0.3122903367854045
Energy: 0.32429854426291965
Energy: 0.3122903367844336
Energy: 0.324298544262596
Energy: 0.3007539686932881
Energy: 0.2916557865387107
Energy: 0.30075396876251753
Energy: 0.2916557865387107
Energy: 0.30075396869393534
Energy: 0.29165578653903435
Energy: 0.28323608539635076
Energy: 0.298649821830775
Energy: 0.2832360853957035
Energy: 0.2986498218310986
Energy: 0.2832360853957035
Energy: 0.298649821830775
Energy: 0.28996404766220696
Energy: 0.2787454417026355
Energy: 0.28996404766188333
Energy: 0.2787454417029591
Energy: 0.28996404766220696
Energy: 0.2787454417026355
Energy: 0.29029338572975694
Energy: 0.3545722691252962
Energy: 0.2902933857291097
Energy: 0.35457226912561984
Energy: 0.2902933857291097
Energy: 0.3545722691252962
Energy: 0.2728033216750504
Energy: 0.287648880650756
Energy: 0.2728033216815232
Energy: 0.28764888065205046
Energy: 0.2728033216811996
Energy: 0.2876488806514032
Energy: 0.2680306357393562
Energy: 0.3328728637087011
Energy: 0.2680306357406508
Energy: 0.3328728637083775
Energy: 0.2680306357400035
Energy: 0.3328728637083775
Energy: 0.2877648311906887
Energy: 0.3090523946180484
Energy: 0.28776483118971774
Energy: 0.3090523946183721
Energy: 0.28776483119586693
Energy: 0.3090523946180484
Energy: 0.3079344349559616
Energy: 0.29679889985464025
Energy: 0.30793443495563794
Energy: 0.29679889985464025
Energy: 0.30793443495628525
Energy: 0.29679889985464025
Energy: 0.2972027622276911
Energy: 0.288012477848974
Energy: 0.2972027622263965
Energy: 0.28801247783379236
Energy: 0.2972027622260729
Energy: 0.28801247782473044
Energy: 0.2864841798022373
Energy: 0.28055206713069664
Energy: 0.2864841798028846
Energy: 0.28055206713102027
Energy: 0.2864841798035319
Energy: 0.28055206713102027
Energy: 0.27463365736636347
Energy: 0.31523591487604985
Energy: 0.2746336573666871
Energy: 0.31523591468454343
Energy: 0.27463365737057077
Energy: 0.31523591470816914
Energy: 0.3327867613525921
Energy: 0.2622482048900826
Energy: 0.3327867613542103
Energy: 0.26224820489105355
Energy: 0.3327867613606831
Energy: 0.2622482048900826
Energy: 0.30734207416864795
Energy: 0.3032805717818448
Energy: 0.3073420741673534
Energy: 0.30328057178249207
Energy: 0.30734207416864795
Energy: 0.30328057178378665
Energy: 0.33268416766895076
Energy: 0.2785870779931218
Energy: 0.33268416766441977
Energy: 0.2785870779927982
Energy: 0.33268416772814735
Energy: 0.2785870779927982
Energy: 0.28027053168152394
Energy: 0.3146529479814796
Energy: 0.280270531680553
Energy: 0.3146529479850396
Energy: 0.28027053168184757
Energy: 0.3146529479769486
Energy: 0.28647619967214233
Energy: 0.2805707689257058
Energy: 0.28647619967214233
Energy: 0.2805707689257058
Energy: 0.28647619967149507
Energy: 0.2805707689257058
Energy: 0.297359390731437
Energy: 0.28811796563980574
Energy: 0.2973593907320843
Energy: 0.2881179656375403
Energy: 0.297359390731437
Energy: 0.28811796563980574

minimum gb energy = 0.2622482048900826 eV
minimum distance =  2.67608158560486 Angstroms
sigma value = 57


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

Energy: 0.11197347428240688
Energy: 0.11641475588466774
Energy: 0.11197347428240688
Energy: 0.11641475588466774
Energy: 0.11197347428314362
Energy: 0.11641475588466774
Energy: 0.18369310645165504
Energy: 0.18611971518541862
Energy: 0.18369310645165504
Energy: 0.18611971518615533
Energy: 0.18369310645239173
Energy: 0.18611971518394516
Energy: 0.13999075201716832
Energy: 0.16339019943284475
Energy: 0.13999075201790503
Energy: 0.16339019943284475
Energy: 0.13999075201790503
Energy: 0.16339019943284475
Energy: 0.11810618637014071
Energy: 0.11220257244834629
Energy: 0.11810618637014071
Energy: 0.11220257244834629
Energy: 0.11810618637014071
Energy: 0.11220257244834629
Energy: 0.18367213223364243
Energy: 0.18112850781583023
Energy: 0.18367213223364243
Energy: 0.18112850781583023
Energy: 0.18367213223364243
Energy: 0.18112850781656695
Energy: 0.11233096264437112
Energy: 0.14223500870883063
Energy: 0.11233096264363442
Energy: 0.14223500871030406
Energy: 0.11233096264363442
Energy: 0.14223500870956732
Energy: 0.11224403949208896
Energy: 0.14232586588925789
Energy: 0.11224403949208896
Energy: 0.14232586588999457
Energy: 0.11224403949282569
Energy: 0.14232586588999457
Energy: 0.18363590607146302
Energy: 0.18106967930251536
Energy: 0.18363590607146302
Energy: 0.18106967930251536
Energy: 0.18363590607146302
Energy: 0.18106967930251536
Energy: 0.1180769681403407
Energy: 0.11214987968653016
Energy: 0.1180769681403407
Energy: 0.11214987968653016
Energy: 0.118076968139604
Energy: 0.11214987968653016
Energy: 0.14002270371863543
Energy: 0.1633549605484139
Energy: 0.14002270371863543
Energy: 0.1633549605484139
Energy: 0.14002270371863543
Energy: 0.1633549605484139
Energy: 0.18366729792675954
Energy: 0.18602054264106896
Energy: 0.18366729792675954
Energy: 0.1860205426425424
Energy: 0.18366729792749628
Energy: 0.18602054264033224
Energy: 0.11197347428240688
Energy: 0.11641475588466774
Energy: 0.11197347428240688
Energy: 0.11641475588466774
Energy: 0.11197347428240688
Energy: 0.11641475588466774
Energy: 0.18369310645239173
Energy: 0.18611971518615533
Energy: 0.18369310645239173
Energy: 0.18611971518762876
Energy: 0.18369310645091833
Energy: 0.18611971518689205
Energy: 0.13999075201790503
Energy: 0.16339019943284475
Energy: 0.13999075201790503
Energy: 0.16339019943284475
Energy: 0.13999075201864175
Energy: 0.16339019943284475
Energy: 0.11810618637014071
Energy: 0.11220257244834629
Energy: 0.11810618637014071
Energy: 0.11220257244834629
Energy: 0.11810618636940401
Energy: 0.11220257244908301
Energy: 0.18367213223364243
Energy: 0.18112850781583023
Energy: 0.18367213223290568
Energy: 0.18112850781583023
Energy: 0.18367213223364243
Energy: 0.18112850781583023
Energy: 0.11233096264363442
Energy: 0.14223500870956732
Energy: 0.11233096264363442
Energy: 0.14223500871030406
Energy: 0.11233096264363442
Energy: 0.14223500871030406
Energy: 0.11224403949282569
Energy: 0.14232586588925789
Energy: 0.11224403949208896
Energy: 0.14232586588999457
Energy: 0.11224403949208896
Energy: 0.14232586588925789
Energy: 0.18363590607146302
Energy: 0.18106967930177864
Energy: 0.1836359060707263
Energy: 0.18106967930251536
Energy: 0.18363590607219976
Energy: 0.18106967930251536

minimum gb energy = 0.11197347428240688 eV
minimum distance =  2.74937175635455 Angstroms
sigma value = 11


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

Energy: 0.2609154699709384
Energy: 0.2535438883379174
Energy: 0.2609154699703988
Energy: 0.25354388832172753
Energy: 0.2609154699703988
Energy: 0.2535438883076963
Energy: 0.28703902106628415
Energy: 0.24414815101685047
Energy: 0.2870390210528417
Energy: 0.24414815101685047
Energy: 0.2870390211035209
Energy: 0.24414815101685047
Energy: 0.26697145690707436
Energy: 0.31914494622448736
Energy: 0.2824822784569934
Energy: 0.31914494622448736
Energy: 0.2680676569878416
Energy: 0.31914494622610634
Energy: 0.30051502534602736
Energy: 0.2543827444069742
Energy: 0.3005150253465671
Energy: 0.2543827444064345
Energy: 0.30051502534278945
Energy: 0.2543827444069742
Energy: 0.24978936802813537
Energy: 0.23726038288550316
Energy: 0.24978936803137333
Energy: 0.23726038288550316
Energy: 0.24978936802813537
Energy: 0.23726038288550316
Energy: 0.265853502012815
Energy: 0.25497695473607684
Energy: 0.26585350201065633
Energy: 0.25497695473607684
Energy: 0.2658535020101167
Energy: 0.25497695473607684
Energy: 0.2691194391967764
Energy: 0.28168936014352347
Energy: 0.26911943919515746
Energy: 0.28168936013488893
Energy: 0.26911943919785575
Energy: 0.28168936014352347
Energy: 0.2528349472234736
Energy: 0.2300690999701882
Energy: 0.25283494723372724
Energy: 0.23006909996910888
Energy: 0.2528349472353462
Energy: 0.23006909996910888
Energy: 0.25419242464193204
Energy: 0.22771192341016888
Energy: 0.25419242464139236
Energy: 0.22771192341016888
Energy: 0.2541924246446303
Energy: 0.22771192341016888
Energy: 0.24149713896030042
Energy: 0.28497994364665213
Energy: 0.24149713896084013
Energy: 0.2849799436477315
Energy: 0.24149713896137975
Energy: 0.28497994364935053
Energy: 0.28140539942527254
Energy: 0.3124191607725082
Energy: 0.2814053994231139
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Energy: 0.3124191607725082
Energy: 0.2672929860067503
Energy: 0.24026573273905155
Energy: 0.26729298600944856
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Energy: 0.26729298600782964
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Energy: 0.25217957521110085
Energy: 0.257625851281214
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Energy: 0.2664350112488546
Energy: 0.33803547012252794
Energy: 0.2664350112493942
Energy: 0.33803547011875035
Energy: 0.266435011248315
Energy: 0.3380354701236073
Energy: 0.28858274115843846
Energy: 0.24503088444856413
Energy: 0.2885827411605971
Energy: 0.24503088444802446
Energy: 0.28858274115843846
Energy: 0.2450308844496434
Energy: 0.2614157667484656
Energy: 0.2714632801595206
Energy: 0.26141576674630695
Energy: 0.2714632801562826
Energy: 0.2614157667468466
Energy: 0.2714632801595206
Energy: 0.22960958137792947
Energy: 0.24476303720216366
Energy: 0.22960958135963
Energy: 0.24476303720270337
Energy: 0.22960958136821555
Energy: 0.24476303720216366
Energy: 0.346880569127742
Energy: 0.30590450019778015
Energy: 0.34688056912720233
Energy: 0.30590450019778015
Energy: 0.34688056912828164
Energy: 0.30590450019778015
Energy: 0.28664063568111836
Energy: 0.2565483908755981
Energy: 0.2866406356805787
Energy: 0.2565483908755981
Energy: 0.28664063568111836
Energy: 0.25654839087505843
Energy: 0.26691510891345843
Energy: 0.24628261117133798
Energy: 0.26691510891399806
Energy: 0.24628261117511563
Energy: 0.26691510891345843
Energy: 0.24628261117133798
Energy: 0.23903051313918117
Energy: 0.25430804378212235
Energy: 0.2390305131386415
Energy: 0.25430804378104305
Energy: 0.23903051313918117
Energy: 0.25430804378104305
Energy: 0.27101805448443256
Energy: 0.28296900401302383
Energy: 0.2710180544838928
Energy: 0.28296900401248415
Energy: 0.2710180544838928
Energy: 0.28296900401248415
Energy: 0.2561708459227206
Energy: 0.2540080294007599
Energy: 0.25617084591894296
Energy: 0.2540080294007599
Energy: 0.2561708459211016
Energy: 0.2540080294034582
Energy: 0.25423148952225794
Energy: 0.25948730784685153
Energy: 0.2542314895249563
Energy: 0.2594873078463119
Energy: 0.2542314895233373
Energy: 0.25948730784685153
Energy: 0.23909178892276306
Energy: 0.28661974517143296
Energy: 0.2390917889222234
Energy: 0.28661974516819505
Energy: 0.23909178892276306
Energy: 0.28661974516711575
Energy: 0.34418613729610775
Energy: 0.3139438679728875
Energy: 0.34418613729610775
Energy: 0.3139438679723478
Energy: 0.34418613729610775
Energy: 0.3139438679728875

minimum gb energy = 0.22771192341016888 eV
minimum distance =  2.63985982062998 Angstroms
sigma value = 41


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

Energy: 0.27937092536899694
Energy: 0.24908522593031096
Energy: 0.27937092536899694
Energy: 0.24908522593031096
Energy: 0.27937092536899694
Energy: 0.24908522593031096
Energy: 0.28352577984907523
Energy: 0.2687939900024437
Energy: 0.2835257798822328
Energy: 0.268793990001593
Energy: 0.28352577986394295
Energy: 0.2687939900024437
Energy: 0.2734915418064204
Energy: 0.40109837275683824
Energy: 0.2734915418025923
Energy: 0.40109837275683824
Energy: 0.2734915418042937
Energy: 0.4010983727547116
Energy: 0.283032309206608
Energy: 0.2525489772223304
Energy: 0.283032309206608
Energy: 0.2525489772231811
Energy: 0.283032309206608
Energy: 0.2525489772223304
Energy: 0.2365052547323318
Energy: 0.2613136617028296
Energy: 0.2365052547323318
Energy: 0.2613136617028296
Energy: 0.23650525473190645
Energy: 0.2613136617028296
Energy: 0.28124696560597795
Energy: 0.2765670124225906
Energy: 0.28124696560640333
Energy: 0.2765670124208892
Energy: 0.28124696560512724
Energy: 0.2765670124208892
Energy: 0.26251476275696073
Energy: 0.3345607902258037
Energy: 0.26251476275653535
Energy: 0.3345607902258037
Energy: 0.26251476275653535
Energy: 0.3345607902258037
Energy: 0.2507773956073215
Energy: 0.2525973569684713
Energy: 0.2507773956081722
Energy: 0.2525973569688967
Energy: 0.2507773956073215
Energy: 0.2525973569688967
Energy: 0.23955996568599694
Energy: 0.25281003038617217
Energy: 0.23955996568557159
Energy: 0.25281003038617217
Energy: 0.23955996568557159
Energy: 0.25281003038617217
Energy: 0.28141441345429363
Energy: 0.30302671362557004
Energy: 0.28141441345684576
Energy: 0.30302671362557004
Energy: 0.281414413454719
Energy: 0.30302671362727146
Energy: 0.2832745946278221
Energy: 0.3349753579177392
Energy: 0.2832745946286728
Energy: 0.3349753579177392
Energy: 0.28327459462697147
Energy: 0.3349753579177392
Energy: 0.23872628671633053
Energy: 0.28180295047773657
Energy: 0.23872628671633053
Energy: 0.2818029504781619
Energy: 0.2387262867167559
Energy: 0.28180295047773657
Energy: 0.2494136024409402
Energy: 0.24938135438220846
Energy: 0.24941360244051486
Energy: 0.2493813543817831
Energy: 0.24941360244051486
Energy: 0.24938135438220846
Energy: 0.23778512752032177
Energy: 0.28334408722797305
Energy: 0.23778512752074712
Energy: 0.2833440872045984
Energy: 0.23778512752074712
Energy: 0.28334408723009985
Energy: 0.2833057540277962
Energy: 0.2781799619871644
Energy: 0.28330575403119895
Energy: 0.27817996198588835
Energy: 0.2833057540282215
Energy: 0.27817996198546296
Energy: 0.23762339792540282
Energy: 0.28880813896664476
Energy: 0.23762339792497747
Energy: 0.28880813896749546
Energy: 0.23762339792582815
Energy: 0.2608078591639194
Energy: 0.25303711183558525
Energy: 0.24932490075248467
Energy: 0.25303711183558525
Energy: 0.24932490075248467
Energy: 0.2530371118360106
Energy: 0.24932490075248467
Energy: 0.2733175634277025
Energy: 0.3065055474113597
Energy: 0.2733175634272772
Energy: 0.30650554742114267
Energy: 0.2733175634272772
Energy: 0.3065055474173145
Energy: 0.29617785096690624
Energy: 0.26842923541573177
Energy: 0.2961778509698837
Energy: 0.2684292354148812
Energy: 0.2961778509652049
Energy: 0.2684292354144558
Energy: 0.27945071199901933
Energy: 0.2632200551046822
Energy: 0.27945071199944466
Energy: 0.2632200551046822
Energy: 0.27945071199901933
Energy: 0.26322005510425683
Energy: 0.2394057906742579
Energy: 0.2705842373312412
Energy: 0.23940579067383258
Energy: 0.2705842373312412
Energy: 0.2394057906742579
Energy: 0.27058423733166653
Energy: 0.2723426504010238
Energy: 0.30636033595152556
Energy: 0.2723426503984717
Energy: 0.30636033594301865
Energy: 0.27234265039932243
Energy: 0.30636033611945984
Energy: 0.28385664451229814
Energy: 0.24946140125469746
Energy: 0.2838566445127235
Energy: 0.24946140125427213
Energy: 0.28385664451229814
Energy: 0.2494614012551228
Energy: 0.23769251487251863
Energy: 0.27233255885909113
Energy: 0.23769251487166795
Energy: 0.2723325588586658
Energy: 0.23769251487251863
Energy: 0.2723325588586658
Energy: 0.2409996901915105
Energy: 0.2718608150224834
Energy: 0.24099969019108516
Energy: 0.2718608150271622
Energy: 0.2409996901915105
Energy: 0.2718608150263115
Energy: 0.26129819186763537
Energy: 0.339392259839007
Energy: 0.26129819186763537
Energy: 0.339392259839007
Energy: 0.26129819186721004
Energy: 0.33939225983943233
Energy: 0.25394050870464135
Energy: 0.2495602990815443
Energy: 0.2539405087050667
Energy: 0.24956029908111899
Energy: 0.25394050870464135
Energy: 0.24956029908069363
Energy: 0.2422197384249745
Energy: 0.2636894563221251
Energy: 0.24221973842454914
Energy: 0.2636894563225504
Energy: 0.2422197384249745
Energy: 0.2636894563216997
Energy: 0.27951535165815217
Energy: 0.27063245311514683
Energy: 0.2795153516577268
Energy: 0.27063245311557216
Energy: 0.27951535165687613
Energy: 0.2706324531189556
Energy: 0.3532901729056973
Energy: 0.32399926623786424
Energy: 0.3532901729056973
Energy: 0.32399926623786424
Energy: 0.35329017290612263
Energy: 0.32399926623786424
Energy: 0.24064257707902817
Energy: 0.2597234876266819
Energy: 0.24064257707987888
Energy: 0.2597234876258312
Energy: 0.24064257707902817
Energy: 0.2597234876266819
Energy: 0.25011018084644626
Energy: 0.24806140522210285
Energy: 0.25011018084644626
Energy: 0.24806140522210285
Energy: 0.25011018084644626
Energy: 0.2480614052225282
Energy: 0.24100283751302462
Energy: 0.2754350299460807
Energy: 0.24100283751344997
Energy: 0.2754350299473375
Energy: 0.24100283751302462
Energy: 0.2754350299469121

minimum gb energy = 0.23650525473190645 eV
minimum distance =  2.65196139910205 Angstroms
sigma value = 33


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

Energy: 0.27375643992789395
Energy: 0.25265667069392383
Energy: 0.27375643992699844
Energy: 0.2526566706936253
Energy: 0.2737564399275954
Energy: 0.2526566706936253
Energy: 0.29325958747335873
Energy: 0.26066715960740494
Energy: 0.29325958747753783
Energy: 0.26066715960740494
Energy: 0.2932595874751498
Energy: 0.26066715960710646
Energy: 0.2949748551736512
Energy: 0.3039353052762981
Energy: 0.29497485523631156
Energy: 0.30393530527510404
Energy: 0.2949748551858902
Energy: 0.3039353052754025
Energy: 0.30215246016247876
Energy: 0.2565477697022654
Energy: 0.3021524601609862
Energy: 0.25654776970196697
Energy: 0.30215246016188174
Energy: 0.2565477697022654
Energy: 0.2523386016312843
Energy: 0.2547806042960022
Energy: 0.25233860163217986
Energy: 0.25478060432105004
Energy: 0.25233860163217986
Energy: 0.2547806043103307
Energy: 0.2749132548420415
Energy: 0.2609619865360954
Energy: 0.27491325428556085
Energy: 0.2609619865363939
Energy: 0.27491325483248913
Energy: 0.26096198653818503
Energy: 0.27696439331514716
Energy: 0.29241860921090357
Energy: 0.27696439331096795
Energy: 0.2924186092103066
Energy: 0.27696439331066947
Energy: 0.29241860921090357
Energy: 0.28589780723856717
Energy: 0.3043640639425127
Energy: 0.28589780723797015
Energy: 0.30436406394281124
Energy: 0.28589780723856717
Energy: 0.3043640639422142
Energy: 0.31120861050326926
Energy: 0.2616773207959649
Energy: 0.3112086105014782
Energy: 0.261677320796562
Energy: 0.3112086105047618
Energy: 0.2616773207962634
Energy: 0.31258445199857415
Energy: 0.2667022603757461
Energy: 0.31258445200215634
Energy: 0.2667022603757461
Energy: 0.3125844519929024
Energy: 0.2667022603757461
Energy: 0.28232550247554705
Energy: 0.28316098115424887
Energy: 0.2823255024764426
Energy: 0.28316098115663696
Energy: 0.2823255024824129
Energy: 0.2831609811554429
Energy: 0.2596198002277872
Energy: 0.2566193154918382
Energy: 0.25961980014336256
Energy: 0.2566193154918382
Energy: 0.25961980018453007
Energy: 0.2566193154921367
Energy: 0.2595237278365966
Energy: 0.25691211009273623
Energy: 0.259523727835104
Energy: 0.2569121101213662
Energy: 0.2595237278359996
Energy: 0.256912110075124
Energy: 0.3037561254714055
Energy: 0.28136313759578246
Energy: 0.30375612546513675
Energy: 0.28136313758921516
Energy: 0.30375612547050995
Energy: 0.281363137596081
Energy: 0.2898118854403011
Energy: 0.2772540953044039
Energy: 0.2898118854411967
Energy: 0.2772540953044039
Energy: 0.2898118854364205
Energy: 0.27725409530500095
Energy: 0.2591648344610192
Energy: 0.29942908466328627
Energy: 0.2591648344607207
Energy: 0.2994290846489577
Energy: 0.2591648344616162
Energy: 0.299429084657913
Energy: 0.30356574449750495
Energy: 0.2528829666448009
Energy: 0.3035657444966094
Energy: 0.25288296664420395
Energy: 0.303565744499296
Energy: 0.25288296664450244
Energy: 0.25893931961628064
Energy: 0.29010723851540066
Energy: 0.2589393196156836
Energy: 0.2901072385151022
Energy: 0.2589393196159821
Energy: 0.2901072385145051
Energy: 0.30563984644528336
Energy: 0.2921529517472688
Energy: 0.3056398464822717
Energy: 0.29215295173920897
Energy: 0.3056398464306563
Energy: 0.292152951752045
Energy: 0.25782767197839357
Energy: 0.2667114587720928
Energy: 0.2578276721457774
Energy: 0.2667114587726898
Energy: 0.25782767223020203
Energy: 0.2667114587726898
Energy: 0.25335564560351587
Energy: 0.2744374859365835
Energy: 0.25335564560321727
Energy: 0.2744374859365835
Energy: 0.25335564560321727
Energy: 0.2744374859365835
Energy: 0.26337623096793433
Energy: 0.29302799514057354
Energy: 0.2633762309670388
Energy: 0.29302799513311073
Energy: 0.26337623096674034
Energy: 0.293027995140275
Energy: 0.2895674464302273
Energy: 0.2641806795316527
Energy: 0.2895674464341079
Energy: 0.264180679527175
Energy: 0.2895674464344065
Energy: 0.264180679525384
Energy: 0.25484077558068513
Energy: 0.3057314095037529
Energy: 0.25484077558068513
Energy: 0.3057314095040514
Energy: 0.25484077558098367
Energy: 0.30573140950524547
Energy: 0.2565476591046251
Energy: 0.25292812852912044
Energy: 0.2565476590989534
Energy: 0.2529281285297175
Energy: 0.25654765909984895
Energy: 0.252928128529419
Energy: 0.2636693205346798
Energy: 0.2918422201985344
Energy: 0.2636693205349784
Energy: 0.29184222020865663
Energy: 0.2636693205349784
Energy: 0.2918422202002983
Energy: 0.30627550352136634
Energy: 0.2770451079303585
Energy: 0.3062755035210678
Energy: 0.2770451079276719
Energy: 0.3062755035210678
Energy: 0.27704510793185105
Energy: 0.27645964540661044
Energy: 0.25468440420970606
Energy: 0.2764596454048193
Energy: 0.2546844042100046
Energy: 0.2764596454063119
Energy: 0.25468440420970606
Energy: 0.2654421487754857
Energy: 0.3017086249959374
Energy: 0.26544214877488864
Energy: 0.30170862496551637
Energy: 0.2654421487757842
Energy: 0.301708624915095
Energy: 0.2693997591956978
Energy: 0.338634639868205
Energy: 0.2693997591953993
Energy: 0.33863463988641423
Energy: 0.2693997591953993
Energy: 0.3386346398670109
Energy: 0.2866977166644974
Energy: 0.2617559420813153
Energy: 0.28669771666181076
Energy: 0.2617559420810168
Energy: 0.2866977166606167
Energy: 0.26175594207982283
Energy: 0.25492335032277696
Energy: 0.25731065601584124
Energy: 0.25492335032188146
Energy: 0.25731065609190756
Energy: 0.25492335032218
Energy: 0.257310656025068
Energy: 0.2571940494570569
Energy: 0.25872328011107376
Energy: 0.2571940479785812
Energy: 0.25872328011137224
Energy: 0.2571940475208809
Energy: 0.25872328011137224
Energy: 0.28021307370395176
Energy: 0.292309480205524
Energy: 0.28021307370454884
Energy: 0.29230948022612135
Energy: 0.28021307370305626
Energy: 0.2923094802228377
Energy: 0.28027495005695385
Energy: 0.2925645814904587
Energy: 0.2802749500539687
Energy: 0.29256458149105574
Energy: 0.2802749500548642
Energy: 0.29256458149374237
Energy: 0.2571579103935209
Energy: 0.2587580464347965
Energy: 0.2571579104161807
Energy: 0.258758046435095
Energy: 0.2571579103977001
Energy: 0.25875804643539346
Energy: 0.2548901389556714
Energy: 0.2578704736756824
Energy: 0.2548901389556714
Energy: 0.25787045634312544
Energy: 0.2548901389556714
Energy: 0.25787046553292614
Energy: 0.2867558348507596
Energy: 0.26173259884731975
Energy: 0.2867558348507596
Energy: 0.26173259884523015
Energy: 0.2867558348513295
Energy: 0.2617325988479168
Energy: 0.26933645689941316
Energy: 0.33877053494826515
Energy: 0.2693364568991147
Energy: 0.3387705349658774
Energy: 0.26933645689941316
Energy: 0.3387705349390113
Energy: 0.2654050257736866
Energy: 0.37059932697463255
Energy: 0.2654050257736866
Energy: 0.370599326974334
Energy: 0.26540502577338804
Energy: 0.370599326974334
Energy: 0.2764921636188214
Energy: 0.2547153026110425
Energy: 0.27649216361911994
Energy: 0.2547153026119381
Energy: 0.27649216361822443
Energy: 0.2547153026110425
Energy: 0.3058199562553521
Energy: 0.27667309279368446
Energy: 0.3058199562574416
Energy: 0.27667309279249036
Energy: 0.3058199562544565
Energy: 0.2766730927948785
Energy: 0.263573213251262
Energy: 0.291682928321465
Energy: 0.2635732132509635
Energy: 0.29168292832236054
Energy: 0.2635732132521575
Energy: 0.2916829283184799
Energy: 0.2565675657315118
Energy: 0.25290814176882925
Energy: 0.2565675658174561
Energy: 0.25290814176942633
Energy: 0.25656756587235524
Energy: 0.2529081417691278
Energy: 0.2548483795226355
Energy: 0.305553857099674
Energy: 0.2548483795226355
Energy: 0.3055538571029576
Energy: 0.2548483795232325
Energy: 0.305553857099674
Energy: 0.28953946768579586
Energy: 0.2639817648233019
Energy: 0.2895394676762435
Energy: 0.2639817648170331
Energy: 0.2895394676846018
Energy: 0.26398176481763014
Energy: 0.2633788223733835
Energy: 0.31100452684444835
Energy: 0.2633788223730849
Energy: 0.3110045268435528
Energy: 0.2633788223730849
Energy: 0.3110045268429558

minimum gb energy = 0.2523386016312843 eV
minimum distance =  2.64191187290392 Angstroms
sigma value = 67


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

Energy: 0.26197292373344844
Energy: 0.260178452925519
Energy: 0.26197292373344844
Energy: 0.260178452925519
Energy: 0.26197292373344844
Energy: 0.260178452925315
Energy: 0.2536955266989894
Energy: 0.2496267573065726
Energy: 0.2536955266989894
Energy: 0.24962675730677666
Energy: 0.25369552669878537
Energy: 0.24962675730636857
Energy: 0.35860091055214666
Energy: 0.34367995845991917
Energy: 0.3586009105527361
Energy: 0.34367995845953375
Energy: 0.4008327453869346
Energy: 0.34367995845991917
Energy: 0.25366631916176774
Energy: 0.24954976533319595
Energy: 0.2536663191619718
Energy: 0.24954976533319595
Energy: 0.2536663191613824
Energy: 0.2495497653333773
Energy: 0.26197292373344844
Energy: 0.26017845292393205
Energy: 0.2619729237330404
Energy: 0.26017845292393205
Energy: 0.2619729237332444
Energy: 0.26017845292393205
Energy: 0.2536955267003723
Energy: 0.24962675730616452
Energy: 0.25369552670078044
Energy: 0.2496267573065726
Energy: 0.2536955267005764
Energy: 0.24962675730636857
Energy: 0.24757307293209493
Energy: 0.3436799584593297
Energy: 0.2475730729318909
Energy: 0.3436799584589216
Energy: 0.247573072932299
Energy: 0.34367995845833216

minimum gb energy = 0.2475730729318909 eV
minimum distance =  2.697782879637 Angstroms
sigma value = 3


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

Energy: 0.37868651083684257
Energy: 0.33198283025988234
Energy: 0.37868651083654636
Energy: 0.3319828302604253
Energy: 0.37868651083600346
Energy: 0.3319828302604253
Energy: 0.3298996441539275
Energy: 0.3111012489987063
Energy: 0.3298996441506696
Energy: 0.3111012489987063
Energy: 0.32989964415368067
Energy: 0.3111012489987063
Energy: 0.3104205086749435
Energy: 0.3467064152912149
Energy: 0.31042050867385756
Energy: 0.34670641529175783
Energy: 0.3104205086749435
Energy: 0.3467064152909681
Energy: 0.32253989244224884
Energy: 0.29450144626245633
Energy: 0.32253989244061987
Energy: 0.29450144626137037
Energy: 0.3225398924414096
Energy: 0.2945014462619134
Energy: 0.33406447775706594
Energy: 0.3317378230084291
Energy: 0.334064477759534
Energy: 0.3317378230084291
Energy: 0.33406447775899106
Energy: 0.3317378230081822
Energy: 0.3155040767821446
Energy: 0.3342835699546428
Energy: 0.31550407678594544
Energy: 0.33428356995844366
Energy: 0.31550407678323056
Energy: 0.33428356995627173
Energy: 0.3218202209444124
Energy: 0.3499140829049965
Energy: 0.32182022094525164
Energy: 0.3499140829044535
Energy: 0.32182022094470863
Energy: 0.3499140829047497
Energy: 0.30787000331433656
Energy: 0.3061016702891142
Energy: 0.3078700033151757
Energy: 0.30610167029020025
Energy: 0.30787000331408976
Energy: 0.3061016702891142
Energy: 0.32465400517994875
Energy: 0.3240765830728454
Energy: 0.3246540051821207
Energy: 0.3240765830733885
Energy: 0.3246540051777768
Energy: 0.32407658307230247
Energy: 0.31412637803223586
Energy: 0.33429738497225
Energy: 0.3141263780335687
Energy: 0.33429738497170697
Energy: 0.3141263780324827
Energy: 0.3342973849708678
Energy: 0.32939672367153716
Energy: 0.3433943363461835
Energy: 0.3293967236702044
Energy: 0.3433943363464303
Energy: 0.3293967236691184
Energy: 0.3433943363464303
Energy: 0.3186314632214159
Energy: 0.31356394740496313
Energy: 0.31863146322087293
Energy: 0.313563947404667
Energy: 0.3186314632222551
Energy: 0.31356394740496313
Energy: 0.3269546854044332
Energy: 0.3223628542485867
Energy: 0.32695468540581535
Energy: 0.3223628542485867
Energy: 0.32695468540581535
Energy: 0.3223628542483399
Energy: 0.31229399819349285
Energy: 0.3362970459616137
Energy: 0.3122939981926537
Energy: 0.33629704596620436
Energy: 0.31229399819373965
Energy: 0.3362970459689193
Energy: 0.3410870218386021
Energy: 0.3266194406975766
Energy: 0.34108702183889833
Energy: 0.3266194406972804
Energy: 0.3410870218394413
Energy: 0.3266194406972804
Energy: 0.3476245130469299
Energy: 0.31804684542771305
Energy: 0.34762451304638686
Energy: 0.31804684542771305
Energy: 0.3476245130469299
Energy: 0.3180468454280092
Energy: 0.3306136205798447
Energy: 0.3286616832021129
Energy: 0.3306136205787587
Energy: 0.32866168320186606
Energy: 0.3306136205803877
Energy: 0.32866168320186606
Energy: 0.2999255190470565
Energy: 0.3506481527979942
Energy: 0.29992551904759945
Energy: 0.35064815279745126
Energy: 0.2999255190470565
Energy: 0.3506481527969083
Energy: 0.3399418102187115
Energy: 0.3312789641285457
Energy: 0.33994181021491054
Energy: 0.3312789641249916
Energy: 0.3399418102214264
Energy: 0.3312789641249916
Energy: 0.3186125028597152
Energy: 0.33395566454885184
Energy: 0.31861250285616116
Energy: 0.33395566454939485
Energy: 0.31861250285941906
Energy: 0.33395566454914805
Energy: 0.33314785635513033
Energy: 0.36959210580417673
Energy: 0.3331478563545874
Energy: 0.36959210580417673
Energy: 0.33314785635537714
Energy: 0.36959210580417673
Energy: 0.2936647894379931
Energy: 0.34041404550912574
Energy: 0.2936647894789637
Energy: 0.3404140455080398
Energy: 0.2936647894773347
Energy: 0.34041404550966875
Energy: 0.3331111314358665
Energy: 0.2924238085471833
Energy: 0.3331111314285609
Energy: 0.2924238085498982
Energy: 0.33311113144292526
Energy: 0.2924238085491084
Energy: 0.2898304006800985
Energy: 0.32980403137630443
Energy: 0.2898304006808883
Energy: 0.32980403137630443
Energy: 0.28983040067925936
Energy: 0.32980403137605757
Energy: 0.3197207356808193
Energy: 0.3698215347489668
Energy: 0.31972073568274445
Energy: 0.3698215347489668
Energy: 0.31972073568136233
Energy: 0.3698215347489668
Energy: 0.31359717062507897
Energy: 0.3394324892730086
Energy: 0.31359717062507897
Energy: 0.3394324892735516
Energy: 0.3135971706242892
Energy: 0.3394324892724656
Energy: 0.3364449757943632
Energy: 0.3181381637879805
Energy: 0.3364449758296572
Energy: 0.3181381637879805
Energy: 0.3364449757932773
Energy: 0.31813816378827664
Energy: 0.29336340521439785
Energy: 0.2907013296071348
Energy: 0.2933634052181987
Energy: 0.2907013296093067
Energy: 0.29336340521464466
Energy: 0.29070132960960293
Energy: 0.31903665979711027
Energy: 0.3289032543950115
Energy: 0.3190366597979494
Energy: 0.32890325439471535
Energy: 0.31903665979819623
Energy: 0.3289032543950115
Energy: 0.3433444410395111
Energy: 0.31340254435215387
Energy: 0.343344441040597
Energy: 0.31340254435161086
Energy: 0.3433444410454839
Energy: 0.31340254435215387
Energy: 0.3576534863744103
Energy: 0.3008846971430526
Energy: 0.35765348637223837
Energy: 0.30088469714334876
Energy: 0.3576534863744103
Energy: 0.30088469714334876
Energy: 0.3116870586359258
Energy: 0.3242756481157045
Energy: 0.3116870586359258
Energy: 0.3242756481154577
Energy: 0.3116870586378016
Energy: 0.3242756481157045
Energy: 0.29837813640560795
Energy: 0.32450124112257467
Energy: 0.298378136404522
Energy: 0.3245012411222785
Energy: 0.29837813640644706
Energy: 0.32450124112257467
Energy: 0.3415425467935122
Energy: 0.32672101699069506
Energy: 0.341542546793216
Energy: 0.32672101699015205
Energy: 0.3415425467913402
Energy: 0.32672101699069506
Energy: 0.3329426829738752
Energy: 0.3271093569979548
Energy: 0.33294268297357904
Energy: 0.3271093569976587
Energy: 0.3329426829738752
Energy: 0.3271093569984978
Energy: 0.3194502179664711
Energy: 0.36354883115608616
Energy: 0.3194502179675571
Energy: 0.36354883115579006
Energy: 0.3194502179691861
Energy: 0.3635488311563331
Energy: 0.2892752169013616
Energy: 0.3210192380980584
Energy: 0.2892752169043727
Energy: 0.3210192380980584
Energy: 0.2892752169024475
Energy: 0.32101923809697236
Energy: 0.34381213665197335
Energy: 0.298203654648068
Energy: 0.34381213665903215
Energy: 0.2982036546486109
Energy: 0.34381213665009763
Energy: 0.298203654647525
Energy: 0.30468266373446656
Energy: 0.342893869553799
Energy: 0.3046826637360955
Energy: 0.34289386955434203
Energy: 0.30468266373663855
Energy: 0.34289386955488493
Energy: 0.3383565401165417
Energy: 0.36373128095319274
Energy: 0.33835654011708466
Energy: 0.36373128095319274
Energy: 0.3383565401168378
Energy: 0.3637312809534395
Energy: 0.32937466525875436
Energy: 0.33202376487724283
Energy: 0.32937466525766845
Energy: 0.33202376487724283
Energy: 0.32937466525929743
Energy: 0.33202376487748964
Energy: 0.3541019443879299
Energy: 0.2905548772372332
Energy: 0.3541019443906449
Energy: 0.2905548772363941
Energy: 0.3541019443597442
Energy: 0.29055487723560436
Energy: 0.30156652812099904
Energy: 0.3368375636753152
Energy: 0.30156652812075224
Energy: 0.33683756367314327
Energy: 0.3015665281202093
Energy: 0.3368375636769441
Energy: 0.3330928448923971
Energy: 0.32472018203095826
Energy: 0.33309284489269325
Energy: 0.32472018203066205
Energy: 0.33309284489269325
Energy: 0.32472018203066205
Energy: 0.36062402294578755
Energy: 0.32856825022370817
Energy: 0.3606240229430726
Energy: 0.3285682502231652
Energy: 0.3606240229447016
Energy: 0.32856825022346137
Energy: 0.3541832381929446
Energy: 0.30515027963930946
Energy: 0.3541832381954127
Energy: 0.3051502796414814
Energy: 0.35418323819403064
Energy: 0.3051502796414814
Energy: 0.3116704681223347
Energy: 0.33337402100721003
Energy: 0.3116704681207057
Energy: 0.33337402100745683
Energy: 0.31167046812263083
Energy: 0.33337402100775304
Energy: 0.3309403433391254
Energy: 0.3105149799692463
Energy: 0.3309403433415442
Energy: 0.3105149799692463
Energy: 0.3309403433391254
Energy: 0.3105149799689995
Energy: 0.32890661220992934
Energy: 0.3208586825639259
Energy: 0.3289066122093863
Energy: 0.32085868256446887
Energy: 0.3289066122110152
Energy: 0.32085868256446887
Energy: 0.33746402735971853
Energy: 0.33415076026587764
Energy: 0.33746402736026154
Energy: 0.33415076026449547
Energy: 0.3374640273591756
Energy: 0.3341507602666674
Energy: 0.31042105975593354
Energy: 0.3404525809726152
Energy: 0.31042105975785866
Energy: 0.34045258097207226
Energy: 0.31042105975731565
Energy: 0.34045258097098635

minimum gb energy = 0.2892752169013616 eV
minimum distance =  2.62296924523429 Angstroms
sigma value = 81


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

Energy: 0.3130842891549366
Energy: 0.30956095846320925
Energy: 0.3130842891549366
Energy: 0.30956095846320925
Energy: 0.3130842891549366
Energy: 0.30956095846320925
Energy: 0.2829621165726023
Energy: 0.281322943830066
Energy: 0.2829621165722297
Energy: 0.28132294382708506
Energy: 0.28296211657409276
Energy: 0.28132294382447676
Energy: 0.3689974734409324
Energy: 0.28168405764949567
Energy: 0.3689974734409324
Energy: 0.28168405764875043
Energy: 0.3689974734416776
Energy: 0.28168405764837784
Energy: 0.29802191370060577
Energy: 0.30377025764833326
Energy: 0.29802191369986053
Energy: 0.30377025764870585
Energy: 0.2980219137002332
Energy: 0.3037702576479607
Energy: 0.33927431234579863
Energy: 0.3188548895641698
Energy: 0.33927431234579863
Energy: 0.3188548895604436
Energy: 0.33927431234579863
Energy: 0.3188548895660329
Energy: 0.2819457773346132
Energy: 0.28080418777604593
Energy: 0.2819457773349858
Energy: 0.28080418777604593
Energy: 0.28194577733237747
Energy: 0.2808041877753007
Energy: 0.2792753427071198
Energy: 0.2817239994674167
Energy: 0.2792753427067472
Energy: 0.2817239994674167
Energy: 0.27927534270637455
Energy: 0.2817239994674167
Energy: 0.2819240723584528
Energy: 0.3137922478546363
Energy: 0.2819240723584528
Energy: 0.3137922478576173
Energy: 0.2819240723580802
Energy: 0.31379224785687204
Energy: 0.3202219232331106
Energy: 0.31685999806302295
Energy: 0.3202219232323653
Energy: 0.31685999806265036
Energy: 0.3202219232334832
Energy: 0.3168599980622777
Energy: 0.31250380175084785
Energy: 0.36915579419372596
Energy: 0.31250380175084785
Energy: 0.3691557941974521
Energy: 0.31250380175122056
Energy: 0.3691557941922354
Energy: 0.2805527659518925
Energy: 0.2777218338400299
Energy: 0.2805527659541282
Energy: 0.2777218338400299
Energy: 0.2805527659530104
Energy: 0.2777218338400299
Energy: 0.28091939493167756
Energy: 0.2991636146402042
Energy: 0.2809193949380121
Energy: 0.29916361464057684
Energy: 0.28091939493279544
Energy: 0.2991636146402042
Energy: 0.3156372192464798
Energy: 0.3178129506408309
Energy: 0.3156372192535596
Energy: 0.31781295063785
Energy: 0.3156372192449894
Energy: 0.31781295063747733
Energy: 0.30206459528178464
Energy: 0.33148446011946314
Energy: 0.30206459528141205
Energy: 0.3314844601172274
Energy: 0.3020645952806668
Energy: 0.33148446011797267
Energy: 0.2843143301266507
Energy: 0.2869533531779172
Energy: 0.2843143301255328
Energy: 0.28695335317456366
Energy: 0.2843143301266507
Energy: 0.28695335318686005
Energy: 0.28274208532522466
Energy: 0.2831430965712901
Energy: 0.2827420853259699
Energy: 0.2831430965735258
Energy: 0.2827420853296961
Energy: 0.2831430965712901
Energy: 0.3073653233939123
Energy: 0.3098064873499934
Energy: 0.3073653233939123
Energy: 0.3098064873496208
Energy: 0.30736532339353967
Energy: 0.3098064873496208
Energy: 0.29038124420169936
Energy: 0.301537729069668
Energy: 0.29038124420169936
Energy: 0.3015377290692954
Energy: 0.290381244202072
Energy: 0.3015377290689228
Energy: 0.28038722292121177
Energy: 0.3709070219967929
Energy: 0.28038722292046653
Energy: 0.3709070219967929
Energy: 0.28038722292046653
Energy: 0.3709070219964202
Energy: 0.3024408185909263
Energy: 0.3186598244101695
Energy: 0.3024408185864549
Energy: 0.3186598244101695
Energy: 0.3024408185898085
Energy: 0.31865982441240515
Energy: 0.33918499108483646
Energy: 0.317906826686917
Energy: 0.33918499108520905
Energy: 0.3179068266824456
Energy: 0.33918499108409117
Energy: 0.3179068266824456
Energy: 0.2846105392761945
Energy: 0.2825740788635868
Energy: 0.2846105392761945
Energy: 0.2825740788639594
Energy: 0.28461053927395885
Energy: 0.28257407886470465
Energy: 0.28456802677568255
Energy: 0.2794301792628916
Energy: 0.28456802677568255
Energy: 0.279430179264382
Energy: 0.28456802677642784
Energy: 0.27943017926326413
Energy: 0.3392743705982729
Energy: 0.31794202557703793
Energy: 0.3392743705979004
Energy: 0.31794202557852835
Energy: 0.3392743705982729
Energy: 0.3179420255774106
Energy: 0.30229240668162477
Energy: 0.3187587045105285
Energy: 0.3022924066827426
Energy: 0.3187587045105285
Energy: 0.30229240668199736
Energy: 0.31875870451015587
Energy: 0.28048328606669193
Energy: 0.3709353876227725
Energy: 0.28048328606520145
Energy: 0.37093538762389033
Energy: 0.2804832860670645
Energy: 0.37093538762314515
Energy: 0.29024525114266175
Energy: 0.3015622560731017
Energy: 0.290245251143407
Energy: 0.30156225607272913
Energy: 0.2902452511430344
Energy: 0.3015622560731017
Energy: 0.30189390100508284
Energy: 0.309790959237384
Energy: 0.3018939010073186
Energy: 0.30979095923701133
Energy: 0.3018939010073186
Energy: 0.309790959237384
Energy: 0.2828144687711362
Energy: 0.283130035374269
Energy: 0.2828144687726266
Energy: 0.28313003537352377
Energy: 0.2828144687752349
Energy: 0.2831300353757594
Energy: 0.2843472190244521
Energy: 0.28702677811235294
Energy: 0.2843472190240795
Energy: 0.28702677810937194
Energy: 0.28434721902482474
Energy: 0.2870267781071363
Energy: 0.30195398508683424
Energy: 0.331787735296914
Energy: 0.3019539850875795
Energy: 0.3317877353002337
Energy: 0.30195398508608906
Energy: 0.33178773529837063
Energy: 0.3150816679060995
Energy: 0.31779560941949053
Energy: 0.31508166790796255
Energy: 0.3177956094418477
Energy: 0.31508166790721737
Energy: 0.3177956094202358
Energy: 0.2808447890993542
Energy: 0.29913955623359845
Energy: 0.2808447890993542
Energy: 0.2991395562343437
Energy: 0.2808447891023351
Energy: 0.2991395562339711
Energy: 0.28047508733384463
Energy: 0.27769934982363315
Energy: 0.2804750873345898
Energy: 0.2776993498240058
Energy: 0.2804750873345898
Energy: 0.27769934982326056
Energy: 0.3125515792320431
Energy: 0.36929931787028625
Energy: 0.31255157923129784
Energy: 0.36929931787103154
Energy: 0.31255157923167043
Energy: 0.36929931787028625
Energy: 0.3202292748378675
Energy: 0.3168788118383119
Energy: 0.3202292748374948
Energy: 0.31687881183793926
Energy: 0.3202292748389853
Energy: 0.31687881183793926
Energy: 0.2820551395796347
Energy: 0.31359082897419516
Energy: 0.28205513957814426
Energy: 0.31359082897494045
Energy: 0.2820551395811252
Energy: 0.31359082897084156
Energy: 0.279429719637306
Energy: 0.2817544555310221
Energy: 0.2794297196376786
Energy: 0.2817544555313947
Energy: 0.2794297196376786
Energy: 0.2817544555310221

minimum gb energy = 0.27769934982326056 eV
minimum distance =  2.72951188588986 Angstroms
sigma value = 43


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

Energy: 0.36566029857612903
Energy: 0.31270087714044315
Energy: 0.36566029857612903
Energy: 0.31270087714044315
Energy: 0.3656602985765867
Energy: 0.31270087714044315
Energy: 0.31932316813108497
Energy: 0.28620197996008323
Energy: 0.31932316813016964
Energy: 0.28620197995962554
Energy: 0.31932316813108497
Energy: 0.28620197996008323
Energy: 0.3085148794624234
Energy: 0.3415285865356811
Energy: 0.3085148794628811
Energy: 0.3415285865182886
Energy: 0.34509914109187845
Energy: 0.34152858653522333
Energy: 0.2822202375312567
Energy: 0.29014745402642744
Energy: 0.28222023756052844
Energy: 0.290147454025512
Energy: 0.2822202375751747
Energy: 0.2901474540268851
Energy: 0.33213751068145225
Energy: 0.2987556198348839
Energy: 0.33213751068145225
Energy: 0.2987556198298492
Energy: 0.3321375106809945
Energy: 0.2987556198362569
Energy: 0.2959163832407934
Energy: 0.311724820881949
Energy: 0.2959163832512996
Energy: 0.3117248208828644
Energy: 0.2959163832512996
Energy: 0.311724820881949
Energy: 0.3171589697107468
Energy: 0.3257845818711186
Energy: 0.3171589697121199
Energy: 0.3257845818724917
Energy: 0.3171589697121199
Energy: 0.3257845818702032
Energy: 0.2952293168612186
Energy: 0.308052915452006
Energy: 0.29522931686213394
Energy: 0.308052915452006
Energy: 0.2952293168630494
Energy: 0.30805291545154834
Energy: 0.33738140294225033
Energy: 0.2792888712476756
Energy: 0.33738140294179264
Energy: 0.279288871244014
Energy: 0.33738140294179264
Energy: 0.27928887124538715
Energy: 0.2949446305124338
Energy: 0.3224708000923255
Energy: 0.29494463051197606
Energy: 0.322470800094614
Energy: 0.2949446305124338
Energy: 0.3224708000927832
Energy: 0.313241743399946
Energy: 0.2964499843612049
Energy: 0.313241743399946
Energy: 0.2964499842504842
Energy: 0.31324174340040367
Energy: 0.29644998430264063
Energy: 0.29527012454641743
Energy: 0.3397310189882595
Energy: 0.2952701245491636
Energy: 0.3397310189882595
Energy: 0.295270124554656
Energy: 0.3397310189882595
Energy: 0.3354771891479972
Energy: 0.3116633391954811
Energy: 0.3354771891479972
Energy: 0.3116633391968542
Energy: 0.3354771891479972
Energy: 0.3116633391954811
Energy: 0.28292557446826205
Energy: 0.32097933219768193
Energy: 0.2829255744691774
Energy: 0.3209793321963089
Energy: 0.28292557446643124
Energy: 0.32097933219859737
Energy: 0.31321393648725304
Energy: 0.29826347829253497
Energy: 0.3132139364867953
Energy: 0.29826347829070415
Energy: 0.3132139364863376
Energy: 0.2982634782916196
Energy: 0.29307043513473996
Energy: 0.3359322783578314
Energy: 0.2930704351324515
Energy: 0.33593227835737377
Energy: 0.2930704351361131
Energy: 0.3359322783578314
Energy: 0.31122814324900533
Energy: 0.2861196075339251
Energy: 0.3112281432480899
Energy: 0.2861196075339251
Energy: 0.31122814324900533
Energy: 0.2861196075348405
Energy: 0.3280956496580268
Energy: 0.3010987312452793
Energy: 0.3280956496584845
Energy: 0.301098731245737
Energy: 0.3280956496580268
Energy: 0.30109873124299086
Energy: 0.340010567742672
Energy: 0.29020312273495064
Energy: 0.34001056770836563
Energy: 0.2902031227335775
Energy: 0.34001056776095906
Energy: 0.29020312273540827
Energy: 0.31104658481037034
Energy: 0.3279873215389518
Energy: 0.31104658481037034
Energy: 0.3279873215389518
Energy: 0.31104658481037034
Energy: 0.3279873215394095
Energy: 0.29305022349818977
Energy: 0.30249944419055125
Energy: 0.29305022349864746
Energy: 0.3024994441859743
Energy: 0.2930502234959013
Energy: 0.302499444191009
Energy: 0.32821312565214195
Energy: 0.32277337367681896
Energy: 0.32821312564664956
Energy: 0.32277337367681896
Energy: 0.32821312564115723
Energy: 0.32277337367681896
Energy: 0.2829353452677975
Energy: 0.3246626891627791
Energy: 0.2829353452677975
Energy: 0.3246626891627791
Energy: 0.2829353452677975
Energy: 0.32466268916188445
Energy: 0.33496339949274423
Energy: 0.3515694860482325
Energy: 0.33496339949182885
Energy: 0.3515694860482325
Energy: 0.33496339949274423
Energy: 0.3515694860482325
Energy: 0.2955378169254559
Energy: 0.31867648242831276
Energy: 0.29553781692499814
Energy: 0.31867648242785507
Energy: 0.2955378169263712
Energy: 0.31867648242785507
Energy: 0.3279832831205914
Energy: 0.32135847134108336
Energy: 0.32798328311784525
Energy: 0.32135847134108336
Energy: 0.32798328311876057
Energy: 0.3213584713406257
Energy: 0.29277555869556243
Energy: 0.28593137527113055
Energy: 0.29277555869693556
Energy: 0.28593137526884205
Energy: 0.3133779871803022
Energy: 0.28593137527021517
Energy: 0.3012625886633623
Energy: 0.3315715528325009
Energy: 0.3012625886619892
Energy: 0.33157155283295864
Energy: 0.30126258866382
Energy: 0.33157155283295864
Energy: 0.29553185139978017
Energy: 0.30867941222174183
Energy: 0.29553185140023785
Energy: 0.30867941222174183
Energy: 0.29553185140069554
Energy: 0.3086794122221995
Energy: 0.31371103007461915
Energy: 0.3351111616380178
Energy: 0.31371103007370377
Energy: 0.33511116163664467
Energy: 0.31371103007461915
Energy: 0.3351111616389332
Energy: 0.3202670919911126
Energy: 0.31189734919856565
Energy: 0.32026709199065484
Energy: 0.3118973491981079
Energy: 0.32026709199065484
Energy: 0.31189734919902334

minimum gb energy = 0.279288871244014 eV
minimum distance =  2.68403347021627 Angstroms
sigma value = 57


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

Energy: 0.34624599891594093
Energy: 0.28772724865684474
Energy: 0.3462459989165335
Energy: 0.28772724865565946
Energy: 0.34624599891594093
Energy: 0.2877272486580299
Energy: 0.30015235401298496
Energy: 0.2667231224600772
Energy: 0.30015235401120705
Energy: 0.26672312245948454
Energy: 0.300152354008244
Energy: 0.26672312245948454
Energy: 0.31253023351568066
Energy: 0.33702234803649805
Energy: 0.31253023351568066
Energy: 0.33702234803649805
Energy: 0.3125302335150881
Energy: 0.33702234803709064
Energy: 0.2942974575034859
Energy: 0.2924364659385886
Energy: 0.29429745749163355
Energy: 0.2924364659368107
Energy: 0.2942974575135604
Energy: 0.29243646593977385
Energy: 0.340590007823945
Energy: 0.29245800621949336
Energy: 0.34059000782098187
Energy: 0.2924580062171229
Energy: 0.3405900078227598
Energy: 0.2924580062171229
Energy: 0.3121402659383837
Energy: 0.2846517549256418
Energy: 0.3121402659371984
Energy: 0.30506794120703623
Energy: 0.31214026593779104
Energy: 0.28465175490727074
Energy: 0.31536721351667624
Energy: 0.31744901346115006
Energy: 0.3153672135143058
Energy: 0.3174490134605574
Energy: 0.31536721351667624
Energy: 0.3174490134599648
Energy: 0.2940546241522406
Energy: 0.3006218714629837
Energy: 0.29405462414631445
Energy: 0.3006218714629837
Energy: 0.2940546241492775
Energy: 0.3006218714629837
Energy: 0.3168416446038015
Energy: 0.26641678083990866
Energy: 0.31684164460320885
Energy: 0.26641678084464954
Energy: 0.316841644604394
Energy: 0.26641678084761267
Energy: 0.2759572935724632
Energy: 0.31084848935843823
Energy: 0.27595729357187054
Energy: 0.31084848935666043
Energy: 0.2759572935736484
Energy: 0.310848489357253
Energy: 0.3152673236846848
Energy: 0.2914817739694927
Energy: 0.3152673236852775
Energy: 0.2914817739694927
Energy: 0.3152673236846848
Energy: 0.2914817739689
Energy: 0.3399685974664836
Energy: 0.326360071451247
Energy: 0.33996859747063196
Energy: 0.32636007145065443
Energy: 0.33996859747063196
Energy: 0.326360071451247
Energy: 0.30145531834641653
Energy: 0.2665203190471181
Energy: 0.3014553183458239
Energy: 0.26652031904474766
Energy: 0.3014553183458239
Energy: 0.26652031904534024
Energy: 0.3318715168363149
Energy: 0.26995525220777206
Energy: 0.33187151683512967
Energy: 0.26995525221132777
Energy: 0.33187151683337873
Energy: 0.26995525221073513
Energy: 0.3100107269387747
Energy: 0.26995399817437066
Energy: 0.3100107269417378
Energy: 0.26995399818029686
Energy: 0.3100107269423304
Energy: 0.2699539981755559
Energy: 0.35814086289819885
Energy: 0.3257961794920227
Energy: 0.3581408628999767
Energy: 0.3257961794920227
Energy: 0.35814086289819885
Energy: 0.32579617949143014
Energy: 0.2728330535085969
Energy: 0.30086255445451043
Energy: 0.27283305351215265
Energy: 0.30086255445806614
Energy: 0.2728330535085969
Energy: 0.3008625544503621
Energy: 0.3140107625024238
Energy: 0.3008418234882378
Energy: 0.3140107625030164
Energy: 0.3008418234882378
Energy: 0.3140107625024238
Energy: 0.3008418234888305
Energy: 0.2727899239039948
Energy: 0.30015378179884894
Energy: 0.27278992390518003
Energy: 0.300153781794108
Energy: 0.2727899239063653
Energy: 0.30015378179529323
Energy: 0.35790942631700606
Energy: 0.3259444887911513
Energy: 0.35790942631463557
Energy: 0.3259444887905587
Energy: 0.3579094263140429
Energy: 0.3259444887905587
Energy: 0.3098900754803476
Energy: 0.2697598149389705
Energy: 0.30989007547797714
Energy: 0.26975981493956314
Energy: 0.30989007547916236
Energy: 0.26975981494074835
Energy: 0.3319038059702051
Energy: 0.29311914888061824
Energy: 0.3319038059702051
Energy: 0.293119148879433
Energy: 0.33190380596901986
Energy: 0.293119148879433
Energy: 0.30158419148400245
Energy: 0.2664773054753177
Energy: 0.30158419148400245
Energy: 0.26647730547650295
Energy: 0.30158419148340976
Energy: 0.26647730547650295
Energy: 0.3399927846656903
Energy: 0.32685481556284185
Energy: 0.3399927846656903
Energy: 0.32685481556284185
Energy: 0.3399927846656903
Energy: 0.3268548155634345

minimum gb energy = 0.26641678083990866 eV
minimum distance =  2.67080222164226 Angstroms
sigma value = 17


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

Energy: 0.32784394098041864
Energy: 0.2825282173333707
Energy: 0.32784394098041864
Energy: 0.2825282173333707
Energy: 0.32784394097790437
Energy: 0.2825282173325326
Energy: 0.27363279767714926
Energy: 0.2639203517692036
Energy: 0.2736327976813397
Energy: 0.2639203517700417
Energy: 0.27363279768301585
Energy: 0.2639203517700417
Energy: 0.31608435766903054
Energy: 0.32034011119421374
Energy: 0.31608435766986864
Energy: 0.32034011119421374
Energy: 0.31608435766903054
Energy: 0.32034011119505185
Energy: 0.25730660676546874
Energy: 0.2910081590355422
Energy: 0.25730660676546874
Energy: 0.2910081590355422
Energy: 0.2573066067637925
Energy: 0.29100815903638033
Energy: 0.3196270642369318
Energy: 0.2873871807354197
Energy: 0.3196270642352556
Energy: 0.2873871807354197
Energy: 0.3196270642360937
Energy: 0.28738718073625774
Energy: 0.2807932608957378
Energy: 0.26333609942691866
Energy: 0.2807932608957378
Energy: 0.26333609942608055
Energy: 0.2807932608957378
Energy: 0.26333609942608055
Energy: 0.26939547989361284
Energy: 0.28188467723185284
Energy: 0.26939547989445095
Energy: 0.28188467723185284
Energy: 0.26939547989361284
Energy: 0.28188467723185284
Energy: 0.2572103993052501
Energy: 0.2899566200913496
Energy: 0.2572103993102786
Energy: 0.28995662008632106
Energy: 0.2572103993077644
Energy: 0.2899566200888353
Energy: 0.28488901402091443
Energy: 0.26384024741980416
Energy: 0.28488901402091443
Energy: 0.26384024741896606
Energy: 0.2848890140200764
Energy: 0.2638402474206422
Energy: 0.2929739746298941
Energy: 0.27510738682311214
Energy: 0.2929739746298941
Energy: 0.27510738682311214
Energy: 0.2929739746307322
Energy: 0.27510738682311214
Energy: 0.28749452706928214
Energy: 0.30824618067306325
Energy: 0.28749452705838696
Energy: 0.30824618068058696
Energy: 0.28749452707764395
Energy: 0.30824618067807275
Energy: 0.2831535726730297
Energy: 0.26414117912272117
Energy: 0.2831535726721916
Energy: 0.2641411788847994
Energy: 0.28315357267135355
Energy: 0.2641411791813492
Energy: 0.25672286318746484
Energy: 0.3118369041317901
Energy: 0.2567228631849505
Energy: 0.3118369041317901
Energy: 0.25672286318746484
Energy: 0.3118369041326282
Energy: 0.29226727288500726
Energy: 0.2934425309295705
Energy: 0.2922672728858453
Energy: 0.2934425309304086
Energy: 0.2922672728858453
Energy: 0.2934425309295705
Energy: 0.28068786360063286
Energy: 0.3328668763224228
Energy: 0.2806878636106899
Energy: 0.3328668763232609
Energy: 0.28068786360566134
Energy: 0.3328668763224228
Energy: 0.2798839623352286
Energy: 0.2642220394556306
Energy: 0.2798839623360476
Energy: 0.2642220394556306
Energy: 0.2798839623352286
Energy: 0.26422203945479256
Energy: 0.2922046965404415
Energy: 0.29398978332679754
Energy: 0.2922046965404415
Energy: 0.29398978332679754
Energy: 0.29220469653960335
Energy: 0.29398978332679754

minimum gb energy = 0.2567228631849505 eV
minimum distance =  2.65970739708137 Angstroms
sigma value = 17


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

Energy: 0.3162751200627438
Energy: 0.28643862123089675
Energy: 0.31098452736446514
Energy: 0.286438621231544
Energy: 0.31627512006598013
Energy: 0.286438621231544
Energy: 0.3320585893967605
Energy: 0.28387757070009334
Energy: 0.3189675248070729
Energy: 0.2838775706965333
Energy: 0.3320585893993496
Energy: 0.2838775706971805
Energy: 0.30628755880077724
Energy: 0.28759962214240486
Energy: 0.31159207582518195
Energy: 0.28759962213852125
Energy: 0.30628755880110087
Energy: 0.2875996221388449
Energy: 0.3428055033172294
Energy: 0.29247798536308883
Energy: 0.34281388452578515
Energy: 0.2924779853543506
Energy: 0.3428055033207895
Energy: 0.2924779853559688
Energy: 0.3235952099165397
Energy: 0.27216662315565926
Energy: 0.3235952099181579
Energy: 0.2721666231546884
Energy: 0.32359520991459784
Energy: 0.2721666231546884
Energy: 0.2826032195906547
Energy: 0.26242480860186823
Energy: 0.2831759922478835
Energy: 0.2624248086073701
Energy: 0.2826032195922729
Energy: 0.26242480860381
Energy: 0.2824197496469208
Energy: 0.28004319876189654
Energy: 0.2824197496443317
Energy: 0.2800431987580129
Energy: 0.2824197496469208
Energy: 0.2800431987596311
Energy: 0.3519795606887455
Energy: 0.33536408257642353
Energy: 0.3519795606861564
Energy: 0.335364082578689
Energy: 0.3519795606874509
Energy: 0.33536408257804173
Energy: 0.2818288444586289
Energy: 0.2644105374443952
Energy: 0.2818288444589525
Energy: 0.26441053743662785
Energy: 0.2818288444583052
Energy: 0.2644105374372751
Energy: 0.27977631687627724
Energy: 0.26061836499079016
Energy: 0.27977631687919
Energy: 0.26061836498917196
Energy: 0.2797763168804846
Energy: 0.26061836498917196
Energy: 0.2617890516910341
Energy: 0.3255652548825245
Energy: 0.2617890516936232
Energy: 0.32556525487831717
Energy: 0.2617890516900632
Energy: 0.32556525487864085
Energy: 0.2926314393695433
Energy: 0.2755358958861293
Energy: 0.2926314393692196
Energy: 0.2755358958893657
Energy: 0.2926314393679251
Energy: 0.27553589589033667
Energy: 0.28923999877565554
Energy: 0.2786870622415742
Energy: 0.28923999877274276
Energy: 0.2786870622418978
Energy: 0.289239998777921
Energy: 0.27868706224222145
Energy: 0.2720930087557952
Energy: 0.3053640722859781
Energy: 0.27209300875097003
Energy: 0.3053640722837126
Energy: 0.2720930087493518
Energy: 0.3053640722837126
Energy: 0.29465642619379223
Energy: 0.34954809920881585
Energy: 0.29465849903325503
Energy: 0.34954809921011043
Energy: 0.29465642619249766
Energy: 0.34954809921011043
Energy: 0.2650063417249837
Energy: 0.30534208568535476
Energy: 0.2647904520087216
Energy: 0.30254197970896846
Energy: 0.2650063417207764
Energy: 0.305342085686002
Energy: 0.28346341190923624
Energy: 0.2987591498135264
Energy: 0.283463411907618
Energy: 0.2987591498099664
Energy: 0.28346341190729435
Energy: 0.2987591498099664
Energy: 0.29200178394045273
Energy: 0.34237430160718046
Energy: 0.292001783949191
Energy: 0.3423743016013549
Energy: 0.29200178394109993
Energy: 0.3423743016016786
Energy: 0.27121047502886675
Energy: 0.3241209709622487
Energy: 0.2712104750253067
Energy: 0.32412097096548514
Energy: 0.2712104750285431
Energy: 0.32412097096483783
Energy: 0.2802123033028554
Energy: 0.2554185769885213
Energy: 0.28021230330415
Energy: 0.2554185769859322
Energy: 0.2802123033025318
Energy: 0.25541857698560855
Energy: 0.28374362476462023
Energy: 0.31904320477298026
Energy: 0.28374362476332565
Energy: 0.31904320477233294
Energy: 0.2837436247613839
Energy: 0.3190432047742748
Energy: 0.27407814598458397
Energy: 0.3424000352487472
Energy: 0.2740781459890855
Energy: 0.3424000352464817
Energy: 0.2740781459862021
Energy: 0.3424000352464817
Energy: 0.2826199622231716
Energy: 0.2803514719641084
Energy: 0.28261996222381885
Energy: 0.28035147196475574
Energy: 0.2826199622222007
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Energy: 0.264095745164586
Energy: 0.3122949820657152
Energy: 0.2640957451652333
Energy: 0.3122949820676571
Energy: 0.26409574516361506
Energy: 0.3122949820650679
Energy: 0.29879594894519457
Energy: 0.34968204158710625
Energy: 0.29879594894487094
Energy: 0.34968204158969535
Energy: 0.2987959489426054
Energy: 0.3496820415893717
Energy: 0.294938249470924
Energy: 0.3115572408642715
Energy: 0.271840330885782
Energy: 0.3115572408597405
Energy: 0.29493824946606945
Energy: 0.3115572408597405
Energy: 0.29742437465469024
Energy: 0.2789170870645796
Energy: 0.28657583689090393
Energy: 0.27891708706328505
Energy: 0.2974243746569557
Energy: 0.2789170870629614
Energy: 0.3077433850860603
Energy: 0.34727426122996957
Energy: 0.3123857560995122
Energy: 0.34727426122511496
Energy: 0.3077433850792638
Energy: 0.34727426122511496
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Energy: 0.32980603154595556
Energy: 0.2609471703624428
Energy: 0.3298060315462792
Energy: 0.26088573315213637
Energy: 0.3298060315466028
Energy: 0.2815685473904782
Energy: 0.26136765276320373
Energy: 0.2815685473875654
Energy: 0.2613676527622329
Energy: 0.2815685473872418
Energy: 0.2613676527615856
Energy: 0.2852129763743351
Energy: 0.2624409333947399
Energy: 0.28521297638339704
Energy: 0.2624409333908562
Energy: 0.2852129763617132
Energy: 0.2624409333983
Energy: 0.33071588863617446
Energy: 0.3589998763878622
Energy: 0.33071588863487994
Energy: 0.3589998763846257
Energy: 0.3307158886345563
Energy: 0.3589998763843021
Energy: 0.2538396476759634
Energy: 0.2729214742469385
Energy: 0.2538396476698142
Energy: 0.2729214742453204
Energy: 0.2538396476678724
Energy: 0.272921474245644
Energy: 0.28791770556816515
Energy: 0.270617661535412
Energy: 0.28791770556881247
Energy: 0.27061766153508837
Energy: 0.28791770557010704
Energy: 0.2706176615357357
Energy: 0.3223967627316159
Energy: 0.2695258939967069
Energy: 0.3223967627338814
Energy: 0.2695258939915287
Energy: 0.3223967627338814
Energy: 0.26952589398991045
Energy: 0.2628775236905853
Energy: 0.2784696388540108
Energy: 0.2628775236824943
Energy: 0.2784696389248585
Energy: 0.26287752369608713
Energy: 0.27846963906493566
Energy: 0.2935640421052343
Energy: 0.2825236609382107
Energy: 0.29356404210685255
Energy: 0.2825236609404762
Energy: 0.2935640421029689
Energy: 0.2825236609401525
Energy: 0.3217081827966824
Energy: 0.28990002218854344
Energy: 0.3217081827957115
Energy: 0.28990002218563066
Energy: 0.3217081827973297
Energy: 0.2899000221849834
Energy: 0.3109845273732034
Energy: 0.2864386212292785
Energy: 0.31098452737514526
Energy: 0.2864386212292785
Energy: 0.3109845273667306
Energy: 0.2864386212299258
Energy: 0.31896752481063295
Energy: 0.2709927067577556
Energy: 0.31896752480869106
Energy: 0.2709927067541956
Energy: 0.31896752480480745
Energy: 0.270992706753872
Energy: 0.31406136201971546
Energy: 0.2875204872570351
Energy: 0.3140665491830247
Energy: 0.28752048725574053
Energy: 0.31406136201971546
Energy: 0.28752048725574053
Energy: 0.3430315314396322
Energy: 0.2865241450969453
Energy: 0.343030513050942
Energy: 0.2865241450995344
Energy: 0.3430315314412504
Energy: 0.28652414509629803
Energy: 0.32359520991492147
Energy: 0.27223533776925507
Energy: 0.3235952099136269
Energy: 0.2722353377721678
Energy: 0.32359520991233237
Energy: 0.2722353377708733

minimum gb energy = 0.2538396476678724 eV
minimum distance =  2.63866039466012 Angstroms
sigma value = 57


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

Energy: 0.3550954928475866
Energy: 0.2674709244565035
Energy: 0.35509549284705966
Energy: 0.2674709244522879
Energy: 0.3550954928465328
Energy: 0.2674709244565035
Energy: 0.2983544119455495
Energy: 0.25946717059354485
Energy: 0.2983544119439686
Energy: 0.25946717059670665
Energy: 0.2983544119439686
Energy: 0.25946717059249097
Energy: 0.28170098640373187
Energy: 0.26975235853199175
Energy: 0.28170098640425884
Energy: 0.26975235853199175
Energy: 0.2817009864032049
Energy: 0.26975235853199175
Energy: 0.3293533372039238
Energy: 0.27007330386553663
Energy: 0.32935333720445076
Energy: 0.2700733038650096
Energy: 0.3293533372055047
Energy: 0.27007330386448264
Energy: 0.3021756816070295
Energy: 0.24058974382078868
Energy: 0.30217568161019126
Energy: 0.24058974384498108
Energy: 0.30217568160966424
Energy: 0.24058974383448972
Energy: 0.2650533732138389
Energy: 0.2630766337582767
Energy: 0.265053373212785
Energy: 0.2630766337582767
Energy: 0.2650533732138389
Energy: 0.2630766337588037
Energy: 0.29741747081597153
Energy: 0.26750352238586783
Energy: 0.2974174708470623
Energy: 0.26750352238534086
Energy: 0.2974174708191333
Energy: 0.26750352238586783
Energy: 0.3201150054648553
Energy: 0.31617876821916385
Energy: 0.32011500546538224
Energy: 0.3161787682196908
Energy: 0.32011500546380134
Energy: 0.31617876821863683
Energy: 0.2570381489549672
Energy: 0.2597813775611231
Energy: 0.2570381489533863
Energy: 0.2597813775616501
Energy: 0.25703814895654803
Energy: 0.259781377562177
Energy: 0.26654893573613125
Energy: 0.2598734633071387
Energy: 0.2665489357382392
Energy: 0.2598734633076656
Energy: 0.2665489357356043
Energy: 0.2598734633071387
Energy: 0.3227940960822912
Energy: 0.31966486430102997
Energy: 0.32279409608123727
Energy: 0.3196648643015569
Energy: 0.3227940960807103
Energy: 0.31966486430102997
Energy: 0.26379023388436956
Energy: 0.2965920712380102
Energy: 0.2637902338827887
Energy: 0.2965920712448607
Energy: 0.2637902338827887
Energy: 0.2965920712390641
Energy: 0.26746964003186
Energy: 0.27463641960228213
Energy: 0.26746964003133306
Energy: 0.27463641960228213
Energy: 0.26746964003186
Energy: 0.2746364196028091
Energy: 0.24698424863301371
Energy: 0.3032361042740735
Energy: 0.24698424863406768
Energy: 0.3032361042740735
Energy: 0.2469842486303789
Energy: 0.3032361042740735
Energy: 0.2804532714847385
Energy: 0.3338361880259694
Energy: 0.2804532714863194
Energy: 0.33383618802649634
Energy: 0.2804532714868463
Energy: 0.3338361880270233
Energy: 0.2639475496771202
Energy: 0.3001512884680625
Energy: 0.26394754967659323
Energy: 0.3001512884680625
Energy: 0.2639475496771202
Energy: 0.30015128846858946
Energy: 0.2700382006705068
Energy: 0.3006080101693754
Energy: 0.2700382006757765
Energy: 0.3006080101693754
Energy: 0.27003820068315393
Energy: 0.3006080101693754
Energy: 0.28181927927683975
Energy: 0.33689522134159017
Energy: 0.2818192792789476
Energy: 0.33689522134106326
Energy: 0.28181927927631284
Energy: 0.33689522134106326
Energy: 0.25062898361460273
Energy: 0.3133714085525076
Energy: 0.25062898361671054
Energy: 0.3133714085519807
Energy: 0.2506289836082792
Energy: 0.3133714085525076
Energy: 0.25041462197089437
Energy: 0.26673846320834244
Energy: 0.25041462198406844
Energy: 0.26673846320834244
Energy: 0.2504146219851224
Energy: 0.26673846320834244
Energy: 0.2697557091006361
Energy: 0.32643758649051263
Energy: 0.26975570907059926
Energy: 0.3264375864894587
Energy: 0.2697557092128313
Energy: 0.3264375864899857
Energy: 0.24978164627456925
Energy: 0.31877244767661167
Energy: 0.24978164627562316
Energy: 0.31877244767661167
Energy: 0.24978164627615013
Energy: 0.31877244767661167
Energy: 0.2699307820995789
Energy: 0.26316920402624716
Energy: 0.26993078209536314
Energy: 0.26316920402624716
Energy: 0.2699307820948361
Energy: 0.26316920402624716
Energy: 0.2740189042935262
Energy: 0.3232082911657654
Energy: 0.2740189042940532
Energy: 0.3232082911657654
Energy: 0.2740189042924723
Energy: 0.32320829116629235
Energy: 0.2656560951981476
Energy: 0.33245343526093174
Energy: 0.26565609520183625
Energy: 0.33245343526093174
Energy: 0.2656560952007823
Energy: 0.33245343526093174
Energy: 0.27135320853701955
Energy: 0.26375285268324183
Energy: 0.2713532085359657
Energy: 0.26375285268271487
Energy: 0.27135320853543865
Energy: 0.26375285268324183
Energy: 0.25373291314211904
Energy: 0.31315932802982244
Energy: 0.25373291314211904
Energy: 0.31315932802982244
Energy: 0.253732913142646
Energy: 0.3131593280303494

minimum gb energy = 0.24058974382078868 eV
minimum distance =  2.64591380553879 Angstroms
sigma value = 43


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

Energy: 0.3351115037340299
Energy: 0.24847559264942892
Energy: 0.335111503733646
Energy: 0.2484755926498129
Energy: 0.335111503733646
Energy: 0.24847559264866104
Energy: 0.2673781782714821
Energy: 0.24743710657171913
Energy: 0.2673781782714821
Energy: 0.2474371065690315
Energy: 0.2673781782718661
Energy: 0.24743710657095125
Energy: 0.2583453105021174
Energy: 0.25393122742658714
Energy: 0.25834531050288523
Energy: 0.25393122742620317
Energy: 0.2583453105017334
Energy: 0.25393122742697105
Energy: 0.31289546646099303
Energy: 0.24245817929396807
Energy: 0.3128954664617609
Energy: 0.24245817929511995
Energy: 0.31289546646137695
Energy: 0.24245817929473598
Energy: 0.2694430753817685
Energy: 0.24055907829751635
Energy: 0.26944307536602663
Energy: 0.24055907829905213
Energy: 0.2694430753652587
Energy: 0.24055907829674844
Energy: 0.2353958745032668
Energy: 0.24118649552781563
Energy: 0.23539587450403468
Energy: 0.24118649552935142
Energy: 0.2353958745044186
Energy: 0.24118649552896745
Energy: 0.2935866860678991
Energy: 0.23619271995389704
Energy: 0.293586686068667
Energy: 0.23619271995197727
Energy: 0.2935866860678991
Energy: 0.23619271995197727
Energy: 0.2710697070113874
Energy: 0.2417120061516517
Energy: 0.2710697070125392
Energy: 0.24171200615203564
Energy: 0.27106970701215527
Energy: 0.24171200615241956
Energy: 0.23091566117508003
Energy: 0.23497984380580236
Energy: 0.2309156611758479
Energy: 0.2349798438061863
Energy: 0.23091566117508003
Energy: 0.23497984380810605
Energy: 0.24831528856502544
Energy: 0.2307414572023787
Energy: 0.24831528856848098
Energy: 0.23074145720199474
Energy: 0.24831528856963284
Energy: 0.23074145720314657
Energy: 0.28727713538291283
Energy: 0.2751242317258324
Energy: 0.28727713538329674
Energy: 0.2751242317266003
Energy: 0.28727713538329674
Energy: 0.2751242317242967
Energy: 0.2276549654965548
Energy: 0.23564369557318438
Energy: 0.22765496549693875
Energy: 0.23564369557280043
Energy: 0.22765496549693875
Energy: 0.23564369557318438
Energy: 0.25448416586812855
Energy: 0.22766159476056722
Energy: 0.2544841658708162
Energy: 0.22766159476095116
Energy: 0.25448416586736067
Energy: 0.22766159476095116
Energy: 0.2908619640568904
Energy: 0.28496341495438854
Energy: 0.2908619640561225
Energy: 0.28496341495438854
Energy: 0.2908619640576583
Energy: 0.28496341495438854
Energy: 0.23164439193148498
Energy: 0.2459708091487105
Energy: 0.23164439193302075
Energy: 0.24597080914602285
Energy: 0.23164439193186892
Energy: 0.24597080915446967
Energy: 0.24500778788773372
Energy: 0.23605881836922643
Energy: 0.24500778788581395
Energy: 0.23605881836999434
Energy: 0.24500778788696584
Energy: 0.23605881836922643
Energy: 0.2495138609932741
Energy: 0.2741946061891696
Energy: 0.24951386099135436
Energy: 0.2741946061953128
Energy: 0.24951386099289014
Energy: 0.2741946061907054
Energy: 0.23893356643978453
Energy: 0.23053458211530367
Energy: 0.23893356644016844
Energy: 0.2305345820788636
Energy: 0.2389335664405524
Energy: 0.23053458206619334
Energy: 0.2235977821200975
Energy: 0.24565225102205643
Energy: 0.2235977821185617
Energy: 0.24565225102205643
Energy: 0.2235977821197136
Energy: 0.24565225102205643
Energy: 0.2502567682989317
Energy: 0.26056841188303353
Energy: 0.25025676829931565
Energy: 0.2605684118857211
Energy: 0.25025676830353905
Energy: 0.26056841188380137
Energy: 0.2518434192506475
Energy: 0.2369445136272439
Energy: 0.25184341925179937
Energy: 0.23694451363108332
Energy: 0.2518434192502636
Energy: 0.23694451361687727
Energy: 0.25586845549994486
Energy: 0.26757916497052
Energy: 0.25586845550071274
Energy: 0.26757916497013595
Energy: 0.2558684554995609
Energy: 0.26757916497052
Energy: 0.2481334743773075
Energy: 0.26685582232676
Energy: 0.2481334743723162
Energy: 0.26685582232676
Energy: 0.24813347437500383
Energy: 0.26685582232676
Energy: 0.25527623481294404
Energy: 0.23641433839737797
Energy: 0.2552762348148638
Energy: 0.23641433896879638
Energy: 0.255276234813328
Energy: 0.2364143384307465
Energy: 0.24325981911094655
Energy: 0.2669501983533933
Energy: 0.24325981911209835
Energy: 0.2669501983537773
Energy: 0.24325981911094655
Energy: 0.2669501983533933
Energy: 0.23784746223060244
Energy: 0.24110484760186968
Energy: 0.23784746223252218
Energy: 0.24110484760186968
Energy: 0.23784746223175426
Energy: 0.24110484760148573
Energy: 0.2407468370831661
Energy: 0.30732747340998184
Energy: 0.24074683708431793
Energy: 0.30732747340998184
Energy: 0.2407468370847019
Energy: 0.30732747340959793
Energy: 0.21432593308532233
Energy: 0.264837351883347
Energy: 0.2143259330761076
Energy: 0.2648373518825791
Energy: 0.21432593307764336
Energy: 0.2648373518825791
Energy: 0.23839128137957277
Energy: 0.230047788097951
Energy: 0.23839128137957277
Energy: 0.230047788097951
Energy: 0.23839128137957277
Energy: 0.230047788097951
Energy: 0.22988723164298808
Energy: 0.294619647823691
Energy: 0.22988723164298808
Energy: 0.294619647823691
Energy: 0.22988723164337205
Energy: 0.294619647823691
Energy: 0.21846115522232873
Energy: 0.2644326909922324
Energy: 0.21846115522540036
Energy: 0.26443269099184846
Energy: 0.21846115522232873
Energy: 0.2644326909941521
Energy: 0.23845065274629404
Energy: 0.229996770866645
Energy: 0.23845065274706193
Energy: 0.229996770866645
Energy: 0.23845065274629404
Energy: 0.2299967708670289
Energy: 0.2278088575273855
Energy: 0.2792149845993673
Energy: 0.22780885752546576
Energy: 0.27921498460090305
Energy: 0.22780885752623364
Energy: 0.27921498460051913
Energy: 0.2404911083144152
Energy: 0.2863080998546253
Energy: 0.2404911083121115
Energy: 0.28630809985308947
Energy: 0.2404911083144152
Energy: 0.28630809985424127
Energy: 0.24679745715905502
Energy: 0.22683168284391167
Energy: 0.24679745715828708
Energy: 0.22683168284544744
Energy: 0.24679745715867105
Energy: 0.22683168284429558
Energy: 0.21353531384196214
Energy: 0.25811261636975746
Energy: 0.21353531384157817
Energy: 0.2581126163689896
Energy: 0.2135353138423461
Energy: 0.2581126163705254

minimum gb energy = 0.21353531384157817 eV
minimum distance =  2.65054885251815 Angstroms
sigma value = 81


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

Energy: 0.0532012421860926
Energy: 0.07115184796462577
Energy: 0.0532012421860926
Energy: 0.07115184796433723
Energy: 0.0532012421860926
Energy: 0.07115184796475402
Energy: 0.15145836066003474
Energy: 0.07787109286695454
Energy: 0.1514583606604515
Energy: 0.07787109286751563
Energy: 0.15145836066003474
Energy: 0.07787109286737133
Energy: 0.15146111257644654
Energy: 0.07829530779842767
Energy: 0.15146111257671907
Energy: 0.07829530779857194
Energy: 0.15146111257671907
Energy: 0.07829530779842767
Energy: 0.0532012421860926
Energy: 0.0711518479648983
Energy: 0.0532012421860926
Energy: 0.07115184796433723
Energy: 0.05320124218594833
Energy: 0.0711518479648983
Energy: 0.15145836066086835
Energy: 0.07787109286751563
Energy: 0.15145836065989046
Energy: 0.07787109286751563
Energy: 0.15145836066003474
Energy: 0.0778710928676599
Energy: 0.15146111257686332
Energy: 0.07829530779842767
Energy: 0.1514611125765908
Energy: 0.07829530779857194
Energy: 0.15146111257671907
Energy: 0.07829530779857194
Energy: 0.05320124218594833
Energy: 0.07115184796475402
Energy: 0.0532012421860926
Energy: 0.07115184796518685
Energy: 0.05320124218594833
Energy: 0.0711518479648983
Energy: 0.15145836066030727
Energy: 0.0778710928680767
Energy: 0.15145836066003474
Energy: 0.07787109286780418
Energy: 0.15145836066003474
Energy: 0.07787109286793241
Energy: 0.15146111257686332
Energy: 0.07829530779842767
Energy: 0.1514611125765908
Energy: 0.07829530779842767
Energy: 0.1514611125765908
Energy: 0.07829530779842767
Energy: 0.05320124218594833
Energy: 0.07115184796462577
Energy: 0.05320124218594833
Energy: 0.07115184796475402
Energy: 0.0532012421860926
Energy: 0.0711518479644815

minimum gb energy = 0.05320124218594833 eV
minimum distance =  2.83629397454537 Angstroms
sigma value = 3


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

Energy: 0.3095530613532697
Energy: 0.23935889736406446
Energy: 0.30955306135284755
Energy: 0.23935889736406446
Energy: 0.3095530613532697
Energy: 0.23935889736406446
Energy: 0.25036359963498156
Energy: 0.22518303414060015
Energy: 0.2503635996354037
Energy: 0.22518303412415508
Energy: 0.2503635996345594
Energy: 0.22518303413933366
Energy: 0.28162948080585176
Energy: 0.2247057915608322
Energy: 0.28162948080585176
Energy: 0.22470579156209866
Energy: 0.26918729861009516
Energy: 0.22470579156252082
Energy: 0.28694362959602693
Energy: 0.2398425796732099
Energy: 0.28694362959602693
Energy: 0.23984257967278777
Energy: 0.28694362959602693
Energy: 0.23984257967278777
Energy: 0.2148380831045335
Energy: 0.24989390652749988
Energy: 0.2148380831053778
Energy: 0.24989390653254664
Energy: 0.21483808310495567
Energy: 0.2498939065304358
Energy: 0.24013746977694259
Energy: 0.22018342699920398
Energy: 0.24013746977905337
Energy: 0.22018342681268618
Energy: 0.24013746977863118
Energy: 0.22018342664812063
Energy: 0.2759474952991912
Energy: 0.2387881667699162
Energy: 0.27594749529876905
Energy: 0.2387881667699162
Energy: 0.2759474952991912
Energy: 0.23878816677033837
Energy: 0.21505803424262554
Energy: 0.25270841766938446
Energy: 0.2150580342422034
Energy: 0.2527084176668514
Energy: 0.21505803424262554
Energy: 0.2527084176681179
Energy: 0.24183419898054703
Energy: 0.2463157521096033
Energy: 0.24183419898012487
Energy: 0.2463157521096033
Energy: 0.24183419898181355
Energy: 0.2463157521091811
Energy: 0.2451564637529242
Energy: 0.22667617253290806
Energy: 0.2451564637529242
Energy: 0.22667617253290806
Energy: 0.24515646375250202
Energy: 0.22667617253248593
Energy: 0.22740531534472483
Energy: 0.2513189235472242
Energy: 0.227405315345147
Energy: 0.25131892354933494
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Energy: 0.2513189235476463
Energy: 0.25001195954113214
Energy: 0.2500338454674607
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Energy: 0.2500119595415543
Energy: 0.2500338454678829
Energy: 0.25246561458967376
Energy: 0.21547089756502785
Energy: 0.2524656145892516
Energy: 0.21547089756502785
Energy: 0.25246561458967376
Energy: 0.21547089756545001
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Energy: 0.2702269076305085
Energy: 0.23336837128550955
Energy: 0.2702269076309307
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Energy: 0.2702269076305085
Energy: 0.23350236552366155
Energy: 0.2762801223714351
Energy: 0.23350236552239506
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Energy: 0.233502365524928
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Energy: 0.237632286473826
Energy: 0.21267947035162663
Energy: 0.23763228647340384
Energy: 0.21267947035120444
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Energy: 0.24965244269083076
Energy: 0.262721214866185
Energy: 0.24965244269207804
Energy: 0.2627212148674323
Energy: 0.24965244269125286
Energy: 0.2627212148670101
Energy: 0.24995584049164238
Energy: 0.2206075508630236
Energy: 0.2499558404958448
Energy: 0.22060755086217926
Energy: 0.24995584049204536
Energy: 0.22060755086260145
Energy: 0.2442596614866008
Energy: 0.2949070617737204
Energy: 0.2442596614866008
Energy: 0.2949070617737204
Energy: 0.2442596614866008
Energy: 0.2949070617737204
Energy: 0.2653484626256202
Energy: 0.25089273376265964
Energy: 0.26534846262646444
Energy: 0.25089273376181526
Energy: 0.2653484626256202
Energy: 0.2508927337622375
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Energy: 0.25754931774706663
Energy: 0.23812984418048497
Energy: 0.25754931774706663
Energy: 0.2381298441792185
Energy: 0.25754931774706663
Energy: 0.2456788191837885
Energy: 0.29672587979951337
Energy: 0.2456788191846328
Energy: 0.29672587979951337
Energy: 0.2456788191837885
Energy: 0.2967258797999356
Energy: 0.23458209071436267
Energy: 0.21918691257815223
Energy: 0.23458209071647346
Energy: 0.21918691257773007
Energy: 0.234582090715207
Energy: 0.21918691257730796
Energy: 0.23784127448840078
Energy: 0.24424992829079908
Energy: 0.23784127451919929
Energy: 0.24424992829079908
Energy: 0.23784127450993095
Energy: 0.24424992829079908
Energy: 0.23379851255201337
Energy: 0.2783959634561804
Energy: 0.23379851255285766
Energy: 0.2783959634561804
Energy: 0.23379851255243553
Energy: 0.2783959634561804
Energy: 0.2807822231083274
Energy: 0.21951906481255895
Energy: 0.2807822231087496
Energy: 0.2195190648112925
Energy: 0.2807822231091718
Energy: 0.21951906480833736
Energy: 0.2455811855215682
Energy: 0.24219182311631102
Energy: 0.2455811855283228
Energy: 0.24219182311588885
Energy: 0.2455811855270563
Energy: 0.24219182311588885
Energy: 0.22576354685682865
Energy: 0.25412868227629015
Energy: 0.22576354685725084
Energy: 0.2541286822737571
Energy: 0.22576354685725084
Energy: 0.25412868227502367
Energy: 0.2834178488310888
Energy: 0.23018847418395405
Energy: 0.28341784883151094
Energy: 0.23018847418268754
Energy: 0.28341784883151094
Energy: 0.2301884741835319
Energy: 0.2738148651737955
Energy: 0.23851432936136688
Energy: 0.2738148651737955
Energy: 0.2385143293630555
Energy: 0.27381486517421766
Energy: 0.23851432936263336
Energy: 0.2217321626254984
Energy: 0.23216119309201902
Energy: 0.22173216262507625
Energy: 0.23216119308779745
Energy: 0.22173216262592058
Energy: 0.23216119308779745
Energy: 0.2709034531908352
Energy: 0.2367851333067733
Energy: 0.2709034531908352
Energy: 0.23678513330635118
Energy: 0.27090345319041303
Energy: 0.2367851333067733

minimum gb energy = 0.21267947035120444 eV
minimum distance =  2.65877534527772 Angstroms
sigma value = 67


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

Energy: 0.3230619641349245
Energy: 0.287029543977587
Energy: 0.323061964135526
Energy: 0.2870295439763839
Energy: 0.3230619641349245
Energy: 0.28702954397818853
Energy: 0.2834016437225
Energy: 0.26569213166564026
Energy: 0.28340164372189847
Energy: 0.26569213166864797
Energy: 0.2834016437225
Energy: 0.265692131669851
Energy: 0.3077700515431119
Energy: 0.2650076860482328
Energy: 0.30777005154251036
Energy: 0.2650076860464282
Energy: 0.30777005154251036
Energy: 0.26500768605304503
Energy: 0.30633281199555407
Energy: 0.2738096308081323
Energy: 0.30633281199675716
Energy: 0.2738096308081323
Energy: 0.3063328119961556
Energy: 0.2738096308081323
Energy: 0.24556744372511657
Energy: 0.2779550450435632
Energy: 0.24556744372451503
Energy: 0.2779550450435632
Energy: 0.24556744372451503
Energy: 0.27795504504296165
Energy: 0.292337999768796
Energy: 0.28106000567381345
Energy: 0.29233799976759295
Energy: 0.28106000567501654
Energy: 0.29233799976759295
Energy: 0.2810600056756181
Energy: 0.28405536299576517
Energy: 0.2680404019904351
Energy: 0.28405536299636663
Energy: 0.2680404019904351
Energy: 0.28405536299576517
Energy: 0.2680404019904351
Energy: 0.27085052366831397
Energy: 0.27536603879893967
Energy: 0.27085052366831397
Energy: 0.27536603879833815
Energy: 0.2708505236713217
Energy: 0.2753660387995412
Energy: 0.2702133745795039
Energy: 0.3153076438223746
Energy: 0.2702133745848903
Energy: 0.3153076438223746
Energy: 0.2702133745830857
Energy: 0.31530764382177306
Energy: 0.2668038426369417
Energy: 0.25351760514190663
Energy: 0.26680384262914913
Energy: 0.25351760514190663
Energy: 0.2668038426303522
Energy: 0.25351760514250815
Energy: 0.27453697182845926
Energy: 0.3017069094881354
Energy: 0.27453697182845926
Energy: 0.30170690948873685
Energy: 0.2745369718278577
Energy: 0.30170690948873685
Energy: 0.2568428972494587
Energy: 0.2986640583482953
Energy: 0.2568428972446738
Energy: 0.29866405834889687
Energy: 0.2568428972530679
Energy: 0.29866405834889687
Energy: 0.27986284114797755
Energy: 0.24818509143253376
Energy: 0.2798628411491806
Energy: 0.24818509143373682
Energy: 0.279862841147376
Energy: 0.24818509143253376
Energy: 0.2747180341058775
Energy: 0.31432883395865435
Energy: 0.27471803410647905
Energy: 0.31432883395865435
Energy: 0.27471803410527595
Energy: 0.31432883395865435
Energy: 0.28254946489271704
Energy: 0.2813702000059554
Energy: 0.28254946489331856
Energy: 0.281370200006557
Energy: 0.28254946489331856
Energy: 0.281370200006557
Energy: 0.2547690848688016
Energy: 0.29672252994678083
Energy: 0.25476908487241073
Energy: 0.29672252994678083
Energy: 0.2547690848682001
Energy: 0.29672252994678083
Energy: 0.27885058720732003
Energy: 0.3167749652301608
Energy: 0.27885058720732003
Energy: 0.3167749652301608
Energy: 0.27885058720732003
Energy: 0.3167749652301608
Energy: 0.2923541437883602
Energy: 0.24880108231239229
Energy: 0.29235414378896174
Energy: 0.24880108231179077
Energy: 0.29235414378956326
Energy: 0.24880108231179077
Energy: 0.3135436030469035
Energy: 0.2852321571526818
Energy: 0.3135436030469035
Energy: 0.28523215715388484
Energy: 0.31354360304630197
Energy: 0.2852321571532833
Energy: 0.24958109574096574
Energy: 0.27400774952754403
Energy: 0.2495810957433718
Energy: 0.27400774952694257
Energy: 0.24958109574397333
Energy: 0.27400774952453644
Energy: 0.3140576621233633
Energy: 0.2590091387716839
Energy: 0.3140576621239648
Energy: 0.2590091387716839
Energy: 0.3140576621245664
Energy: 0.25900913877108245
Energy: 0.3137038918712147
Energy: 0.28961267655147954
Energy: 0.31370389187061315
Energy: 0.2896126765532842
Energy: 0.3137038918712147
Energy: 0.2896126765532842
Energy: 0.2499402644394045
Energy: 0.2734650603196925
Energy: 0.24994026443880296
Energy: 0.2734650603167122
Energy: 0.24994026444000603
Energy: 0.2734650603052831

minimum gb energy = 0.24556744372451503 eV
minimum distance =  2.65810076488166 Angstroms
sigma value = 33


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

Energy: 0.33148917005799383
Energy: 0.2849375723814194
Energy: 0.33148917005799383
Energy: 0.2849375723814194
Energy: 0.33148917005875705
Energy: 0.2849375723814194
Energy: 0.2909814353623151
Energy: 0.28320199707881777
Energy: 0.2909814353615518
Energy: 0.2832019970772913
Energy: 0.2909814353619335
Energy: 0.28320199707385696
Energy: 0.30076666928841245
Energy: 0.3028057186757695
Energy: 0.3007666692845965
Energy: 0.30280571870706063
Energy: 0.30076666928574125
Energy: 0.3028057186711903
Energy: 0.31942822629118967
Energy: 0.2812067676126924
Energy: 0.31942822629042644
Energy: 0.2812067676126924
Energy: 0.31942822629118967
Energy: 0.281206767613074
Energy: 0.2792234575450957
Energy: 0.30324234972384956
Energy: 0.2792234575454773
Energy: 0.3032423497234679
Energy: 0.2792234575443325
Energy: 0.30324234972270475
Energy: 0.29354379500913114
Energy: 0.2974290418787575
Energy: 0.29354379501523675
Energy: 0.31393244523319924
Energy: 0.2935437950133287
Energy: 0.29742904187799424
Energy: 0.29161329870062247
Energy: 0.2788178719008394
Energy: 0.2916132986979513
Energy: 0.2788178719008394
Energy: 0.2916132986971881
Energy: 0.2788178719008394
Energy: 0.29343633544084957
Energy: 0.32051451842058737
Energy: 0.2934363354381784
Energy: 0.3205145184202058
Energy: 0.2934363354400864
Energy: 0.32051451842058737
Energy: 0.279566205708382
Energy: 0.32759565686260106
Energy: 0.27956620570800034
Energy: 0.3275956568622194
Energy: 0.27956620571067153
Energy: 0.3275956568622194
Energy: 0.34063684040585646
Energy: 0.28011303114261354
Energy: 0.34063684040433007
Energy: 0.28566059201194866
Energy: 0.34063684040547487
Energy: 0.2856605920127118
Energy: 0.29809040589918273
Energy: 0.3225769686226177
Energy: 0.2980904058999459
Energy: 0.3225769686226177
Energy: 0.2980904059003275
Energy: 0.3225769686226177
Energy: 0.2933222146448998
Energy: 0.2978454601983391
Energy: 0.2933222146448998
Energy: 0.29784546019757585
Energy: 0.29332221464566305
Energy: 0.2978454601983391
Energy: 0.33888958942919073
Energy: 0.2878260666947275
Energy: 0.33888958943033554
Energy: 0.2878260666951091
Energy: 0.33888958942957237
Energy: 0.2878260666951091
Energy: 0.30174903838922773
Energy: 0.3256974044494672
Energy: 0.3017490383877013
Energy: 0.3256974044494672
Energy: 0.3017490383896093
Energy: 0.32569740444908557
Energy: 0.30610520825710824
Energy: 0.3054815391702214
Energy: 0.30610520825710824
Energy: 0.3054815391702214
Energy: 0.30610520825710824
Energy: 0.30548153917060306
Energy: 0.31934429276017484
Energy: 0.29904268975456144
Energy: 0.3193442927605564
Energy: 0.2990426897537982
Energy: 0.31934429276017484
Energy: 0.29904268975456144
Energy: 0.2720703479938412
Energy: 0.2944854303742421
Energy: 0.27207034799498603
Energy: 0.29448543037347885
Energy: 0.2720703479942228
Energy: 0.29448543037462366
Energy: 0.3300952373441702
Energy: 0.2999197714560468
Energy: 0.3300952373437886
Energy: 0.29991977145452037
Energy: 0.330095237343407
Energy: 0.2999197714541388
Energy: 0.29173225390658597
Energy: 0.29778680770069127
Energy: 0.29173225390658597
Energy: 0.2977868077010729
Energy: 0.29173225390582286
Energy: 0.29778680770069127
Energy: 0.2933825538338414
Energy: 0.30194686382607827
Energy: 0.2933825538334598
Energy: 0.30194686382836783
Energy: 0.2933825538334598
Energy: 0.30194686382874947
Energy: 0.29233324949304756
Energy: 0.29791128052760724
Energy: 0.2923332494961003
Energy: 0.2979112805203568
Energy: 0.2923332494945739
Energy: 0.29791128051921206
Energy: 0.3086154160461048
Energy: 0.261358651407435
Energy: 0.3086154160461048
Energy: 0.261358651407435
Energy: 0.308615416046868
Energy: 0.261358651407435
Energy: 0.29482426535752615
Energy: 0.32258356045351627
Energy: 0.29482426535676304
Energy: 0.32258356045351627
Energy: 0.2948242653579078
Energy: 0.3225835604531347
Energy: 0.3392674423393867
Energy: 0.29901001978779235
Energy: 0.3392674423393867
Energy: 0.29901001978893715
Energy: 0.33926744233976835
Energy: 0.29901001978855557
Energy: 0.26611594359679697
Energy: 0.2968314202738206
Energy: 0.2661159435983234
Energy: 0.296831420273439
Energy: 0.2661159435964154
Energy: 0.2968314202738206
Energy: 0.29576265383579614
Energy: 0.3205469550951506
Energy: 0.2957626538346514
Energy: 0.32054695509438735
Energy: 0.2957626538346514
Energy: 0.32054695509476894
Energy: 0.2915633245137884
Energy: 0.2590104628422283
Energy: 0.291563324512262
Energy: 0.25901046284184664
Energy: 0.2915633245126436
Energy: 0.2590104628410835
Energy: 0.29132737955954763
Energy: 0.2916143493484582
Energy: 0.29132737956489
Energy: 0.291614349345787
Energy: 0.29132737955954763
Energy: 0.29161434934616853
Energy: 0.2960221191587886
Energy: 0.303519157574629
Energy: 0.2960221191587886
Energy: 0.30351915757501063
Energy: 0.2960221191587886
Energy: 0.303519157574629
Energy: 0.29419811013725844
Energy: 0.28173592422097565
Energy: 0.29419811013611363
Energy: 0.28173592422097565
Energy: 0.29419811013764
Energy: 0.28173592422097565
Energy: 0.332121469481687
Energy: 0.32091476406620845
Energy: 0.332121469481687
Energy: 0.320914764064682
Energy: 0.332121469481687
Energy: 0.3209147640654453
Energy: 0.2776135995399686
Energy: 0.30165997137425016
Energy: 0.2776135995418766
Energy: 0.30165997136814454
Energy: 0.2776135995407318
Energy: 0.30165997137081574
Energy: 0.3182065669945675
Energy: 0.2974114492620929
Energy: 0.3182065669949492
Energy: 0.2974114492620929
Energy: 0.3182065669949492
Energy: 0.29741144926171137
Energy: 0.305248921592155
Energy: 0.2832926665479328
Energy: 0.30524892159329986
Energy: 0.283292666548696
Energy: 0.30524892159291817
Energy: 0.2832926665433536
Energy: 0.29939148656130987
Energy: 0.30198685545689447
Energy: 0.2993914865609283
Energy: 0.3019868554565129
Energy: 0.2993914865609283
Energy: 0.30198685545613124
Energy: 0.33274674022627937
Energy: 0.285271985313461
Energy: 0.33274674022666095
Energy: 0.285271985313461
Energy: 0.33274674022627937
Energy: 0.285271985313461
Energy: 0.29189273795239257
Energy: 0.30023961010371514
Energy: 0.291892737952011
Energy: 0.30023961010371514
Energy: 0.29189273795239257
Energy: 0.30023961010333355

minimum gb energy = 0.2590104628410835 eV
minimum distance =  2.63437081927181 Angstroms
sigma value = 41


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

Energy: 0.3405484679193598
Energy: 0.3232139020096787
Energy: 0.3405484679193598
Energy: 0.3232139020096787
Energy: 0.3405484679193598
Energy: 0.3232139020096787
Energy: 0.3219262031589565
Energy: 0.33414329066071524
Energy: 0.3219262031579146
Energy: 0.33414329066071524
Energy: 0.3219262031579146
Energy: 0.3341432906617571
Energy: 0.31745005371624785
Energy: 0.342262136225381
Energy: 0.34416418926615167
Energy: 0.342262136225381
Energy: 0.36978116374594333
Energy: 0.342262136225381
Energy: 0.34710010695834914
Energy: 0.3351226299140733
Energy: 0.34710010695834914
Energy: 0.3351226299140733
Energy: 0.34710010695834914
Energy: 0.3351226299140733
Energy: 0.3144203892420044
Energy: 0.32962180357037874
Energy: 0.3144203892420044
Energy: 0.3296218035724625
Energy: 0.3144203892420044
Energy: 0.32962180356933685
Energy: 0.3584920760195623
Energy: 0.34194466309642246
Energy: 0.35849207601852034
Energy: 0.3419446630953805
Energy: 0.3584920760195623
Energy: 0.3419446630953805
Energy: 0.3495903963936511
Energy: 0.3158042749875437
Energy: 0.3495903963936511
Energy: 0.3158042749865018
Energy: 0.3495903963936511
Energy: 0.3158042749875437
Energy: 0.34194105301849487
Energy: 0.33893530715788195
Energy: 0.34194105301849487
Energy: 0.33893530715788195
Energy: 0.34194105301849487
Energy: 0.33893530715788195
Energy: 0.323383712672251
Energy: 0.3125776114903207
Energy: 0.323383712672251
Energy: 0.3125776114903207
Energy: 0.323383712672251
Energy: 0.3125776114913626
Energy: 0.3448327430935783
Energy: 0.3251958465006284
Energy: 0.3448327430935783
Energy: 0.3251958465006284
Energy: 0.3448327430925364
Energy: 0.32519584649958655
Energy: 0.3243859827222184
Energy: 0.3420376275914855
Energy: 0.3243859827222184
Energy: 0.3420376275914855
Energy: 0.3243859827222184
Energy: 0.3420376275914855
Energy: 0.31071544962259956
Energy: 0.3340211020967583
Energy: 0.31071544962259956
Energy: 0.33402110209884206
Energy: 0.3107154496205158
Energy: 0.33402110209780017
Energy: 0.35776556239398427
Energy: 0.33888552805698363
Energy: 0.35776556239398427
Energy: 0.3388855280559417
Energy: 0.35776556239398427
Energy: 0.33888552805698363
Energy: 0.3105326463875451
Energy: 0.3394166012567536
Energy: 0.3105326463875451
Energy: 0.3394166012567536
Energy: 0.3105326463875451
Energy: 0.3394166012557117

minimum gb energy = 0.3105326463875451 eV
minimum distance =  2.61946837540344 Angstroms
sigma value = 11


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

Energy: 0.3780908103345049
Energy: 0.36520278320876925
Energy: 0.3780908103345049
Energy: 0.36520278320876925
Energy: 0.3780908103345049
Energy: 0.36520278320876925
Energy: 0.33114312481376074
Energy: 0.35702507421416907
Energy: 0.33114312481330305
Energy: 0.35702507421371144
Energy: 0.3311431248142184
Energy: 0.35702507421416907
Energy: 0.3802545060112787
Energy: 0.3552502809349074
Energy: 0.3438598132527194
Energy: 0.3552502809349074
Energy: 0.3438598132522617
Energy: 0.3552502809349074
Energy: 0.36055550756509225
Energy: 0.3293484546450566
Energy: 0.36055550756509225
Energy: 0.3293484546450566
Energy: 0.36055550756509225
Energy: 0.3293484546450566
Energy: 0.3452032759542409
Energy: 0.36034996007681314
Energy: 0.3452032759524101
Energy: 0.36034996007681314
Energy: 0.3452032759524101
Energy: 0.36034996007681314
Energy: 0.3386359996093236
Energy: 0.37301853541894625
Energy: 0.33863599960978125
Energy: 0.37301853541894625
Energy: 0.33863599960978125
Energy: 0.37301853541894625
Energy: 0.3606992394105899
Energy: 0.3451955738055419
Energy: 0.36069923941104753
Energy: 0.3451955738055419
Energy: 0.3606992394105899
Energy: 0.34519557380691496
Energy: 0.3464699110786453
Energy: 0.3585737072883302
Energy: 0.3464699110786453
Energy: 0.358573707288788
Energy: 0.34646991107818753
Energy: 0.358573707288788
Energy: 0.35094883566399987
Energy: 0.35766576191434796
Energy: 0.35094883566399987
Energy: 0.35766576191480576
Energy: 0.35094883566399987
Energy: 0.35766576191480576
Energy: 0.3580692190993114
Energy: 0.3449117219939817
Energy: 0.3580692190988536
Energy: 0.3449117219939817
Energy: 0.3580692190993114
Energy: 0.3449117219944393
Energy: 0.32951569733615216
Energy: 0.3570478193372276
Energy: 0.32951569733660985
Energy: 0.3570478193372276
Energy: 0.32951569733706754
Energy: 0.3570478193367699
Energy: 0.342503434869055
Energy: 0.37591807939331495
Energy: 0.3425034348681396
Energy: 0.37591807939331495
Energy: 0.342503434869055
Energy: 0.37591807939331495
Energy: 0.36066982232719164
Energy: 0.34943170433491183
Energy: 0.36066982232673384
Energy: 0.34943170433491183
Energy: 0.36066982232673384
Energy: 0.34943170433491183
Energy: 0.34221908045814603
Energy: 0.3652861757392531
Energy: 0.3422190804586037
Energy: 0.36528617573879535
Energy: 0.34221908045814603
Energy: 0.36528617573879535
Energy: 0.34595332067165174
Energy: 0.352793456189859
Energy: 0.34595332067165174
Energy: 0.3527934561903167
Energy: 0.34595332067165174
Energy: 0.352793456189859
Energy: 0.3615415593585261
Energy: 0.34127148914103467
Energy: 0.3615415593580685
Energy: 0.341271489140577
Energy: 0.3615415593580685
Energy: 0.3412714891396616
Energy: 0.32924155686338874
Energy: 0.35688741963414283
Energy: 0.3292415568643041
Energy: 0.35688741963414283
Energy: 0.32924155686338874
Energy: 0.35688741963414283
Energy: 0.3652934407245794
Energy: 0.36442514485160243
Energy: 0.3652934407245794
Energy: 0.36442514485160243
Energy: 0.3652934407245794
Energy: 0.36442514485160243
Energy: 0.3534182101631519
Energy: 0.3263795615970756
Energy: 0.3534182101631519
Energy: 0.3263795615970756
Energy: 0.3534182101626942
Energy: 0.3263795615970756
Energy: 0.3443730844080066
Energy: 0.3579616265288369
Energy: 0.34437308440709125
Energy: 0.35796162652929464
Energy: 0.34437308440709125
Energy: 0.3579616265288369
Energy: 0.33471124121312995
Energy: 0.3462627796020775
Energy: 0.33471124121312995
Energy: 0.34626277960161983
Energy: 0.3347112412140454
Energy: 0.34626277960253526
Energy: 0.37541232454513307
Energy: 0.35783796073618485
Energy: 0.37541232454559087
Energy: 0.35783796073664265
Energy: 0.3754123245460485
Energy: 0.35783796073664265
Energy: 0.3479473945179206
Energy: 0.3561129676093121
Energy: 0.3479473945174629
Energy: 0.35611296760885436
Energy: 0.3479473945174629
Energy: 0.3561129676093121
Energy: 0.3646619709526295
Energy: 0.3554943107785674
Energy: 0.3646619709530872
Energy: 0.355494310777652
Energy: 0.3646619709530872
Energy: 0.35549431077810967
Energy: 0.3552915989492687
Energy: 0.33696594609663094
Energy: 0.35529159894972634
Energy: 0.3369659460961733
Energy: 0.3552915989488109
Energy: 0.33696594609663094
Energy: 0.33598748483101804
Energy: 0.35734241826873514
Energy: 0.33598748483101804
Energy: 0.35734241826873514
Energy: 0.3359874848305603
Energy: 0.35734241826873514
Energy: 0.35372078763645637
Energy: 0.36451224686205846
Energy: 0.35372078763645637
Energy: 0.36451224686205846
Energy: 0.35372078763645637
Energy: 0.36451224686205846
Energy: 0.3588829472633404
Energy: 0.3441922780055423
Energy: 0.3588829472633404
Energy: 0.344192278006
Energy: 0.3588829472633404
Energy: 0.344192278006
Energy: 0.34165756172515116
Energy: 0.3673311277035785
Energy: 0.34165756172515116
Energy: 0.3673311277031208
Energy: 0.34165756172515116
Energy: 0.3673311277035785
Energy: 0.34662475345280613
Energy: 0.32298383463523545
Energy: 0.34662475345280613
Energy: 0.32298383463706626
Energy: 0.34662475345234844
Energy: 0.3229838346375239
Energy: 0.3582414802856328
Energy: 0.3522546295528037
Energy: 0.3582414802856328
Energy: 0.35225462954410747
Energy: 0.3582414802851751
Energy: 0.3522546295523459

minimum gb energy = 0.32298383463523545 eV
minimum distance =  2.60323869210645 Angstroms
sigma value = 57


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

Energy: 0.32587414185792185
Energy: 0.310604164810001
Energy: 0.32587414185792185
Energy: 0.310604164810001
Energy: 0.3258741418587363
Energy: 0.310604164810001
Energy: 0.34172375421861173
Energy: 0.3693364223951902
Energy: 0.34172375421779727
Energy: 0.3693364223951902
Energy: 0.34172375421861173
Energy: 0.3693364223951902
Energy: 0.3488979763131765
Energy: 0.33519310919045026
Energy: 0.3488979763131765
Energy: 0.3351931091896358
Energy: 0.3488979763131765
Energy: 0.33519310919045026
Energy: 0.3187944389972354
Energy: 0.32808312682670077
Energy: 0.3187944389980499
Energy: 0.32808312682670077
Energy: 0.3187944389980499
Energy: 0.3176131579489752
Energy: 0.348933700929798
Energy: 0.3352484001039069
Energy: 0.3489337009306125
Energy: 0.3352484001039069
Energy: 0.348933700929798
Energy: 0.3352484001039069
Energy: 0.3418002017073191
Energy: 0.3204052727179239
Energy: 0.3418002017073191
Energy: 0.3204052727179239
Energy: 0.3418002017073191
Energy: 0.3204052727179239
Energy: 0.32587414185710734
Energy: 0.310604164810001
Energy: 0.32587414185792185
Energy: 0.310604164810001
Energy: 0.32587414185792185
Energy: 0.310604164810001
Energy: 0.34172375421779727
Energy: 0.3693364223943757
Energy: 0.34172375421698276
Energy: 0.3693364223943757
Energy: 0.34172375421698276
Energy: 0.3693364223943757
Energy: 0.3488979763131765
Energy: 0.33519310918882134
Energy: 0.3488979763131765
Energy: 0.33519310918882134
Energy: 0.34889797631399094
Energy: 0.33519310918882134
Energy: 0.31879443899886434
Energy: 0.30650559757493384
Energy: 0.31879443899886434
Energy: 0.30650559757574836
Energy: 0.31879443899886434
Energy: 0.30650559757493384
Energy: 0.34893370092816905
Energy: 0.3352484001039069
Energy: 0.34893370092816905
Energy: 0.3352484001039069
Energy: 0.34893370092898357
Energy: 0.3352484001039069
Energy: 0.3418002017081336
Energy: 0.32040527271873837
Energy: 0.3418002017081336
Energy: 0.32040527271873837
Energy: 0.3418002017073191
Energy: 0.32040527271873837
Energy: 0.3258741418587363
Energy: 0.310604164810001
Energy: 0.3258741418587363
Energy: 0.310604164810001
Energy: 0.3258741418587363
Energy: 0.310604164810001
Energy: 0.34172375421861173
Energy: 0.36933642239356124
Energy: 0.34172375421779727
Energy: 0.36933642239356124
Energy: 0.34172375421861173
Energy: 0.3693364223943757
Energy: 0.34889797631236197
Energy: 0.33519310919045026
Energy: 0.34889797631236197
Energy: 0.33519310919045026
Energy: 0.34889797631236197
Energy: 0.33519310919045026
Energy: 0.3187944389972354
Energy: 0.30650559757574836
Energy: 0.3187944389980499
Energy: 0.3065055975765628
Energy: 0.3187944389972354
Energy: 0.3065055975765628
Energy: 0.348933700929798
Energy: 0.3352484001039069
Energy: 0.34893370093142695
Energy: 0.3352484001039069
Energy: 0.348933700929798
Energy: 0.3352484001039069

minimum gb energy = 0.30650559757493384 eV
minimum distance =  2.64341962400977 Angstroms
sigma value = 9


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

Energy: 0.3667517485828951
Energy: 0.32405824656998417
Energy: 0.3667517485828951
Energy: 0.32405824656998417
Energy: 0.3667517485828951
Energy: 0.32405824656998417
Energy: 0.3437503211135106
Energy: 0.3516734374141606
Energy: 0.34375032111484066
Energy: 0.35167343741482554
Energy: 0.34375032111484066
Energy: 0.3516734374141606
Energy: 0.33886105537178673
Energy: 0.3489625662857099
Energy: 0.3388610553731168
Energy: 0.3489625662850448
Energy: 0.3388610553731168
Energy: 0.3489625662850448
Energy: 0.3478220131807601
Energy: 0.3616130269867963
Energy: 0.34782201318209016
Energy: 0.3616130269867963
Energy: 0.3478220131807601
Energy: 0.3616130269867963
Energy: 0.34371181394194633
Energy: 0.32284588205547105
Energy: 0.3437118139412813
Energy: 0.3228458820495161
Energy: 0.34371181394194633
Energy: 0.3228458820528109
Energy: 0.3507942054138082
Energy: 0.35030127666985156
Energy: 0.3507942054138082
Energy: 0.35030127666985156
Energy: 0.3507942054144732
Energy: 0.35030127666985156
Energy: 0.3446097685279127
Energy: 0.348071315671876
Energy: 0.3446097685279127
Energy: 0.348071315671876
Energy: 0.3446097685292428
Energy: 0.348071315671876
Energy: 0.34753331136929716
Energy: 0.35600360684869076
Energy: 0.3475333113699623
Energy: 0.35600360684869076
Energy: 0.3475333113699623
Energy: 0.35600360684869076
Energy: 0.36211491327244133
Energy: 0.3436288925694301
Energy: 0.36211491327244133
Energy: 0.3436288925694301
Energy: 0.36211491327244133
Energy: 0.3436288925694301
Energy: 0.3449921665457807
Energy: 0.3352471423274352
Energy: 0.3449921665457807
Energy: 0.3352471423274352
Energy: 0.34499216654644577
Energy: 0.33524714232677016
Energy: 0.3400623614039553
Energy: 0.3458151800431024
Energy: 0.3400623614039553
Energy: 0.3458151800431024
Energy: 0.34006236140329027
Energy: 0.3458151800431024
Energy: 0.34563944734291446
Energy: 0.35036613542109385
Energy: 0.3456394473415844
Energy: 0.35036613541976386
Energy: 0.3456394473415844
Energy: 0.35036613542109385
Energy: 0.34800577686046696
Energy: 0.3652897532667356
Energy: 0.348005776861132
Energy: 0.3652897532674006
Energy: 0.34800577686046696
Energy: 0.3652897532667356
Energy: 0.34722588161654133
Energy: 0.34469423418978556
Energy: 0.34722588161720636
Energy: 0.34469423418978556
Energy: 0.3472258816178713
Energy: 0.34469423418978556
Energy: 0.35291884001425305
Energy: 0.34922033338122177
Energy: 0.35291884001491813
Energy: 0.34922033338055675
Energy: 0.35291884001558305
Energy: 0.34922033338122177
Energy: 0.3315006105927619
Energy: 0.3473166587567191
Energy: 0.3315006106140425
Energy: 0.3473166587560541
Energy: 0.331500610594757
Energy: 0.3473166587560541
Energy: 0.3540251799117695
Energy: 0.354932230383017
Energy: 0.3540251799124345
Energy: 0.354932230383017
Energy: 0.3540251799124345
Energy: 0.354932230383017
Energy: 0.37059652649258623
Energy: 0.3533484457276185
Energy: 0.3705965264912563
Energy: 0.3533484457269535
Energy: 0.37059652649258623
Energy: 0.35334844572828356
Energy: 0.3427488761688736
Energy: 0.3423219198332424
Energy: 0.3427488761682086
Energy: 0.3423219198332424
Energy: 0.3427488761682086
Energy: 0.34232191983257737
Energy: 0.3462037987024857
Energy: 0.3277714582908684
Energy: 0.3462037987031507
Energy: 0.3277714582882083
Energy: 0.3462037987031507
Energy: 0.3277714582882083
Energy: 0.3584538639895661
Energy: 0.3501202975234439
Energy: 0.35845386399023116
Energy: 0.3501202975234439
Energy: 0.3584538639895661
Energy: 0.3501202975234439

minimum gb energy = 0.3228458820495161 eV
minimum distance =  2.61195954373672 Angstroms
sigma value = 27


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

Energy: 0.3474414569055094
Energy: 0.32537022463542625
Energy: 0.31978935090669136
Energy: 0.32537022463542625
Energy: 0.3474414569071911
Energy: 0.3253702246365474
Energy: 0.33058783721432083
Energy: 0.32273860643733915
Energy: 0.33058783721544194
Energy: 0.32273860643733915
Energy: 0.3305878372148814
Energy: 0.3227386064384603
Energy: 0.3137270404572464
Energy: 0.3426312211918767
Energy: 0.31372704045446914
Energy: 0.3426312211918767
Energy: 0.3137270404572464
Energy: 0.34263122119580064
Energy: 0.31948944559087633
Energy: 0.3450002494480644
Energy: 0.31948944559087633
Energy: 0.3450002494469433
Energy: 0.31948944559087633
Energy: 0.34500024945030666
Energy: 0.3183535894644409
Energy: 0.3038430144477622
Energy: 0.3183535894638803
Energy: 0.30384301444832273
Energy: 0.3183535894644409
Energy: 0.3038430144455199
Energy: 0.3296587560479602
Energy: 0.3231498479499592
Energy: 0.3296587560451573
Energy: 0.3231498479499592
Energy: 0.3296587560479602
Energy: 0.3231498479522015
Energy: 0.32034916700840127
Energy: 0.3244095796968373
Energy: 0.3203491670089619
Energy: 0.3244095796968373
Energy: 0.32034916700840127
Energy: 0.3244095796990796
Energy: 0.3366062579665223
Energy: 0.3115535592303399
Energy: 0.3366062579547505
Energy: 0.3115535592303399
Energy: 0.3366062579665223
Energy: 0.31155355922868366
Energy: 0.29518101185828055
Energy: 0.322287384993728
Energy: 0.29518101185771994
Energy: 0.322287384993728
Energy: 0.2951810118588411
Energy: 0.32228738499540965
Energy: 0.31947280783356774
Energy: 0.2947870330027211
Energy: 0.31947280783468884
Energy: 0.29478703300328163
Energy: 0.31947280783356774
Energy: 0.29478703300328163
Energy: 0.31960868712251495
Energy: 0.3185777975597623
Energy: 0.3196086871213938
Energy: 0.3185777975597623
Energy: 0.3196086871219544
Energy: 0.31857779755752
Energy: 0.32348205132247665
Energy: 0.32384344765790646
Energy: 0.32348205132303726
Energy: 0.32384344765846695
Energy: 0.32348205132247665
Energy: 0.3238434476573459
Energy: 0.31186875500250616
Energy: 0.33676070241490275
Energy: 0.31186875500418787
Energy: 0.3367607024165844
Energy: 0.31186875500306677
Energy: 0.3367607024120999
Energy: 0.3201478775685338
Energy: 0.2953992186621122
Energy: 0.3201478775685338
Energy: 0.2953992186621122
Energy: 0.3201478775690944
Energy: 0.29539921866379387
Energy: 0.3293163558899804
Energy: 0.32272230535048513
Energy: 0.32931635589278324
Energy: 0.3227223053510457
Energy: 0.3293163558899804
Energy: 0.3227223053465612
Energy: 0.31838950058130405
Energy: 0.30379801248165234
Energy: 0.3183895005779407
Energy: 0.3037980124810918
Energy: 0.3183895005807435
Energy: 0.30379801248165234
Energy: 0.31942473687431744
Energy: 0.3196708787959362
Energy: 0.31942473687431744
Energy: 0.3196708787959362
Energy: 0.31942473687375683
Energy: 0.3196708787931334
Energy: 0.339110129575573
Energy: 0.3371211045125775
Energy: 0.33911012957389125
Energy: 0.3371211045125775
Energy: 0.339110129575573
Energy: 0.33712110451089583
Energy: 0.3245704453196763
Energy: 0.3229368140041976
Energy: 0.2966417451441916
Energy: 0.322936814003637
Energy: 0.3245704453196763
Energy: 0.32293681400475815
Energy: 0.3474414569055094
Energy: 0.32537022463430515
Energy: 0.31978935090669136
Energy: 0.32537022463430515
Energy: 0.3474414569055094
Energy: 0.32537022463430515
Energy: 0.3305878372137603
Energy: 0.32273860643733915
Energy: 0.33058783721432083
Energy: 0.32273860643733915
Energy: 0.3305878372137603
Energy: 0.3227386064384603
Energy: 0.31372704045780697
Energy: 0.3426312211929978
Energy: 0.3137270404550042
Energy: 0.3426312211924373
Energy: 0.31372704045780697
Energy: 0.34263122119580064
Energy: 0.31948944559143694
Energy: 0.34500024944862495
Energy: 0.31948944559143694
Energy: 0.3450002494491855
Energy: 0.31948944559087633
Energy: 0.3450002494508672
Energy: 0.3183535894644409
Energy: 0.30384301444832273
Energy: 0.3183535894633197
Energy: 0.30384301444832273
Energy: 0.3183535894644409
Energy: 0.3038430144455199
Energy: 0.3296587560479602
Energy: 0.32314984794827756
Energy: 0.3296587560473996
Energy: 0.32314984794827756
Energy: 0.3296587560479602
Energy: 0.3231498479505198

minimum gb energy = 0.2947870330027211 eV
minimum distance =  2.63596112018361 Angstroms
sigma value = 19


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

Energy: 0.3425757419804863
Energy: 0.37935500967908925
Energy: 0.3425757419804863
Energy: 0.37935500967086355
Energy: 0.3425757419809702
Energy: 0.37935500967860547
Energy: 0.33684153418204354
Energy: 0.32755910602952626
Energy: 0.33684153418204354
Energy: 0.32755910602952626
Energy: 0.33684153418204354
Energy: 0.32755910603001004
Energy: 0.34574704570845227
Energy: 0.3226465081446138
Energy: 0.3574492371960982
Energy: 0.32264650814412993
Energy: 0.33894966799712273
Energy: 0.3226465081446138
Energy: 0.33063372707481037
Energy: 0.33888760622661224
Energy: 0.33063372707481037
Energy: 0.33888760622661224
Energy: 0.33063372707481037
Energy: 0.3388876062246768
Energy: 0.3251561553465481
Energy: 0.33839679224246555
Energy: 0.32515615534703196
Energy: 0.33839679224246555
Energy: 0.32515615534606424
Energy: 0.33839679224198166
Energy: 0.3418806462997849
Energy: 0.331726593145301
Energy: 0.3418806462997849
Energy: 0.331726593145301
Energy: 0.3418806462997849
Energy: 0.331726593145301
Energy: 0.3244838469548876
Energy: 0.34284737361422085
Energy: 0.32448384695440374
Energy: 0.3428473736132531
Energy: 0.32448384695440374
Energy: 0.3428473736122854
Energy: 0.33983392082281305
Energy: 0.3479669898226146
Energy: 0.33983392082329694
Energy: 0.34796698982019525
Energy: 0.33983392082281305
Energy: 0.3479669898216468
Energy: 0.3411622966672849
Energy: 0.3228803789054815
Energy: 0.3411622966672849
Energy: 0.3228803789059653
Energy: 0.3411622966672849
Energy: 0.3228803789059653
Energy: 0.33097073351689593
Energy: 0.3350609885555832
Energy: 0.33097073351689593
Energy: 0.3350609885555832
Energy: 0.33097073351689593
Energy: 0.3350609885555832
Energy: 0.32654221787013327
Energy: 0.3524530255629298
Energy: 0.32654221787013327
Energy: 0.3524530255634136
Energy: 0.32654221787013327
Energy: 0.3524530255624459
Energy: 0.33523792956807197
Energy: 0.3233974500940233
Energy: 0.33523792956807197
Energy: 0.32339745009450716
Energy: 0.33523792956807197
Energy: 0.3233974500940233
Energy: 0.3361486994976978
Energy: 0.33206062289481386
Energy: 0.33614869949576237
Energy: 0.33206062289529775
Energy: 0.3361486994981817
Energy: 0.33206062289481386
Energy: 0.3295284779061785
Energy: 0.34274612645060176
Energy: 0.32952847790666234
Energy: 0.3427461264510856
Energy: 0.3295284779061785
Energy: 0.3427461264510856
Energy: 0.3371825899927328
Energy: 0.3249943489501748
Energy: 0.33718258999321665
Energy: 0.3249943489501748
Energy: 0.33718258999370054
Energy: 0.3249943489501748
Energy: 0.32832441375571464
Energy: 0.32196752753479063
Energy: 0.32832441375571464
Energy: 0.32196752753479063
Energy: 0.32832441375619853
Energy: 0.32196752753479063
Energy: 0.3303147475628712
Energy: 0.33958438477395964
Energy: 0.33031474756335505
Energy: 0.33958438477444347
Energy: 0.3303147475628712
Energy: 0.33958438477395964
Energy: 0.33786418872775775
Energy: 0.33614615455491303
Energy: 0.33786418872775775
Energy: 0.3361461545539453
Energy: 0.3378641887272739
Energy: 0.3361461545539453
Energy: 0.3233730347596507
Energy: 0.3322617369572632
Energy: 0.3233730347596507
Energy: 0.33226173695677935
Energy: 0.3233730347596507
Energy: 0.3322617369572632
Energy: 0.33207104780095614
Energy: 0.3375198969009811
Energy: 0.3320710478004722
Energy: 0.337519896901465
Energy: 0.3320710478004722
Energy: 0.3375198969009811
Energy: 0.3233360176484775
Energy: 0.32980128059890673
Energy: 0.3233360176484775
Energy: 0.32980128060035835
Energy: 0.32333601764799375
Energy: 0.3298012805993906
Energy: 0.3565877128095611
Energy: 0.3239243099600328
Energy: 0.3565877128100449
Energy: 0.32392430995954896
Energy: 0.3565877128095611
Energy: 0.32392430995954896
Energy: 0.3497752785514049
Energy: 0.33541467925177776
Energy: 0.34977527855188867
Energy: 0.33541467925129387
Energy: 0.3497752785523726
Energy: 0.33541467925129387
Energy: 0.3529890870220584
Energy: 0.32867347428155314
Energy: 0.3529890870215745
Energy: 0.32867347428106924
Energy: 0.3529890870215745
Energy: 0.32867347428106924
Energy: 0.33534897323563156
Energy: 0.32301256172805404
Energy: 0.33534897323514773
Energy: 0.32301256172805404
Energy: 0.33534897323514773
Energy: 0.32301256172805404
Energy: 0.3435063728419755
Energy: 0.33004778850783595
Energy: 0.34350637284245933
Energy: 0.3300477885068682
Energy: 0.34350637284245933
Energy: 0.33004778850783595
Energy: 0.3236020959806557
Energy: 0.3374372425875828
Energy: 0.3236020959806557
Energy: 0.3374372425875828
Energy: 0.3236020959811396
Energy: 0.3374372425875828
Energy: 0.3352324813725505
Energy: 0.3397591420441037
Energy: 0.33523248137109884
Energy: 0.3397591420441037
Energy: 0.3352324813740021
Energy: 0.3397591420441037
Energy: 0.3341387550097754
Energy: 0.33708500178566525
Energy: 0.3341387550126786
Energy: 0.337085001786633
Energy: 0.33413875501219475
Energy: 0.33708500178614914

minimum gb energy = 0.32196752753479063 eV
minimum distance =  2.61751788516882 Angstroms
sigma value = 101


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

Energy: 0.330681242776442
Energy: 0.348403172723683
Energy: 0.330681242776442
Energy: 0.348403172723683
Energy: 0.330681242776442
Energy: 0.348403172723683
Energy: 0.32754392994990955
Energy: 0.3339261275615566
Energy: 0.32754392995246157
Energy: 0.3339261275619819
Energy: 0.32754392995246157
Energy: 0.3242135074804219
Energy: 0.3250814113220357
Energy: 0.30978727697205805
Energy: 0.3250814113224611
Energy: 0.30978727697205805
Energy: 0.3250814113220357
Energy: 0.30978727697205805
Energy: 0.3075143976261555
Energy: 0.3393890887112509
Energy: 0.3075143976261555
Energy: 0.33938908871252693
Energy: 0.3075143976261555
Energy: 0.3393890886980652
Energy: 0.31397486152844745
Energy: 0.32087563820726955
Energy: 0.31397486152759674
Energy: 0.3208756382064383
Energy: 0.3139748615288728
Energy: 0.32087563820812026
Energy: 0.345384589492191
Energy: 0.30816858801743247
Energy: 0.34538458949261636
Energy: 0.3081685880170072
Energy: 0.345384589492191
Energy: 0.3081685880170072
Energy: 0.32429705538297654
Energy: 0.3256644659869641
Energy: 0.32429705538297654
Energy: 0.32566446598653875
Energy: 0.32429705538297654
Energy: 0.32566446598653875
Energy: 0.30745387816095227
Energy: 0.3496874000452974
Energy: 0.30745387815967623
Energy: 0.3589941391976513
Energy: 0.30745387816095227
Energy: 0.32493869957606375
Energy: 0.34431885809308066
Energy: 0.3097894640636546
Energy: 0.34431885809308066
Energy: 0.3097894640636546
Energy: 0.34431885809393137
Energy: 0.3097894640636546
Energy: 0.31264034364503335
Energy: 0.3280750217114363
Energy: 0.31264034364503335
Energy: 0.32807502172034925
Energy: 0.312640343644608
Energy: 0.328075021711011
Energy: 0.3063109289625514
Energy: 0.3518420964586765
Energy: 0.30631092896212603
Energy: 0.35184209645910186
Energy: 0.3063109289625514
Energy: 0.3518420964586765
Energy: 0.33433358043031897
Energy: 0.31727911206076365
Energy: 0.33433358042989364
Energy: 0.31727911206076365
Energy: 0.3343335804324457
Energy: 0.31727911206033826
Energy: 0.3303625401380963
Energy: 0.313226560715227
Energy: 0.33036254013767097
Energy: 0.313226560715227
Energy: 0.3303625401372456
Energy: 0.313226560715227
Energy: 0.3325890807029388
Energy: 0.32969798553464474
Energy: 0.3325890807033641
Energy: 0.32969798553507007
Energy: 0.3325890807033641
Energy: 0.3296979855354954
Energy: 0.32904551382429637
Energy: 0.32118432558650917
Energy: 0.3290455138234457
Energy: 0.32118432558608384
Energy: 0.3290455138234457
Energy: 0.32118432558608384
Energy: 0.3246676998406376
Energy: 0.30892284310022594
Energy: 0.3246676998419136
Energy: 0.30892284310022594
Energy: 0.3246676998410629
Energy: 0.30892284310022594
Energy: 0.30727299788701834
Energy: 0.32631437356292115
Energy: 0.3072729978861677
Energy: 0.32631437356377174
Energy: 0.30727299788701834
Energy: 0.32631437356249576
Energy: 0.3068885275080628
Energy: 0.3371793200289089
Energy: 0.30688852750891343
Energy: 0.3371793200289089
Energy: 0.3068885275076568
Energy: 0.3371793200289089
Energy: 0.34466772714095595
Energy: 0.3095751092939793
Energy: 0.3446677271405306
Energy: 0.3095751092944046
Energy: 0.34466772714095595
Energy: 0.3095751092939793
Energy: 0.32825991366179
Energy: 0.31955461632489857
Energy: 0.32825991366179
Energy: 0.3195546163325548
Energy: 0.32825991366179
Energy: 0.3195546163393603
Energy: 0.3072930873433992
Energy: 0.3542677625046127
Energy: 0.3072930873433992
Energy: 0.3542677625046127
Energy: 0.3072930873433992
Energy: 0.3542677625041874
Energy: 0.3346223869568944
Energy: 0.31023456299544133
Energy: 0.33462238695476765
Energy: 0.31023456299544133
Energy: 0.3346223869577451
Energy: 0.31023456299544133
Energy: 0.325855562270289
Energy: 0.30919087155416636
Energy: 0.3258555622707144
Energy: 0.30919087155416636
Energy: 0.3258555622707144
Energy: 0.30919087155459174
Energy: 0.3074747585450686
Energy: 0.34026803772081415
Energy: 0.3074747585450686
Energy: 0.34026803771996345
Energy: 0.30747475854549394
Energy: 0.34026803771996345
Energy: 0.33666835561245306
Energy: 0.3195334803372539
Energy: 0.33666835561032626
Energy: 0.31953348033682855
Energy: 0.3366683556128784
Energy: 0.3195334803372539
Energy: 0.33020741847678636
Energy: 0.31031010948836385
Energy: 0.33020741847678636
Energy: 0.31031010948836385
Energy: 0.33020741847763707
Energy: 0.31031010948878923
Energy: 0.33627288440259784
Energy: 0.3217828560820753
Energy: 0.3362728844038739
Energy: 0.3217828560820753
Energy: 0.33627288440259784
Energy: 0.3217828560825006
Energy: 0.3334273104813345
Energy: 0.330313043778654
Energy: 0.3334273104809092
Energy: 0.330313043778654
Energy: 0.3334273104804838
Energy: 0.3303130437782287
Energy: 0.3402526033025091
Energy: 0.30893864136027155
Energy: 0.3402526033025091
Energy: 0.30893864136027155
Energy: 0.3402526033029345
Energy: 0.30893864135984617
Energy: 0.3068938232556857
Energy: 0.3259159189487583
Energy: 0.3068938232556857
Energy: 0.32591591894918365
Energy: 0.306893823254835
Energy: 0.3259159189479076
Energy: 0.30745158590082616
Energy: 0.3204569805580449
Energy: 0.30745158590210225
Energy: 0.3204569805580449
Energy: 0.30745158590082616
Energy: 0.3204569805576195
Energy: 0.3265560089786152
Energy: 0.3089337429924675
Energy: 0.3265560089786152
Energy: 0.3089337429911914
Energy: 0.3265560089786152
Energy: 0.30893374299034077
Energy: 0.326789381456042
Energy: 0.30891260254915065
Energy: 0.32678938145646735
Energy: 0.30891260254915065
Energy: 0.32678938145689274
Energy: 0.30891260254957603

minimum gb energy = 0.30631092896212603 eV
minimum distance =  2.62641062420547 Angstroms
sigma value = 33


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

Energy: 0.011732917720447324
Energy: 0.28544562901298415
Energy: 0.011732917720447324
Energy: 0.2854456290133376
Energy: 0.011732917720781097
Energy: 0.2854456290133376
Energy: 0.012539751853199728
Energy: 0.15599732666241747
Energy: 0.012539751853553134
Energy: 0.15599732666310465
Energy: 0.012539751853199728
Energy: 0.15599732666173027
Energy: 0.2857099522206977
Energy: 0.1561552532215361
Energy: 0.2857099522210511
Energy: 0.1561552532215361
Energy: 0.2857099522210511
Energy: 0.1561552532215361
Energy: 0.01253975185251255
Energy: 0.15599732666173027
Energy: 0.012539751852865955
Energy: 0.15599732666173027
Energy: 0.012539751852865955
Energy: 0.15599732666173027

minimum gb energy = 0.011732917720447324 eV
minimum distance =  2.84723958476868 Angstroms
sigma value = 1