Model name: model_name=MEAM_LAMMPS_WangOhLee_2020_CuCo__MO_694335101831_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315641880036
cohesive_energy=3.5402784093827564
mass=63.546
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: 0.013700276458789847
Energy: 0.7280891893432001
Energy: 0.013700276458789847
Energy: 0.7280891893432001
Energy: 0.013700276459103747
Energy: 0.7280891893432001
Energy: 0.7280891893432001
Energy: 0.8633325788778773
Energy: 0.7280891893432001
Energy: 0.8633325788778773
Energy: 0.7280891893432001
Energy: 0.863332578876029
Energy: 0.013700276458789847
Energy: 0.7280891893432001
Energy: 0.013700276459103747
Energy: 0.7280891893432001
Energy: 0.013700276459103747
Energy: 0.7280891893432001
Energy: 0.7280891893432001
Energy: 0.8633325788775634
Energy: 0.7280891893432001
Energy: 0.8633325788766567
Energy: 0.7280891893432001
Energy: 0.8633325788775634
Energy: 0.013700276459103747
Energy: 0.7280891893432001
Energy: 0.013700276459103747
Energy: 0.7280891893432001
Energy: 0.013700276459103747
Energy: 0.7280891893432001
Energy: 0.7280891893432001
Energy: 0.8633325788772496
Energy: 0.7280891893432001
Energy: 0.8633325788775634
Energy: 0.7280891893432001
Energy: 0.8633325788781913

minimum gb energy = 0.013700276458789847 eV
minimum distance =  2.38924004848903 Angstroms
sigma value = 1


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

Energy: 0.9687634229358415
Energy: 1.1638896569745971
Energy: 0.968763422935086
Energy: 1.1638896569753527
Energy: 0.968763422935086
Energy: 1.1638896569745971
Energy: 1.180127898057326
Energy: 0.9081776329633996
Energy: 1.180127898057326
Energy: 0.9081776329626441
Energy: 1.1801278980580818
Energy: 0.9081776329626441
Energy: 0.9463443923019283
Energy: 1.286097312746477
Energy: 0.9463443923019283
Energy: 1.2860973127457216
Energy: 0.9463443923019283
Energy: 1.286097312746477
Energy: 1.2047753333032722
Energy: 0.9705701514958293
Energy: 1.2047753333040276
Energy: 0.9705701514958293
Energy: 1.2047753333040276
Energy: 0.9705701514950736
Energy: 1.008149428163939
Energy: 1.0821207133139081
Energy: 1.008149428163939
Energy: 1.0821207133139081
Energy: 1.008149428163939
Energy: 1.0821207133139081
Energy: 1.0245045077846255
Energy: 0.9961713386599083
Energy: 1.0245045077846255
Energy: 0.9961713386599083
Energy: 1.0245045077846255
Energy: 0.9961713386599083
Energy: 0.9869882231835418
Energy: 1.1236325528029467
Energy: 0.9869882231827861
Energy: 1.1236325528037023
Energy: 0.9869882231835418
Energy: 1.1236325528037023
Energy: 0.9849752439235168
Energy: 1.2006255495097398
Energy: 0.9849752439242723
Energy: 1.2006255495104954
Energy: 0.9849752439242723
Energy: 1.2006255495104954
Energy: 1.09053873750491
Energy: 0.9572627523356916
Energy: 1.09053873750491
Energy: 0.9572627523356916
Energy: 1.09053873750491
Energy: 0.9572627523356916
Energy: 0.9215026890606873
Energy: 1.197047617749945
Energy: 0.9215026890606873
Energy: 1.197047617749945
Energy: 0.9215026890599316
Energy: 1.197047617749945
Energy: 1.2309503834746771
Energy: 0.8978717621253232
Energy: 1.2309503834746771
Energy: 0.8978717621253232
Energy: 1.2309503834746771
Energy: 0.8978717621253232
Energy: 0.8616976999965875
Energy: 1.2787484680645613
Energy: 0.8616976999965875
Energy: 1.2787484680645613
Energy: 0.8616976999965875
Energy: 1.2787484680645613
Energy: 1.1991553101422057
Energy: 0.88972638326282
Energy: 1.1991553101406947
Energy: 0.88972638326282
Energy: 1.1991553101422057
Energy: 0.88972638326282
Energy: 0.9339885746122346
Energy: 1.068529561047632
Energy: 0.9339885746122346
Energy: 1.068529561047632
Energy: 0.9339885746129901
Energy: 1.068529561047632
Energy: 1.2219740242183936
Energy: 0.9315583653548352
Energy: 1.2219740242183936
Energy: 0.9315583653548352
Energy: 1.2219740242183936
Energy: 0.9315583653548352
Energy: 1.1612919232963017
Energy: 1.1562305722131598
Energy: 1.1612919232963017
Energy: 1.1562305722131598
Energy: 1.1612919232963017
Energy: 1.1562305722131598
Energy: 1.0615159401601908
Energy: 1.0094162459858764
Energy: 1.0615159401609466
Energy: 1.0094162459858764
Energy: 1.0615159401601908
Energy: 1.0094162459858764
Energy: 1.0965681251944368
Energy: 1.0110705646079459
Energy: 1.0965681251936812
Energy: 1.0110705646087015
Energy: 1.0965681251944368
Energy: 1.0110705646087015
Energy: 0.8764303943149091
Energy: 1.0642417018372092
Energy: 0.8764303943126422
Energy: 1.0642417018364536
Energy: 0.8764303943141536
Energy: 1.0642417018364536
Energy: 1.0744489826332548
Energy: 0.9403419658142789
Energy: 1.0744489826332548
Energy: 0.9403419658142789
Energy: 1.0744489826324994
Energy: 0.9403419658142789
Energy: 0.9113203567872037
Energy: 1.288745034356094
Energy: 0.9113203567872037
Energy: 1.2887450343583609
Energy: 0.9113203567872037
Energy: 1.288745034356094
Energy: 1.120547086317035
Energy: 0.9529484093863574
Energy: 1.120547086317035
Energy: 0.9529484093856019
Energy: 1.120547086317035
Energy: 0.9529484093856019
Energy: 0.8677540183301946
Energy: 1.177588383048225
Energy: 0.8677540183301946
Energy: 1.1775883830489804
Energy: 0.8677540183301946
Energy: 1.1775883830489804

minimum gb energy = 0.8616976999965875 eV
minimum distance =  2.36254192703558 Angstroms
sigma value = 33


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

Energy: 1.025668411120516
Energy: 1.1946237550814904
Energy: 0.9590133011662814
Energy: 1.1946237550814904
Energy: 1.025668411120516
Energy: 1.1946237550810606
Energy: 1.2598550087885685
Energy: 0.9903915446491027
Energy: 1.259855008789389
Energy: 0.9903915446495325
Energy: 1.2598550087881388
Energy: 0.9903915446491027
Energy: 0.9082523938998299
Energy: 0.9756281459168217
Energy: 0.9082523939006895
Energy: 0.975628145918111
Energy: 0.9082523938998299
Energy: 0.9756281459176813
Energy: 1.1559228247475306
Energy: 1.0354835299952827
Energy: 1.1559228247462412
Energy: 1.0354835299952827
Energy: 1.1559228247471007
Energy: 1.0354835299952827
Energy: 1.0841620521461683
Energy: 1.1395060104008248
Energy: 1.0841620521461683
Energy: 1.139506010400395
Energy: 1.0841620521461683
Energy: 1.139506010400395
Energy: 1.1138298488940894
Energy: 0.9067370581342884
Energy: 1.1138298488940894
Energy: 0.9067370581338587
Energy: 1.1138298488940894
Energy: 0.9067370581338587
Energy: 1.1295624599651477
Energy: 1.000546278880565
Energy: 1.1295624599655771
Energy: 1.000546278880565
Energy: 1.1295624599651477
Energy: 1.000546278882284
Energy: 0.9073621702238025
Energy: 1.165015263526921
Energy: 0.9073621702250918
Energy: 1.1650152635264912
Energy: 0.9073621702233726
Energy: 1.1650152635273507
Energy: 1.0451909503824048
Energy: 0.9075857111045367
Energy: 1.0451909503832642
Energy: 0.907585711104107
Energy: 1.0451909503824048
Energy: 0.9075857111049666
Energy: 0.88611188277286
Energy: 1.2279356121402305
Energy: 0.8861945212156952
Energy: 1.2279356121398006
Energy: 0.8861118827724304
Energy: 1.2279356121406602
Energy: 1.1849833021575233
Energy: 0.8928464464666431
Energy: 1.1849833021575233
Energy: 0.8928464464666431
Energy: 1.1849833021570935
Energy: 0.8928464464670728
Energy: 0.9072577503517236
Energy: 1.1122425817073929
Energy: 0.9072398101547553
Energy: 1.1122425817078225
Energy: 0.9072577503517236
Energy: 1.1122425817078225
Energy: 1.193868673530576
Energy: 0.928766621035936
Energy: 1.268265106477505
Energy: 0.9287666210363658
Energy: 1.193868673531006
Energy: 0.928766621035936
Energy: 0.9590587822001216
Energy: 1.1080182509629863
Energy: 1.0258839325244586
Energy: 1.1080182509629863
Energy: 0.9590587821996919
Energy: 1.1080182509638459
Energy: 0.9736246529895247
Energy: 1.0494266393926994
Energy: 0.973624652989095
Energy: 1.049426639393129
Energy: 0.9736246529895247
Energy: 1.0494266393922693
Energy: 0.90723984004177
Energy: 0.975977470673897
Energy: 0.90723984004177
Energy: 0.9759774706734673
Energy: 0.90723984004177
Energy: 0.9759774706747566
Energy: 1.080373057908909
Energy: 1.0118672986562023
Energy: 1.0803730579071897
Energy: 1.011867298656632
Energy: 1.080373057908909
Energy: 1.0118672986562023
Energy: 1.084395922358736
Energy: 0.906851374953673
Energy: 1.0843959223583062
Energy: 0.9068513749541026
Energy: 1.0843959223600255
Energy: 0.906851374953673
Energy: 0.9905927208398186
Energy: 1.1145498468587254
Energy: 0.99059272083724
Energy: 1.1145498468582957
Energy: 0.9905927208393888
Energy: 1.1145498468582957
Energy: 1.1965722648359025
Energy: 0.9622301921498005
Energy: 1.196572264835043
Energy: 0.9622301921493708
Energy: 1.1965722648363322
Energy: 0.9622301921498005
Energy: 0.8940439340964832
Energy: 1.2593174543647598
Energy: 0.8940439340956237
Energy: 1.2593174543647598
Energy: 0.8940439340964832
Energy: 1.25931745436433
Energy: 0.976763206322304
Energy: 0.9086349691177544
Energy: 0.9767632063227337
Energy: 0.9086349691177544
Energy: 0.9767632063235933
Energy: 0.9086349691173246
Energy: 0.8907560960617081
Energy: 1.1878743453845522
Energy: 0.8907390050096127
Energy: 1.187874345385412
Energy: 0.8907560960617081
Energy: 1.1878743453845522
Energy: 1.1750580676995344
Energy: 0.9854926180428099
Energy: 1.1750580676986748
Energy: 0.9854926180428099
Energy: 1.1750580676986748
Energy: 0.9854926180432397
Energy: 0.9082117505046915
Energy: 1.1108310742295469
Energy: 0.9075408402598337
Energy: 1.1108310742295469
Energy: 0.908211750505512
Energy: 1.1108310742299765
Energy: 1.1842133455629513
Energy: 1.1145233757144302
Energy: 1.1097844580987366
Energy: 1.1145233757148603
Energy: 1.1842133455629513
Energy: 1.1145233757161497
Energy: 1.1653249741497416
Energy: 1.040419655864292
Energy: 1.1100051208045247
Energy: 1.040419655863862
Energy: 1.1653249741497416
Energy: 1.040419655864292
Energy: 0.907933332305095
Energy: 1.0862164139448964
Energy: 0.907933332305095
Energy: 1.086216413945326
Energy: 0.907933332305095
Energy: 1.0862164139448964
Energy: 1.2266149636267192
Energy: 0.91474925117334
Energy: 1.2266149636258596
Energy: 0.91474925117334
Energy: 1.2266149636258596
Energy: 0.91474925117334
Energy: 0.8901783373905191
Energy: 1.1873433737798293
Energy: 0.8901783373918083
Energy: 1.1873433737798293
Energy: 0.8901783373900892
Energy: 1.1873433737794
Energy: 1.239072880890067
Energy: 0.9382251929101721
Energy: 1.2390728808892073
Energy: 0.938225192910602
Energy: 1.239072880890067
Energy: 0.9382251929101721
Energy: 0.9276481992608856
Energy: 1.2344589979573684
Energy: 0.927648199260026
Energy: 1.2344589979573684
Energy: 0.9276481992608856
Energy: 1.2344589979573684
Energy: 1.1970037959796769
Energy: 0.9621043125550419
Energy: 1.197003795979247
Energy: 0.9621043125550419
Energy: 1.1970037959796769
Energy: 0.9621043125546122
Energy: 0.9698000243136742
Energy: 1.1426349431374803
Energy: 0.9698000243141041
Energy: 1.142634943164947
Energy: 0.9698000243141041
Energy: 1.1426349431439267
Energy: 0.9757837066895568
Energy: 0.908457380467471
Energy: 0.9757837066904165
Energy: 0.908457380467471
Energy: 0.9757837066891272
Energy: 0.9084573804670414
Energy: 0.980365869118175
Energy: 1.1092253525735254
Energy: 0.9803658691190344
Energy: 1.1092253525735254
Energy: 0.980365869118175
Energy: 1.1092253525739553
Energy: 0.9066758438662765
Energy: 1.0841149279729883
Energy: 0.9065456096104683
Energy: 1.0841149279721285
Energy: 0.906675843867566
Energy: 1.0841149279729883
Energy: 1.0876732748108626
Energy: 1.1118392476863825
Energy: 1.0799393018112335
Energy: 1.1118392476863825
Energy: 1.0876732748100029
Energy: 1.1118392476868124
Energy: 0.9595163244295913
Energy: 1.1268041969120433
Energy: 1.025861486197604
Energy: 1.1268041969107538
Energy: 0.9595163244295913
Energy: 1.1268041969111837
Energy: 1.1661208485002756
Energy: 0.895336497804926
Energy: 1.1661208484998458
Energy: 0.8953364978053556
Energy: 1.1661208485002756
Energy: 0.8953364978044961
Energy: 0.9071698812423915
Energy: 1.0454489638806574
Energy: 0.9071698812415319
Energy: 1.0454489638802278
Energy: 0.9071698812423915
Energy: 1.0454489638797981

minimum gb energy = 0.8861118827724304 eV
minimum distance =  2.39254470206401 Angstroms
sigma value = 51


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

Energy: 1.062466625364147
Energy: 1.0975235931589065
Energy: 1.0624666253651427
Energy: 1.0975235931589065
Energy: 1.062466625364147
Energy: 1.0975235931589065
Energy: 1.1307286498756648
Energy: 1.0066519179345073
Energy: 1.1307286498756648
Energy: 1.0066519179335114
Energy: 1.1307286498756648
Energy: 1.0066519179335114
Energy: 0.9823161702843294
Energy: 1.2663096931683024
Energy: 0.982316170281342
Energy: 1.2663096931683024
Energy: 0.9823161702843294
Energy: 1.2663096931683024
Energy: 0.9993369227975937
Energy: 0.9423373506857678
Energy: 0.9993369227975937
Energy: 0.9423373506857678
Energy: 0.9993369227975937
Energy: 0.9423373506857678
Energy: 1.0803326353381484
Energy: 1.0459080754324954
Energy: 1.0803326353381484
Energy: 1.0459080754324954
Energy: 1.0803326353381484
Energy: 1.0459080754324954
Energy: 1.108724642207586
Energy: 1.0105387004874102
Energy: 1.108724642207586
Energy: 1.0105387004874102
Energy: 1.108724642207586
Energy: 1.0105387004884059
Energy: 0.9477696042909226
Energy: 1.0116865031529472
Energy: 0.9477696042899268
Energy: 1.0116865031519513
Energy: 0.9477696042889309
Energy: 1.0116865031529472
Energy: 0.9723445627152031
Energy: 1.0504892355401572
Energy: 0.9723445627152031
Energy: 1.0504892355401572
Energy: 0.9723445627152031
Energy: 1.0504892355401572
Energy: 1.1866448802993792
Energy: 0.9105063714640063
Energy: 1.1866448802993792
Energy: 0.9105063714640063
Energy: 1.1866448802993792
Energy: 0.9105063714640063
Energy: 0.9562708727825386
Energy: 1.252376387388256
Energy: 0.9562708727825386
Energy: 1.252376387388256
Energy: 0.9562708727825386
Energy: 1.252376387388256
Energy: 1.132687140807143
Energy: 0.9256431240377726
Energy: 1.1326871408081391
Energy: 0.9256431240377726
Energy: 1.132687140807143
Energy: 0.9256431240377726
Energy: 1.035512106929435
Energy: 1.1100815609993153
Energy: 1.035512106929435
Energy: 1.1100815609983197
Energy: 1.035512106929435
Energy: 1.1100815609993153
Energy: 1.18498060830108
Energy: 0.988375665849469
Energy: 1.18498060830108
Energy: 0.988375665849469
Energy: 1.18498060830108
Energy: 0.988375665849469
Energy: 1.0301431598958068
Energy: 0.9934831137768707
Energy: 1.0301431598958068
Energy: 0.9934831137768707
Energy: 1.0301431598948112
Energy: 0.9934831137768707
Energy: 0.9608574906549402
Energy: 1.0069412194640077
Energy: 0.9608574906549402
Energy: 1.0069412194640077
Energy: 0.960857490655936
Energy: 1.0069412194640077
Energy: 1.131164849405396
Energy: 1.0104502232349915
Energy: 1.131164849405396
Energy: 1.0104502232339956
Energy: 1.131164849405396
Energy: 1.0104502232349915
Energy: 1.0517312414747522
Energy: 1.2317178030284088
Energy: 1.0517312414747522
Energy: 1.2317178030284088
Energy: 1.0517312414737563
Energy: 1.2317178030284088
Energy: 1.0038254192691627
Energy: 0.9866949415901567
Energy: 1.0038254192691627
Energy: 0.9866949415901567
Energy: 1.0038254192691627
Energy: 0.9866949415901567

minimum gb energy = 0.9105063714640063 eV
minimum distance =  2.30034448459498 Angstroms
sigma value = 19


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

Energy: 0.9338169243737727
Energy: 1.0137020282198974
Energy: 0.9196252877278273
Energy: 1.0137020282198974
Energy: 0.9338169243737727
Energy: 1.0137020282198974
Energy: 1.1558472013453134
Energy: 1.0642383613597075
Energy: 1.1558472013459042
Energy: 1.0642383613597075
Energy: 1.1558472013453134
Energy: 1.0642383613602984
Energy: 0.84312105585732
Energy: 1.051901894777825
Energy: 0.84312105585732
Energy: 1.0519018947784156
Energy: 0.84312105585732
Energy: 1.0519018947784156
Energy: 1.0110688542913304
Energy: 0.8432726214192497
Energy: 1.0110688542913304
Energy: 0.8432726214192497
Energy: 1.0110688542913304
Energy: 0.8432726214192497
Energy: 0.9447084604765902
Energy: 0.9039385707023444
Energy: 0.9447084604765902
Energy: 0.9039385707023444
Energy: 0.9447084604765902
Energy: 0.9039385707023444
Energy: 0.8408715115164248
Energy: 0.9035590289596183
Energy: 0.8408715115164248
Energy: 0.9035590289602088
Energy: 0.840871511515861
Energy: 0.9035590289596183
Energy: 0.8878253292534413
Energy: 0.8433692210857038
Energy: 0.8878253292528506
Energy: 0.8433692210857038
Energy: 0.8878253292534413
Energy: 0.8433692210857038
Energy: 0.8431468590704736
Energy: 1.172880056719162
Energy: 0.8430711967983008
Energy: 1.1728800567185713
Energy: 0.8431468590704736
Energy: 1.1728800567185713
Energy: 1.1224900830899465
Energy: 1.082710077346683
Energy: 1.0778284333083088
Energy: 1.082710077346683
Energy: 1.1224900830899465
Energy: 1.082710077346683
Energy: 0.9196252877278273
Energy: 1.0137020282198974
Energy: 0.9338169243737727
Energy: 1.0137020282198974
Energy: 0.9196252877278273
Energy: 1.0137020282198974
Energy: 1.155847201344132
Energy: 1.0642383613597075
Energy: 1.1558472013447227
Energy: 1.0642383613597075
Energy: 1.155847201344132
Energy: 1.0642383613591166
Energy: 0.8431210558567294
Energy: 1.0519018947784156
Energy: 0.8431210558567294
Energy: 1.0519018947784156
Energy: 0.8431210558567294
Energy: 1.0519018947784156
Energy: 1.0110688542919213
Energy: 0.8432726214198404
Energy: 1.0110688542919213
Energy: 0.8432726214198404
Energy: 1.0110688542919213
Energy: 0.843272621420431
Energy: 0.9447084604765902
Energy: 0.9039385707029349
Energy: 0.9447084604765902
Energy: 0.9039385707029349
Energy: 0.9447084604765902
Energy: 0.9039385707029349
Energy: 0.8408715115176063
Energy: 0.9035590289596183
Energy: 0.8408715115170154
Energy: 0.9035590289596183
Energy: 0.8408715115170154
Energy: 0.9035590289596183
Energy: 0.8878253292528506
Energy: 0.8433692210862944
Energy: 0.8878253292522599
Energy: 0.8433692210862944
Energy: 0.8878253292534413
Energy: 0.8433692210862944
Energy: 0.8430711967983008
Energy: 1.1728800567185713
Energy: 0.8431468590698832
Energy: 1.1728800567185713
Energy: 0.8430711967983008
Energy: 1.1728800567185713
Energy: 1.0778284333083088
Energy: 1.0827100773472738
Energy: 1.1224900830893556
Energy: 1.082710077346683
Energy: 1.0778284333083088
Energy: 1.0827100773478644
Energy: 0.9338169243737727
Energy: 1.0137020282198974
Energy: 0.9196252877278273
Energy: 1.0137020282198974
Energy: 0.9338169243737727
Energy: 1.0137020282198974
Energy: 1.1558472013453134
Energy: 1.0642383613597075
Energy: 1.1558472013459042
Energy: 1.0642383613602984
Energy: 1.1558472013453134
Energy: 1.0642383613597075
Energy: 0.84312105585732
Energy: 1.0519018947784156
Energy: 0.8431210558567294
Energy: 1.0519018947784156
Energy: 0.84312105585732
Energy: 1.0519018947784156
Energy: 1.0110688542913304
Energy: 0.8432726214198404
Energy: 1.0110688542913304
Energy: 0.8432726214192497
Energy: 1.0110688542913304
Energy: 0.843272621418659
Energy: 0.9447084604765902
Energy: 0.9039385707023444
Energy: 0.9447084604771808
Energy: 0.9039385707029349
Energy: 0.9447084604765902
Energy: 0.9039385707023444
Energy: 0.8408715115164248
Energy: 0.9035590289602088
Energy: 0.8408715115170154
Energy: 0.9035590289602088
Energy: 0.8408715115170154
Energy: 0.9035590289602088
Energy: 0.8878253292534413
Energy: 0.8433692210857038
Energy: 0.8878253292528506
Energy: 0.8433692210857038
Energy: 0.8878253292534413
Energy: 0.8433692210857038
Energy: 0.8431468590710643
Energy: 1.1728800567185713
Energy: 0.8430711967983008
Energy: 1.172880056719162
Energy: 0.8431468590704736
Energy: 1.172880056719162
Energy: 1.1224900830893556
Energy: 1.0827100773460923
Energy: 1.0778284333088994
Energy: 1.082710077346683
Energy: 1.1224900830893556
Energy: 1.0827100773460923
Energy: 0.9196252877278273
Energy: 1.0137020282198974
Energy: 0.9338169243737727
Energy: 1.0137020282198974
Energy: 0.9196252877278273
Energy: 1.0137020282198974
Energy: 1.155847201344132
Energy: 1.0642383613597075
Energy: 1.1558472013453134
Energy: 1.0642383613597075
Energy: 1.155847201344132
Energy: 1.0642383613597075
Energy: 0.84312105585732
Energy: 1.0519018947784156
Energy: 0.84312105585732
Energy: 1.051901894777825
Energy: 0.84312105585732
Energy: 1.051901894777825

minimum gb energy = 0.840871511515861 eV
minimum distance =  2.30776476073162 Angstroms
sigma value = 27


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

Energy: 0.8361939103528544
Energy: 0.7991279695097023
Energy: 0.8361939103528544
Energy: 0.7991279695111493
Energy: 0.8361939103528544
Energy: 0.7991279695111493
Energy: 1.060887677663274
Energy: 0.8291787344847475
Energy: 1.060887677664721
Energy: 0.8291787344847475
Energy: 1.060887677663274
Energy: 0.8291787344847475
Energy: 0.8496640275991729
Energy: 1.0755719572257156
Energy: 0.8496640275991729
Energy: 1.0755719572271625
Energy: 0.8496640275991729
Energy: 1.0755719572257156
Energy: 1.0224840595562679
Energy: 0.7693519321297551
Energy: 1.0224840595562679
Energy: 0.769351932128341
Energy: 1.0224840595562679
Energy: 0.7693519321297551
Energy: 1.1313570726822397
Energy: 0.7667086103664441
Energy: 1.1313570726822397
Energy: 0.7667086103664441
Energy: 1.1313570726822397
Energy: 0.7667086103664441
Energy: 0.8775050166047619
Energy: 1.000099944607505
Energy: 0.8775050166047619
Energy: 1.000099944607505
Energy: 0.8775050166047619
Energy: 1.000099944607505
Energy: 0.848106131281711
Energy: 0.8307110404991658
Energy: 0.848106131281711
Energy: 0.8307110404991658
Energy: 0.848106131281711
Energy: 0.8307110404991658
Energy: 0.8335690323915421
Energy: 0.8018454908167741
Energy: 0.8335690323915421
Energy: 0.8018454908167741
Energy: 0.8335690323915421
Energy: 0.8018454908167741
Energy: 0.8626749067912893
Energy: 0.8498465734807753
Energy: 0.8626749067898425
Energy: 0.849846573693365
Energy: 0.8626749067883955
Energy: 0.8498465734446367
Energy: 0.9254880167322508
Energy: 0.8915530348272567
Energy: 0.9254880167322508
Energy: 0.8915530348272567
Energy: 0.9254880167308039
Energy: 0.8915530348272567
Energy: 0.9943173525742525
Energy: 0.7959272578253509
Energy: 0.9943173525742525
Energy: 0.7959272578253509
Energy: 0.799434686959841
Energy: 0.7959272578253509
Energy: 1.0139729482321036
Energy: 0.8604633873626143
Energy: 1.0139729482306568
Energy: 0.8604633873626143
Energy: 1.0139729482306568
Energy: 0.8604633873626143

minimum gb energy = 0.7667086103664441 eV
minimum distance =  2.29870336701416 Angstroms
sigma value = 9


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

Energy: 0.7522969484877842
Energy: 0.8948691799746298
Energy: 0.7522969484881907
Energy: 0.8948691799746298
Energy: 0.7522969484877842
Energy: 0.8948691799746298
Energy: 1.0168360358130757
Energy: 0.8593772891682235
Energy: 1.0168360358102297
Energy: 0.7995649830182211
Energy: 1.0168360358138886
Energy: 0.7995649830178146
Energy: 0.7074582325098003
Energy: 1.1822938226514963
Energy: 0.7074582325089873
Energy: 1.182293822659627
Energy: 0.7074582325089873
Energy: 1.182293822657594
Energy: 0.7010011863452467
Energy: 0.6910049495895075
Energy: 0.7010011863444336
Energy: 0.6910049495891011
Energy: 0.7010011863448401
Energy: 0.6910049495895075
Energy: 0.8178250094116281
Energy: 0.8357614284134549
Energy: 0.8178250094116281
Energy: 0.8357614284138616
Energy: 0.8178250094116281
Energy: 0.8357614284138616
Energy: 0.7348200533318202
Energy: 0.7979372665550704
Energy: 0.7348200533330399
Energy: 0.7980352471407272
Energy: 0.7348200533330399
Energy: 0.7980351237479324
Energy: 0.7101722056278502
Energy: 0.8499926004808083
Energy: 0.7101722056278502
Energy: 0.8499926004812146
Energy: 0.7101722056270371
Energy: 0.8499926004808083
Energy: 0.6760252903596097
Energy: 0.858381828796679
Energy: 0.6760252903592031
Energy: 0.858381828796679
Energy: 0.6760252903592031
Energy: 0.858381828796679
Energy: 1.1997162067041653
Energy: 0.8629281579431591
Energy: 1.199716206703759
Energy: 0.8629281579435657
Energy: 1.199716206703759
Energy: 0.8629281579439724
Energy: 0.8758394505008675
Energy: 1.0340313001496886
Energy: 0.8758394505008675
Energy: 1.0340313001496886
Energy: 0.8758394505008675
Energy: 1.0340313001496886
Energy: 0.7005983535044326
Energy: 0.69456937361861
Energy: 0.7005983535052456
Energy: 0.6945693736190166
Energy: 0.700598353504839
Energy: 0.6945693736190166
Energy: 0.7795513176832083
Energy: 0.7753036216944672
Energy: 0.7795513176832083
Energy: 0.7753036216948738
Energy: 0.7795513176832083
Energy: 0.7753036216948738
Energy: 0.7315663166625009
Energy: 0.7320013168118685
Energy: 0.7315663166425809
Energy: 0.7320013168118685
Energy: 0.7315663166454266
Energy: 0.732001316812275
Energy: 0.7490765490232273
Energy: 1.0833048847125237
Energy: 0.7490765490224142
Energy: 1.0833048847133366
Energy: 0.7490765490220076
Energy: 1.0833048847133366
Energy: 0.6804191893796387
Energy: 0.8538028705621333
Energy: 0.6804191893792323
Energy: 0.8538028705625398
Energy: 0.6804191893792323
Energy: 0.8538028705621333
Energy: 1.024412474930596
Energy: 0.7238478644424019
Energy: 1.024412474930596
Energy: 0.7238478644411823
Energy: 1.0244124749310024
Energy: 0.7238478644415888
Energy: 0.9214160437457157
Energy: 0.8932994714690318
Energy: 0.9214160437457157
Energy: 0.8932994714714709
Energy: 0.9214160437457157
Energy: 0.8932994714796016
Energy: 0.6869310441993391
Energy: 0.8911140917374285
Energy: 0.6869310441993391
Energy: 0.8911140917378352
Energy: 0.6869310442001523
Energy: 0.8911140917374285
Energy: 0.663688857164647
Energy: 0.984189212683174
Energy: 0.663688857164647
Energy: 0.9841892126835805
Energy: 0.6636888571650534
Energy: 0.984189212683174
Energy: 0.9521663429684464
Energy: 0.8428905011868016
Energy: 0.9521663429688528
Energy: 0.8428905011863953
Energy: 0.9521663429692594
Energy: 0.8428905011859887
Energy: 0.6637851118723513
Energy: 0.9841757164496467
Energy: 0.6637851118723513
Energy: 0.9841757164488336
Energy: 0.6637851118727579
Energy: 0.9841757164500532
Energy: 0.6869744101132641
Energy: 0.8909098388947677
Energy: 0.6869744101136707
Energy: 0.8909098388947677
Energy: 0.6869744101132641
Energy: 0.8909098388947677
Energy: 1.0239773575965498
Energy: 0.8930943890926626
Energy: 1.0239773575965498
Energy: 0.8930943890894103
Energy: 1.0239773575965498
Energy: 0.8930943890914428
Energy: 1.024459738140566
Energy: 0.7346784555422718
Energy: 1.024459738140566
Energy: 0.7346784555434914
Energy: 1.024459738140566
Energy: 0.7346784555422718
Energy: 0.6802503909669481
Energy: 0.8536809603451057
Energy: 0.6802503909669481
Energy: 0.8536809603446991
Energy: 0.6802503909669481
Energy: 0.8536809603446991
Energy: 0.7490976272475861
Energy: 0.8964863451444182
Energy: 0.74909762724596
Energy: 0.8964863451444182
Energy: 0.749097627246773
Energy: 0.8964863451436049
Energy: 0.7308090467873163
Energy: 0.7318563936036488
Energy: 0.7308090467881294
Energy: 0.7318563936028357
Energy: 0.7308090467873163
Energy: 0.7318563936032423
Energy: 0.7797449121588012
Energy: 0.720424122849639
Energy: 0.7797449121592076
Energy: 0.7204241228480128
Energy: 0.779744912157988
Energy: 0.7204241228500454
Energy: 0.7006900891459827
Energy: 0.6946730582099845
Energy: 0.7006900891455762
Energy: 0.694673058210391
Energy: 0.7006900891459827
Energy: 0.694673058210391
Energy: 0.8757756905649504
Energy: 1.028821623220673
Energy: 0.8757756905645439
Energy: 1.028821623220673
Energy: 0.8757756905657634
Energy: 1.028821623220673
Energy: 1.2021802965973072
Energy: 0.8627025518040765
Energy: 1.2021802965977135
Energy: 0.8627025518032636
Energy: 1.202180296596494
Energy: 0.86270255180367
Energy: 0.6760684123288286
Energy: 0.8587418595353433
Energy: 0.6760684123288286
Energy: 0.8587418595357499
Energy: 0.6760684123288286
Energy: 0.8587418595353433
Energy: 0.7103964396923963
Energy: 0.8435601277119023
Energy: 0.7103964396936159
Energy: 0.8435601277123088
Energy: 0.7103964396915832
Energy: 0.8435601277110891
Energy: 0.7347463024655927
Energy: 0.745484162248701
Energy: 0.7347463024830735
Energy: 0.745484162248701
Energy: 0.7347463024786016
Energy: 0.7454841622482945
Energy: 0.8178785128867038
Energy: 0.8359789582437637
Energy: 0.8178785128867038
Energy: 0.835978958241731
Energy: 0.8178785128867038
Energy: 0.8359789582425441
Energy: 0.7010433856405358
Energy: 0.6907280724488487
Energy: 0.7010433856401294
Energy: 0.6907280724496617
Energy: 0.7010433856405358
Energy: 0.6907280724492553
Energy: 0.7074100726088145
Energy: 1.1851826027249903
Energy: 0.7074100726080014
Energy: 1.1851826027253967
Energy: 0.7074100726080014
Energy: 1.1851826027266166
Energy: 1.0168489053108507
Energy: 0.7228060316480579
Energy: 1.0168489053161358
Energy: 0.7228060316484644
Energy: 1.016848905315323
Energy: 0.7682277532278248
Energy: 0.7522969484877842
Energy: 0.8948691799730036
Energy: 0.7522969484873776
Energy: 0.8948691799730036
Energy: 0.7522969484877842
Energy: 0.894869179972597
Energy: 1.016836035805758
Energy: 0.7995649830178146
Energy: 1.0168360358090103
Energy: 0.7995649830174081
Energy: 1.0168360358021362
Energy: 0.7995649830178146
Energy: 0.7074582325085808
Energy: 1.1822938226458048
Energy: 0.7074582325089873
Energy: 1.1822938226453983
Energy: 0.7074582325085808
Energy: 1.1822938226453983
Energy: 0.7010011863460598
Energy: 0.6910049495895075
Energy: 0.7010011863468728
Energy: 0.6910049495899141
Energy: 0.7010011863460598
Energy: 0.6910049495895075
Energy: 0.8178250094116281
Energy: 0.8357614284138616
Energy: 0.8178250094112215
Energy: 0.8357614284142681
Energy: 0.8178250094112215
Energy: 0.8357614284142681

minimum gb energy = 0.663688857164647 eV
minimum distance =  2.36883738230039 Angstroms
sigma value = 57


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

Energy: 0.410723304845908
Energy: 0.4086075689545864
Energy: 0.3020480617102131
Energy: 0.4086075689555117
Energy: 0.410723304845908
Energy: 0.4086075689555117
Energy: 0.49248565194589367
Energy: 0.40679038570448106
Energy: 0.49248565194589367
Energy: 0.4067903857054065
Energy: 0.49248565194589367
Energy: 0.40679038570448106
Energy: 0.44412216280984
Energy: 0.883959252652167
Energy: 0.4441221628089146
Energy: 0.8839592526512416
Energy: 0.44412216280984
Energy: 0.883959252652167
Energy: 0.40956798624369534
Energy: 0.3019030224789552
Energy: 0.4095679862427699
Energy: 0.3019030224789552
Energy: 0.40956798624369534
Energy: 0.3019030224789552
Energy: 0.3912897699619215
Energy: 0.4969506970979731
Energy: 0.3912897699619215
Energy: 0.4969506970979731
Energy: 0.3912897699619215
Energy: 0.49695069709704776
Energy: 0.3020147422766915
Energy: 1.253442578389872
Energy: 0.3020147422766915
Energy: 1.253442578389872
Energy: 0.3020147422766915
Energy: 1.253442578389872
Energy: 0.3021389934636544
Energy: 0.34197397521879597
Energy: 0.3021389934636544
Energy: 0.34197397521879597
Energy: 0.3021389934636544
Energy: 0.3419739752197214
Energy: 0.49269371522842487
Energy: 0.394912655564637
Energy: 0.49269371522842487
Energy: 0.394912655564637
Energy: 0.49269371522842487
Energy: 0.394912655564637
Energy: 0.4105678783261087
Energy: 0.30183707869064513
Energy: 0.4105678783261087
Energy: 0.30183707869064513
Energy: 0.4105678783261087
Energy: 0.3018370786915705
Energy: 0.3449193426391403
Energy: 1.0517414272107017
Energy: 0.3449193426391403
Energy: 1.0517414272107017
Energy: 0.3449193426391403
Energy: 1.0517414272107017
Energy: 0.3926893464653999
Energy: 1.087992465320006
Energy: 0.3926893464653999
Energy: 1.0879924653209314
Energy: 0.3926893464653999
Energy: 1.0879924653209314
Energy: 0.410723304845908
Energy: 0.4086075689545864
Energy: 0.3020480617102131
Energy: 0.4086075689545864
Energy: 0.410723304845908
Energy: 0.4086075689545864
Energy: 0.49248565194681904
Energy: 0.4067903857063319
Energy: 0.49248565194681904
Energy: 0.4067903857054065
Energy: 0.49248565194589367
Energy: 0.40679038570448106
Energy: 0.44412216280984
Energy: 0.883959252652167
Energy: 0.44412216280984
Energy: 0.883959252652167
Energy: 0.44412216280984
Energy: 0.8839592526512416
Energy: 0.40956798624462076
Energy: 0.30190302247802975
Energy: 0.40956798624462076
Energy: 0.30190302247802975
Energy: 0.40956798624462076
Energy: 0.30190302247802975
Energy: 0.39128976996284687
Energy: 0.4969506970979731
Energy: 0.39128976996284687
Energy: 0.4969506970988565
Energy: 0.39128976996284687
Energy: 0.49695069709704776
Energy: 0.3020147422766915
Energy: 1.253442578389872
Energy: 0.30201474227761693
Energy: 1.253442578389872
Energy: 0.3020147422766915
Energy: 1.253442578389872
Energy: 0.3021389934636544
Energy: 0.3419739752178705
Energy: 0.3021389934636544
Energy: 0.34197397521879597
Energy: 0.3021389934636544
Energy: 0.34197397521879597
Energy: 0.49269371522842487
Energy: 0.394912655564637
Energy: 0.49269371522842487
Energy: 0.394912655564637
Energy: 0.49269371522842487
Energy: 0.394912655564637

minimum gb energy = 0.30183707869064513 eV
minimum distance =  2.4498496778612 Angstroms
sigma value = 11


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

Energy: 0.6507268995939589
Energy: 0.7535504601083279
Energy: 0.6507268995939589
Energy: 0.7535504601083279
Energy: 0.6507268995939589
Energy: 0.7535504601083279
Energy: 0.7871909617101127
Energy: 0.7297373793553803
Energy: 0.7871909617053675
Energy: 0.7297373793553803
Energy: 0.787190961707401
Energy: 0.7297373793553803
Energy: 0.907353547580544
Energy: 1.0661427749701988
Energy: 0.8748705594536186
Energy: 1.066142774955963
Energy: 0.8748705594542965
Energy: 1.06614277496342
Energy: 0.972537674591354
Energy: 0.6211878714765883
Energy: 0.9725376745920318
Energy: 0.6211878714772661
Energy: 0.972537674591354
Energy: 0.6211878714765883
Energy: 0.7390504558685983
Energy: 0.5493383601942183
Energy: 0.7390504558685983
Energy: 0.5493383601935404
Energy: 0.7390504558685983
Energy: 0.5493383601935404
Energy: 0.6909649239663185
Energy: 0.8002974189517323
Energy: 0.6909649239649628
Energy: 0.8002974189517323
Energy: 0.6909649239656407
Energy: 0.8002974189517323
Energy: 0.5477551460576496
Energy: 0.8012890094815018
Energy: 0.5477551460569718
Energy: 0.8012890094869252
Energy: 0.5477551460583276
Energy: 0.8012890094828578
Energy: 0.7536199127704616
Energy: 0.5245948455709605
Energy: 0.7536199127691058
Energy: 0.5245948455709605
Energy: 0.7536199127691058
Energy: 0.5245948455709605
Energy: 0.7489718464945275
Energy: 0.5412204580720767
Energy: 0.7489718464945275
Energy: 0.5412204580727545
Energy: 0.7489718464952054
Energy: 0.5412204580727545
Energy: 0.5385620203148487
Energy: 1.0444913279047088
Energy: 0.5385620203148487
Energy: 1.0444913279053867
Energy: 0.5385620203155265
Energy: 1.0444913279047088
Energy: 0.8282744167310138
Energy: 1.0273870234353264
Energy: 0.8282744167310138
Energy: 1.0273870234353264
Energy: 0.8282744167316918
Energy: 1.0273870234353264
Energy: 0.743953046413401
Energy: 0.5515564129386494
Energy: 0.743953046413401
Energy: 0.5515564129379714
Energy: 0.743953046413401
Energy: 0.5515564129379714
Energy: 0.7590760324023416
Energy: 0.6206723965514647
Energy: 0.7590760324030196
Energy: 0.6206723965521427
Energy: 0.7590760324023416
Energy: 0.6206723965521427
Energy: 0.8236908302724326
Energy: 0.9511812883941045
Energy: 0.8236908302724326
Energy: 0.9511812883927486
Energy: 0.8236908302717546
Energy: 0.9511812883934266
Energy: 0.9274527348996766
Energy: 0.7266763758241127
Energy: 0.9274527349003545
Energy: 0.7266763758241127
Energy: 0.9274527348996766
Energy: 0.7266763758247906
Energy: 0.6514301961979132
Energy: 0.7541058239387335
Energy: 0.6514301961979132
Energy: 0.7541058239380557
Energy: 0.6514301961985911
Energy: 0.7541058239387335
Energy: 0.6517996153357791
Energy: 0.746030704206573
Energy: 0.6517996153351012
Energy: 0.746030704206573
Energy: 0.6517996153357791
Energy: 0.746030704206573
Energy: 0.9490174735378035
Energy: 0.8438097033688758
Energy: 0.9490174735378035
Energy: 0.8438097033695536
Energy: 0.9490174735371255
Energy: 0.8438097033695536
Energy: 0.9815762286569275
Energy: 0.5735407936262658
Energy: 0.9815762286569275
Energy: 0.5735407936269435
Energy: 0.9815762286569275
Energy: 0.5735407936262658
Energy: 0.7437580763619276
Energy: 0.6492341726381283
Energy: 0.7437580763626055
Energy: 0.6492341726388061
Energy: 0.7437580763626055
Energy: 0.6492341726381283
Energy: 0.5382280440661965
Energy: 0.755162938264452
Energy: 0.5382280440661965
Energy: 0.755162938264452
Energy: 0.5382280440661965
Energy: 0.755162938264452
Energy: 0.7483676851194063
Energy: 0.8015299727419599
Energy: 0.74836768512144
Energy: 0.8015299727426378
Energy: 0.74836768512144
Energy: 0.8015299727419599
Energy: 0.7543985326919095
Energy: 0.6639660610769733
Energy: 0.7543985326919095
Energy: 0.6639660610769733
Energy: 0.7543985326919095
Energy: 0.6639660610769733
Energy: 0.7501969618325693
Energy: 0.6399647598294693
Energy: 0.7501969618332474
Energy: 0.6399647598294693
Energy: 0.7501969618325693
Energy: 0.6399647598294693
Energy: 0.5385211278601624
Energy: 1.0253513079356216
Energy: 0.5385211278608402
Energy: 1.0253513079335879
Energy: 0.5385211278601624
Energy: 1.0253513079342658
Energy: 1.198223918815692
Energy: 1.0169231436275432
Energy: 1.198223918815692
Energy: 1.0169231436268653
Energy: 1.198223918815692
Energy: 1.0169231436268653

minimum gb energy = 0.5245948455709605 eV
minimum distance =  2.36054719986565 Angstroms
sigma value = 41


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

Energy: 0.7412276135852639
Energy: 0.6390613694103061
Energy: 0.7412276135852639
Energy: 0.6390613694103061
Energy: 0.7412276135857983
Energy: 0.6390613694103061
Energy: 0.812991537049402
Energy: 0.9158741454212409
Energy: 0.8129915370483335
Energy: 0.9158741454212409
Energy: 0.8129915370483335
Energy: 0.9158741454212409
Energy: 1.068761981669685
Energy: 1.207007054060622
Energy: 1.068761981669685
Energy: 1.2070070540611562
Energy: 1.068761981669685
Energy: 1.207007054060622
Energy: 0.7899402674284215
Energy: 0.6360024768727272
Energy: 0.7899402674284215
Energy: 0.636002476872193
Energy: 0.7899402674284215
Energy: 0.636002476872193
Energy: 0.5926179489944866
Energy: 0.6423777148956941
Energy: 0.5926179489939525
Energy: 0.6423777148962285
Energy: 0.5926179489939525
Energy: 0.6423777148946256
Energy: 0.7946530918393344
Energy: 0.922233307281397
Energy: 0.7946530918414715
Energy: 0.922233307281397
Energy: 0.7946530918420059
Energy: 0.922233307281397
Energy: 0.6109997214286305
Energy: 0.9796175177859482
Energy: 0.6109997214275619
Energy: 0.9796175177859482
Energy: 0.6109997214286305
Energy: 0.9796175177864823
Energy: 0.603889872533536
Energy: 0.636196316600058
Energy: 0.603889872533536
Energy: 0.6361963165995237
Energy: 0.6038898725346045
Energy: 0.6361963165995237
Energy: 0.6042383339915539
Energy: 0.635028021891043
Energy: 0.6042383339915539
Energy: 0.6350280218915773
Energy: 0.6042383339915539
Energy: 0.6350280218915773
Energy: 0.6597869531440061
Energy: 1.0926474316354329
Energy: 0.6597869531450747
Energy: 1.0926474316354329
Energy: 0.6597869531456091
Energy: 1.0926474316359671
Energy: 0.6593614470583227
Energy: 1.06743923289193
Energy: 0.6593614470567198
Energy: 1.0674392328924642
Energy: 0.6593614470583227
Energy: 1.06743923289193
Energy: 0.6153697864565674
Energy: 0.7544379169679332
Energy: 0.6153697864565674
Energy: 0.7544379169679332
Energy: 0.6153697864565674
Energy: 0.7544379169679332
Energy: 0.5958329707299778
Energy: 0.6265479427461956
Energy: 0.5958329707289091
Energy: 0.6265479427461956
Energy: 0.5958329707289091
Energy: 0.6265479427461956
Energy: 0.568213128077181
Energy: 1.2992922648592933
Energy: 0.5682131280766467
Energy: 1.2992922648592933
Energy: 0.568213128077181
Energy: 1.2992922648598277
Energy: 0.7911848037877572
Energy: 0.9965244601380261
Energy: 0.7911848037882915
Energy: 0.9965244601380261
Energy: 0.791184803787223
Energy: 0.9965244601380261
Energy: 0.6017177674527232
Energy: 0.7706250207912418
Energy: 0.6017177674527232
Energy: 0.7706250207912418
Energy: 0.601717767452189
Energy: 0.7706250207912418
Energy: 0.6178610079268783
Energy: 0.6262852285620226
Energy: 0.6178610079268783
Energy: 0.6262852285620226
Energy: 0.6178610079268783
Energy: 0.6262852285620226
Energy: 0.8731473832383542
Energy: 1.240832390194029
Energy: 0.8731473832383542
Energy: 1.240832390194029
Energy: 0.8731473832383542
Energy: 1.240832390194029
Energy: 0.8136513173273826
Energy: 0.8620599905633535
Energy: 0.8136513173279168
Energy: 0.862059990562819
Energy: 0.8136513173279168
Energy: 0.862059990562819
Energy: 0.7338582546887935
Energy: 0.9110704877969444
Energy: 0.7338582546882594
Energy: 0.9110704877969444
Energy: 0.7338582546882594
Energy: 0.9790443120059471
Energy: 0.6016502442997406
Energy: 0.9113083346276161
Energy: 0.6016502442997406
Energy: 0.9113083346276161
Energy: 0.6016502442997406
Energy: 0.9113083346276161
Energy: 1.066896964232503
Energy: 1.08312122054417
Energy: 1.066896964232503
Energy: 1.0831212205447045
Energy: 1.066896964232503
Energy: 1.08312122054417
Energy: 0.8068342070936348
Energy: 0.609131460751302
Energy: 0.8068342070931005
Energy: 0.6091314607507675
Energy: 0.8068342070931005
Energy: 0.609131460751302
Energy: 0.6018394359648229
Energy: 0.9194142498999711
Energy: 0.6018394359648229
Energy: 0.9194142498999711
Energy: 0.6018394359648229
Energy: 0.9194142498999711
Energy: 0.580762283550947
Energy: 0.9329002847138508
Energy: 0.5807622835504126
Energy: 0.9329002847138508
Energy: 0.5807622835504126
Energy: 0.9329002847138508
Energy: 0.6096170506623181
Energy: 0.6112237659442046
Energy: 0.6096170506617837
Energy: 0.6112237659442046
Energy: 0.6096170506623181
Energy: 0.6112237659447388
Energy: 0.5915706147957918
Energy: 0.6089139939670407
Energy: 0.5915706147947232
Energy: 0.608913993967575
Energy: 0.5915706147957918
Energy: 0.608913993967575
Energy: 0.6042311120721661
Energy: 0.9053635791740576
Energy: 0.6042311120721661
Energy: 0.9053635791740576
Energy: 0.6042311120721661
Energy: 0.9314716479367336
Energy: 0.7347340383307055
Energy: 0.9160999276231919
Energy: 0.7347340383301711
Energy: 0.9160999276231919
Energy: 0.734734038329637
Energy: 0.9160999276226576
Energy: 0.8978808786762947
Energy: 0.5686958230249795
Energy: 0.8978808786746919
Energy: 0.5686958230249795
Energy: 0.8978808786757604
Energy: 0.5686958230249795
Energy: 0.5894518117999265
Energy: 0.7466268390776925
Energy: 0.5894518117993922
Energy: 0.746626839078761
Energy: 0.5894518117993922
Energy: 0.7466268390771581
Energy: 0.6218997029936676
Energy: 0.7173423678398992
Energy: 0.6218997029936676
Energy: 0.7173423678398992
Energy: 0.6218997029936676
Energy: 0.7173423678398992
Energy: 0.580885215227167
Energy: 0.766394876355484
Energy: 0.580885215227167
Energy: 0.766394876355484
Energy: 0.580885215227167
Energy: 0.7663948763549496

minimum gb energy = 0.5682131280766467 eV
minimum distance =  2.39585746053599 Angstroms
sigma value = 33


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

Energy: 0.7000291198127305
Energy: 0.6533360074380061
Energy: 0.7000291198131056
Energy: 0.653336007438381
Energy: 0.7000291198134805
Energy: 0.6533360074387561
Energy: 0.9890637305110807
Energy: 0.622619552193688
Energy: 0.9890637305118307
Energy: 0.6226195521940631
Energy: 0.9890637305118307
Energy: 0.6226195521940631
Energy: 1.1054921274963732
Energy: 0.9515621850989656
Energy: 1.1054921274959981
Energy: 0.9515621850985906
Energy: 1.1054921274959981
Energy: 0.9515621850970908
Energy: 0.9524638916942927
Energy: 0.6339484312598566
Energy: 0.9524638916946677
Energy: 0.6339484312594816
Energy: 0.9524638916946677
Energy: 0.6339484312598566
Energy: 0.6458632513319792
Energy: 1.1043427140138427
Energy: 0.6458632513319792
Energy: 1.1043427140134676
Energy: 0.6458632513304793
Energy: 1.1043427140138427
Energy: 0.9578232938236002
Energy: 0.6518653237769624
Energy: 0.9578232938236002
Energy: 0.6518653237762125
Energy: 0.9578232938232253
Energy: 0.6518653237762125
Energy: 0.6665020458225409
Energy: 0.7378616525803897
Energy: 0.6665020458225409
Energy: 0.7378616525785149
Energy: 0.6665020458221659
Energy: 0.7378616525822645
Energy: 0.7432590340673922
Energy: 0.8059221389827249
Energy: 0.7432590340670173
Energy: 0.8059221389830998
Energy: 0.7432590340670173
Energy: 0.8059221389827249
Energy: 1.1041515296554625
Energy: 0.6695754829358342
Energy: 1.1041515296558375
Energy: 0.6695754829358342
Energy: 1.1041515296562125
Energy: 0.6695754829358342
Energy: 1.002927527059233
Energy: 0.6413363237173461
Energy: 1.0029275270577334
Energy: 0.6413363237173461
Energy: 1.0029275270588582
Energy: 0.641336323718096
Energy: 0.696806658033168
Energy: 0.6935609293787962
Energy: 0.696806658033918
Energy: 0.6935609293784212
Energy: 0.696806658033918
Energy: 0.6935609293776712
Energy: 1.1271126049143843
Energy: 0.6332193602718046
Energy: 1.1271126049143843
Energy: 0.6332193602721796
Energy: 1.1271126049143843
Energy: 0.6332193602725545
Energy: 0.6707638919722825
Energy: 1.1033218785291434
Energy: 0.6707638919719076
Energy: 1.1033218785287686
Energy: 0.6707638919722825
Energy: 1.1033218785291434
Energy: 0.8094486211352634
Energy: 0.7435581074693707
Energy: 0.8094486211360133
Energy: 0.7435581074686208
Energy: 0.8094486211352634
Energy: 0.7435581074693707
Energy: 0.7172005501057699
Energy: 0.6608582737876418
Energy: 0.717200550103895
Energy: 0.660858273786142
Energy: 0.7172005500993954
Energy: 0.6608582737868919
Energy: 0.6875033450624483
Energy: 0.9645976295977076
Energy: 0.6875033450628233
Energy: 0.9645976295977076
Energy: 0.6875033450624483
Energy: 0.9645976295977076
Energy: 1.1144130476370184
Energy: 0.6468721713129688
Energy: 1.1144130476373935
Energy: 0.6468721713122189
Energy: 1.1144130476370184
Energy: 0.6468721713122189
Energy: 0.6318442385039199
Energy: 0.953856078815007
Energy: 0.6318442385039199
Energy: 0.9538560788153818
Energy: 0.6318442385039199
Energy: 0.953856078815757
Energy: 1.0000351275328891
Energy: 1.1024949485147282
Energy: 1.000035127533264
Energy: 1.1024949485147282
Energy: 1.0000351275328891
Energy: 1.1024949485147282
Energy: 1.1117696896838896
Energy: 0.6735377005293053
Energy: 1.1117696896838896
Energy: 0.6735377005300552
Energy: 1.1117696896838896
Energy: 0.6735377005293053
Energy: 0.6324268052968536
Energy: 0.7111124902994901
Energy: 0.6324268052972285
Energy: 0.711112490299115
Energy: 0.6324268052972285
Energy: 0.7111124902987402
Energy: 0.6213447131135685
Energy: 1.011139475780674
Energy: 0.6213447131135685
Energy: 1.0111394757814238
Energy: 0.6213447131135685
Energy: 1.011139475780674
Energy: 0.9128491278654232
Energy: 0.8693415811423113
Energy: 0.9128491278654232
Energy: 0.8693415811419362
Energy: 0.9128491278650481
Energy: 0.8693415811419362
Energy: 0.6364599825027907
Energy: 0.9519754619330092
Energy: 0.6364599825027907
Energy: 0.9519754619330092
Energy: 0.6364599825020407
Energy: 0.9519754619330092
Energy: 1.101698047468123
Energy: 0.6468863401112742
Energy: 1.101698047468123
Energy: 0.6468863401123992
Energy: 1.1016980474684979
Energy: 0.6468863401105244
Energy: 0.65053105224467
Energy: 0.9599305086421387
Energy: 0.650531052245045
Energy: 0.9599305086421387
Energy: 0.65053105224467
Energy: 0.9599305086421387
Energy: 0.9622020927871523
Energy: 0.7122032483537771
Energy: 0.9622020927890271
Energy: 0.7122032483545271
Energy: 0.9622020927901522
Energy: 0.7122032483545271
Energy: 0.7588057648289092
Energy: 0.6371599281806614
Energy: 0.7588057648289092
Energy: 0.6371599281810363
Energy: 0.7588057648289092
Energy: 0.6371599281806614
Energy: 0.6707478407738354
Energy: 1.1031671416096138
Energy: 0.6707478407730855
Energy: 1.1031671416096138
Energy: 0.6707478407730855
Energy: 1.1031671416092388
Energy: 0.6402693617961772
Energy: 0.9978782159479
Energy: 0.6402693617958022
Energy: 0.9978782159479
Energy: 0.6402693617954273
Energy: 0.9978782159479
Energy: 0.9792673580164989
Energy: 0.6325419551886067
Energy: 0.9792673580176238
Energy: 0.6325419551886067
Energy: 0.9792673580161239
Energy: 0.6325419551882316
Energy: 0.6366006731153677
Energy: 1.1274502892989466
Energy: 0.6366006731149929
Energy: 1.127450289299322
Energy: 0.6366006731157428
Energy: 1.1274502892989466
Energy: 1.1121115104809138
Energy: 0.6814054761423791
Energy: 1.1121115104809138
Energy: 0.6814054761416292
Energy: 1.1121115104809138
Energy: 0.6814054761416292
Energy: 0.7454232134527617
Energy: 0.7661740567240705
Energy: 0.7454232134523867
Energy: 0.7661740567251955
Energy: 0.7454232134523867
Energy: 0.7661740567233206
Energy: 0.6950349193550354
Energy: 0.7654957813625443
Energy: 0.6950349193422865
Energy: 0.7654957813629193
Energy: 0.695034919347536
Energy: 0.7654957813625443
Energy: 1.1121220694390976
Energy: 0.681453866971733
Energy: 1.1121220694387228
Energy: 0.681453866971358
Energy: 1.112122069438348
Energy: 0.681453866970983
Energy: 0.6366446368600323
Energy: 1.1272154664480805
Energy: 0.6366446368600323
Energy: 1.1272154664477054
Energy: 0.6366446368607823
Energy: 1.1272154664480805
Energy: 0.9790833059153737
Energy: 0.6323623193017612
Energy: 0.9790833059138738
Energy: 0.6323623193021363
Energy: 0.9790833059142489
Energy: 0.6323623193017612
Energy: 0.6402323110449919
Energy: 0.9978013231782507
Energy: 0.6402323110453668
Energy: 0.9978013231793756
Energy: 0.6402323110446169
Energy: 0.9978013231771258
Energy: 0.6706529841295027
Energy: 1.1031806805603475
Energy: 0.6706529841295027
Energy: 1.1031806805607225
Energy: 0.6706529841295027
Energy: 1.1031806805607225
Energy: 0.758807700207691
Energy: 0.6370879135116523
Energy: 0.758807700207691
Energy: 0.6370879135112772
Energy: 0.758807700207691
Energy: 0.6370879135116523
Energy: 1.0125228031133766
Energy: 0.712263567954868
Energy: 1.0125228031141267
Energy: 0.712263567954868
Energy: 1.0125228031141267
Energy: 0.712263567954868
Energy: 0.6504468349801972
Energy: 0.9602827992784094
Energy: 0.6504468349801972
Energy: 0.9602827992769095
Energy: 0.6504468349805722
Energy: 0.9602827992776595
Energy: 1.1016804915764873
Energy: 0.6468302373203572
Energy: 1.1016804915761125
Energy: 0.6468302373214819
Energy: 1.1016804915764873
Energy: 0.6468302373211071
Energy: 0.6364275163023039
Energy: 0.9515354408873913
Energy: 0.6364275163030538
Energy: 0.9515354408873913
Energy: 0.6364275163026788
Energy: 0.9515354408885164
Energy: 0.9132684292257062
Energy: 0.8693569253079334
Energy: 0.913268429226831
Energy: 0.8693569253079334
Energy: 0.9132684292253312
Energy: 0.8693569253079334
Energy: 0.621309360135695
Energy: 1.0112090480666418
Energy: 0.621309360135695
Energy: 1.0112090480670166
Energy: 0.6213093601353201
Energy: 1.0112090480666418

minimum gb energy = 0.6213093601353201 eV
minimum distance =  2.34425477348985 Angstroms
sigma value = 67


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

Energy: 0.7469553980258451
Energy: 0.6769113926333519
Energy: 0.7469553980258451
Energy: 0.6769113926333519
Energy: 0.7469553980263292
Energy: 0.6769113926336081
Energy: 0.7330994608563283
Energy: 0.663170471244592
Energy: 0.7330994608563283
Energy: 0.663170471244592
Energy: 0.7330994608563283
Energy: 0.663170471244592
Energy: 0.6853230903065061
Energy: 0.8670708005931869
Energy: 0.6853230903062782
Energy: 0.8670708005929305
Energy: 0.9084307249097251
Energy: 0.8670708005931869
Energy: 0.7330918843321277
Energy: 0.663163052371779
Energy: 0.7330918843326117
Energy: 0.663163052371779
Energy: 0.7330918843323839
Energy: 0.6631630523715512
Energy: 0.7469553980260729
Energy: 0.6769113926336081
Energy: 0.7469553980260729
Energy: 0.6769113926338645
Energy: 0.7469553980263292
Energy: 0.6769113926336081
Energy: 0.7330994608558158
Energy: 0.6631704712448484
Energy: 0.7330994608558158
Energy: 0.6631704712448484
Energy: 0.733099460856072
Energy: 0.663170471244592
Energy: 0.6853230903067623
Energy: 0.8670708005936996
Energy: 0.6853230903065061
Energy: 0.8670708005936996
Energy: 0.6853230903065061
Energy: 0.8670708005934431

minimum gb energy = 0.6631630523715512 eV
minimum distance =  2.3893345471427 Angstroms
sigma value = 3


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

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Energy: 0.8778800074441735
Energy: 1.0527371220363737
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Energy: 0.9935674383871849
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Energy: 1.1090990155249725
Energy: 0.8999341294775763
Energy: 1.1090990155236085
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Energy: 0.844783782279208
Energy: 1.1020245334155416
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Energy: 1.1020245334148595
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Energy: 0.9610294676438177
Energy: 0.9310559210666682
Energy: 0.9610294676424537
Energy: 0.9310559210676602
Energy: 0.9610294676428256
Energy: 1.0802870898612622
Energy: 0.8982619590495353
Energy: 1.0802870898636803
Energy: 0.8982619590495353
Energy: 1.0802870898643624
Energy: 0.8982619590491634
Energy: 1.119684292876878
Energy: 0.8227399671769347
Energy: 1.1196842928782422
Energy: 0.8227399671731525
Energy: 1.11968429287787
Energy: 0.8227399671748886
Energy: 0.9296885764793266
Energy: 1.0233789265212634
Energy: 0.9296881043075268
Energy: 1.0233789265192172
Energy: 0.9296885764793266
Energy: 1.023378926518907
Energy: 0.8858865372323033
Energy: 0.9674168221270587
Energy: 0.8858865372323033
Energy: 0.9674168221256945
Energy: 0.8858865372305672
Energy: 0.9674168221263766
Energy: 0.9936965013499099
Energy: 1.0014943013293935
Energy: 0.9936965013499099
Energy: 1.0014943013280295
Energy: 0.9936965013519562
Energy: 1.0014943013283397
Energy: 0.9580258606828409
Energy: 0.9783716789289657
Energy: 0.958025860683833
Energy: 0.9783716789296478
Energy: 0.958025860684887
Energy: 0.9783716789286557
Energy: 0.9853348407106473
Energy: 0.9522802963205058
Energy: 0.9855756985779742
Energy: 0.95228029632187
Energy: 0.9853348407092833
Energy: 0.9522802963198236

minimum gb energy = 0.7886547558563434 eV
minimum distance =  2.2935291877436 Angstroms
sigma value = 81


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

Energy: 1.0848603313511334
Energy: 0.9585431787814874
Energy: 1.0396398535196603
Energy: 0.9585431787824233
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Energy: 1.2669101779752332
Energy: 0.999494213065139
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Energy: 0.999494213064671
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Energy: 0.9553480600332602
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Energy: 0.9755451741375042
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Energy: 0.8766788473378977
Energy: 1.0875899579601942
Energy: 0.8871080484402459
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Energy: 1.0875899579597264
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Energy: 0.9837779680950943
Energy: 1.0217731792896307
Energy: 0.9840823951603085
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Energy: 0.9926825228007004
Energy: 1.012428530028337
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Energy: 1.006373507209574
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Energy: 1.0063735072086382
Energy: 1.0681661244845921
Energy: 0.903434705888771
Energy: 0.9096292325469222
Energy: 0.9034347058883029
Energy: 0.9096292325469222
Energy: 0.903434705888771
Energy: 0.9096292325464542
Energy: 1.0464247747424487
Energy: 1.0216647650443804
Energy: 1.0464247747410442
Energy: 1.0216647650443804
Energy: 1.0464247747419806
Energy: 1.0216647650443804
Energy: 0.9372979720064116
Energy: 0.9318710903352054
Energy: 0.9372718649019257
Energy: 0.9318710903352054
Energy: 0.9372979720068798
Energy: 0.9318710903352054
Energy: 0.955796578674064
Energy: 0.7967362264228918
Energy: 0.955796578674532
Energy: 0.7967362264228918
Energy: 0.955796578674064
Energy: 0.7967362264224237
Energy: 0.9799416970050615
Energy: 1.1940998510259202
Energy: 0.9799416970050615
Energy: 1.194099851026388
Energy: 0.9799416970050615
Energy: 1.1940998510259202
Energy: 0.8873659829069037
Energy: 0.9205115566769547
Energy: 0.8873659829059675
Energy: 0.9205115566778909
Energy: 0.8873659829069037
Energy: 0.9205115566783589
Energy: 1.0610695109783232
Energy: 0.9727500429597765
Energy: 1.0610746504602457
Energy: 0.9727500429597765
Energy: 1.0610695109787913
Energy: 0.9727500429593083
Energy: 1.1484434830475736
Energy: 0.9364928729447474
Energy: 1.1483203885766937
Energy: 0.9364928729447474
Energy: 1.1484434830471055
Energy: 0.9364928729447474
Energy: 0.8992265081817137
Energy: 1.3280904369982005
Energy: 0.8992322858240062
Energy: 1.3280904369977324
Energy: 0.8992265081817137
Energy: 1.3280904369982005
Energy: 1.0288281263097938
Energy: 1.006166568465468
Energy: 1.0288281263097938
Energy: 1.006166568465
Energy: 1.0288281263093257
Energy: 1.0061665684635956
Energy: 0.9376650764537644
Energy: 0.9154037479332989
Energy: 0.9376650764547005
Energy: 0.9154037479332989
Energy: 0.9376650764537644
Energy: 0.9154037479332989
Energy: 1.034250738001193
Energy: 1.1110560382150572
Energy: 1.0342507380007246
Energy: 1.1110560382150572
Energy: 1.034250738001193
Energy: 1.1110560382150572

minimum gb energy = 0.7967362264224237 eV
minimum distance =  2.27309599302488 Angstroms
sigma value = 43


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

Energy: 1.1017795973161348
Energy: 0.8434132819574242
Energy: 1.1017795973161348
Energy: 0.8434132819568493
Energy: 1.1017795973161348
Energy: 0.8434132819568493
Energy: 0.9923195488007219
Energy: 0.8624269533365502
Energy: 0.9923195488012968
Energy: 0.8624269533365502
Energy: 0.9923195488012968
Energy: 0.862426953337125
Energy: 0.9324427446948458
Energy: 1.0819471839155441
Energy: 0.9324427446948458
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Energy: 0.9324427446948458
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Energy: 1.0194929956602972
Energy: 0.9135007871283133
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Energy: 0.9135007871283133
Energy: 1.0194929956602972
Energy: 0.9135007871283133
Energy: 0.9091550486662962
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Energy: 0.9355347534274588
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Energy: 0.9212131802593214
Energy: 1.0269973626489142
Energy: 0.9212131802587465
Energy: 1.0269973626494888
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Energy: 1.0269973626494888
Energy: 0.9630729476265476
Energy: 1.101847554155869
Energy: 1.0551733979864406
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Energy: 0.9630729476265476
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Energy: 0.9626317400317245
Energy: 0.9302457854149753
Energy: 0.9626317400311494
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Energy: 0.9626317400311494
Energy: 0.9302457854138253
Energy: 0.9680490542034915
Energy: 0.9099430618707471
Energy: 0.9680490542040664
Energy: 0.9099430618707471
Energy: 0.9680490542034915
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Energy: 0.9165420902483618
Energy: 1.0369767816843463
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Energy: 0.9718037315884072
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Energy: 1.1318982556306967
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Energy: 0.9425606717907083
Energy: 0.9515018369224502
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Energy: 0.9425606717907083
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Energy: 0.9154411897729626
Energy: 1.0522540022295686
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Energy: 1.0522540022295686
Energy: 0.9172984916851253
Energy: 1.138149928019133
Energy: 0.9172984916857002
Energy: 1.1381499280197083
Energy: 0.9172984916851253
Energy: 1.1381499280197083
Energy: 1.0871987307911177
Energy: 0.9644969470994597
Energy: 1.0871987307911177
Energy: 0.9644969470994597
Energy: 1.0871987307911177
Energy: 0.9644969470994597
Energy: 0.949344823927346
Energy: 0.929173125236446
Energy: 0.949344823927346
Energy: 0.929173125236446
Energy: 0.949344823927346
Energy: 0.929173125236446
Energy: 1.0157770226560077
Energy: 0.867864930609147
Energy: 1.0157770226554328
Energy: 0.867864930609722
Energy: 1.0157770226554328
Energy: 0.867864930609147
Energy: 1.1891623877737016
Energy: 0.9324549543899114
Energy: 1.1891623877737016
Energy: 0.9324549543899114
Energy: 1.1891623877737016
Energy: 0.9324549543899114
Energy: 1.195283661377306
Energy: 0.9301030959277515
Energy: 1.195283661377881
Energy: 0.9301030959283264
Energy: 1.195283661377881
Energy: 0.9301030959277515
Energy: 1.0157315935068123
Energy: 0.9465576142336363
Energy: 1.0157315935073872
Energy: 0.9465576142336363
Energy: 1.0157315935068123
Energy: 0.9465576142336363
Energy: 0.9523290264248588
Energy: 0.9372776662444893
Energy: 0.9523290264248588
Energy: 0.9372776662444893
Energy: 0.9523290264254338
Energy: 0.9372776662444893
Energy: 1.0564047229921052
Energy: 0.8932001349549047
Energy: 1.0564047229921052
Energy: 0.8932001349554797
Energy: 1.0564047229915303
Energy: 0.8932001349554797
Energy: 0.941182982737896
Energy: 1.0046673242441964
Energy: 0.9411829827373211
Energy: 1.0046673242441964
Energy: 0.9411829827373211
Energy: 1.0046673242441964
Energy: 0.9516664876902576
Energy: 1.05414651167474
Energy: 0.9516664876902576
Energy: 1.05414651167474
Energy: 0.9516664876902576
Energy: 1.05414651167474
Energy: 0.9897483130917281
Energy: 0.914212109617499
Energy: 0.9897483130917281
Energy: 0.914212109617499
Energy: 0.9897483130917281
Energy: 0.9142121096169241
Energy: 1.0990717060643624
Energy: 0.9732724327614477
Energy: 1.0990717060643624
Energy: 0.9732724327608728
Energy: 1.0990717060643624
Energy: 0.9732724327608728
Energy: 0.9183615867696531
Energy: 1.0115861455803228
Energy: 0.918361586770228
Energy: 1.0115861455803228
Energy: 0.918361586770228
Energy: 1.0115861455803228
Energy: 0.9995443306582302
Energy: 0.9142129589051569
Energy: 0.9995443306582302
Energy: 0.9142129589057317
Energy: 0.9995443306576554
Energy: 0.9142129589051569
Energy: 0.989607629382137
Energy: 0.9094063890002958
Energy: 0.989607629382137
Energy: 0.9094063890008708
Energy: 0.9896076293815619
Energy: 0.9094063890008708
Energy: 1.101403249103867
Energy: 1.099969056452045
Energy: 1.1014032491032923
Energy: 1.099969056452045
Energy: 1.101403249103867
Energy: 1.099969056452045
Energy: 0.9221310007056404
Energy: 1.0164915767883038
Energy: 0.9221310007056404
Energy: 1.016491576788879
Energy: 0.9221310007056404
Energy: 1.0164915767883038

minimum gb energy = 0.8434132819568493 eV
minimum distance =  2.31081918814462 Angstroms
sigma value = 57


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

Energy: 1.046094268554235
Energy: 0.7896985372670533
Energy: 1.046094268554235
Energy: 0.7896985372670533
Energy: 1.046094268554235
Energy: 0.7896985372670533
Energy: 0.8423851092761021
Energy: 0.8333083305824815
Energy: 0.8423851092761021
Energy: 0.8333083305817371
Energy: 0.8423851092753577
Energy: 0.8333083305824815
Energy: 0.9085112255115078
Energy: 0.944106433857879
Energy: 0.908511225512252
Energy: 0.9441064338586233
Energy: 0.908511225512252
Energy: 0.944106433857879
Energy: 1.1538556879617674
Energy: 0.9452461237848357
Energy: 1.1538556879617674
Energy: 0.9452461237855799
Energy: 1.1538556879617674
Energy: 0.9452461237848357
Energy: 1.0615783255012192
Energy: 0.9453330872371957
Energy: 1.0615783255019637
Energy: 0.9453330872357069
Energy: 1.0615783255012192
Energy: 0.9453330872364513
Energy: 0.9484961111023162
Energy: 0.9285246115894598
Energy: 0.9484961111023162
Energy: 0.8425832891003068
Energy: 0.9484961111023162
Energy: 0.9285246115894598
Energy: 1.0069454350709752
Energy: 1.026022830246009
Energy: 1.0069454350709752
Energy: 1.026022830246009
Energy: 1.0069454350717197
Energy: 1.026022830246009
Energy: 0.9757936260821192
Energy: 0.7901503365381891
Energy: 0.9757936260821192
Energy: 0.7901503365381891
Energy: 0.9757936260828636
Energy: 0.7901503365381891
Energy: 0.9606169577995558
Energy: 0.8284800351149317
Energy: 0.9606169578003001
Energy: 0.8284800351149317
Energy: 0.9606169578003001
Energy: 0.8284800351149317
Energy: 0.73525742695239
Energy: 0.8447490099821485
Energy: 0.73525742695239
Energy: 0.8447490099821485
Energy: 0.7352574269516456
Energy: 0.8447490099821485
Energy: 0.8670727025160334
Energy: 0.87392273115707
Energy: 0.867072702515289
Energy: 0.87392273115707
Energy: 0.8670727025160334
Energy: 0.8739227311563257
Energy: 0.9838642669873237
Energy: 0.992147267936371
Energy: 0.9838642669873237
Energy: 0.992147267936371
Energy: 0.9838642669880681
Energy: 0.992147267936371
Energy: 0.8830177987761226
Energy: 0.8282510224019972
Energy: 0.8830177987761226
Energy: 0.828251022403486
Energy: 0.8830177987761226
Energy: 0.828251022403486
Energy: 0.9149390718177459
Energy: 0.8555843139590725
Energy: 0.9149390718177459
Energy: 0.8555843139590725
Energy: 0.9149390718177459
Energy: 0.8555843139590725
Energy: 1.011701295819018
Energy: 0.8286268779933542
Energy: 1.0117012958197622
Energy: 0.8286268779926098
Energy: 1.0117012958197622
Energy: 0.8286268779926098
Energy: 1.0492541518307956
Energy: 0.8173511830256113
Energy: 1.0492541518307956
Energy: 0.8173511830256113
Energy: 1.049254151830051
Energy: 0.8173511830248669
Energy: 0.7362396926659392
Energy: 0.8429510075930013
Energy: 0.7362396926666837
Energy: 0.8429510075922569
Energy: 0.7362396926666837
Energy: 0.8429510075930013
Energy: 0.8714013282597807
Energy: 0.8719836212037022
Energy: 0.8714013282597807
Energy: 0.8719836212037022
Energy: 0.8714013282597807
Energy: 0.8719836212037022
Energy: 0.7362824869133646
Energy: 0.8425654716891229
Energy: 0.7362824869133646
Energy: 0.8425654716898674
Energy: 0.7362824869133646
Energy: 0.8425654716891229
Energy: 1.0490796411940417
Energy: 0.8175536004002717
Energy: 1.0490796411940417
Energy: 0.8175536004002717
Energy: 1.0490796411940417
Energy: 0.8175536003995274
Energy: 1.0113892083980425
Energy: 0.8284899520408769
Energy: 1.0113892083950646
Energy: 0.8284899520416213
Energy: 1.0113892083958091
Energy: 0.8284899520408769
Energy: 0.9150075442504189
Energy: 0.896123743400143
Energy: 0.9150075442504189
Energy: 0.8961237433993987
Energy: 0.9150075442496745
Energy: 0.896123743400143
Energy: 0.882919241582868
Energy: 0.8280736676335505
Energy: 0.8829192415821236
Energy: 0.8280736676320616
Energy: 0.8829192415821236
Energy: 0.8280736676335505
Energy: 0.9838159040376947
Energy: 0.9919610174564049
Energy: 0.9838159040376947
Energy: 0.9919610174564049
Energy: 0.9838159040376947
Energy: 0.9919610174564049

minimum gb energy = 0.7352574269516456 eV
minimum distance =  2.33595143002563 Angstroms
sigma value = 17


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

Energy: 1.0540250385720644
Energy: 0.7513347120311074
Energy: 1.0540250385720644
Energy: 0.7513347120300548
Energy: 1.0540250385720644
Energy: 0.7513347120311074
Energy: 0.8468790565826082
Energy: 0.9110985207864667
Energy: 0.8468790565826082
Energy: 0.9110985207864667
Energy: 0.8468790565826082
Energy: 0.9110985207864667
Energy: 0.867203817398577
Energy: 0.8532422813474485
Energy: 0.867203817398577
Energy: 0.8532422813474485
Energy: 0.867203817398577
Energy: 0.8532422813474485
Energy: 0.9838281989104918
Energy: 1.0152682449480281
Energy: 0.9838281989104918
Energy: 1.0152682449480281
Energy: 0.9838281989104918
Energy: 1.0152682449480281
Energy: 0.9403872134442294
Energy: 0.9577540684104773
Energy: 0.9403872134442294
Energy: 0.9577540684104773
Energy: 0.9403872134442294
Energy: 0.9577540684104773
Energy: 0.9778251426168681
Energy: 0.8173264406213999
Energy: 0.9778251426168681
Energy: 0.8173264406203473
Energy: 0.9778251426168681
Energy: 0.8173264406213999
Energy: 0.9137684688631994
Energy: 0.7370292881121802
Energy: 0.9137684688631994
Energy: 0.737029288113233
Energy: 0.9137684688631994
Energy: 0.737029288113233
Energy: 0.9548676275002894
Energy: 0.937690113971991
Energy: 0.9548676275002894
Energy: 0.937690113971991
Energy: 0.9548676275002894
Energy: 0.937690113971991
Energy: 0.8070904532652718
Energy: 0.9838124406792856
Energy: 0.8070904532652718
Energy: 0.9838124406792856
Energy: 0.8070904532652718
Energy: 0.9838124406792856
Energy: 0.8955687346082046
Energy: 0.904978163486155
Energy: 0.8955687346082046
Energy: 0.904978163486155
Energy: 0.8955687346082046
Energy: 0.904978163486155
Energy: 0.9000575061705294
Energy: 0.832575870621467
Energy: 0.9000575061705294
Energy: 0.8325758706204143
Energy: 0.9000575061715821
Energy: 0.832575870621467
Energy: 0.9235328038755145
Energy: 0.9975084228365018
Energy: 0.9235328038755145
Energy: 0.9975084228375546
Energy: 0.9235328038755145
Energy: 0.9975084228375546
Energy: 0.6829348030358551
Energy: 0.9377030278364717
Energy: 0.6829348030358551
Energy: 0.9377030278364717
Energy: 0.6829348030358551
Energy: 0.9377030278364717
Energy: 0.7724885737703147
Energy: 0.8274072532050751
Energy: 0.7724885737703147
Energy: 0.8274072532050751
Energy: 0.7724885737703147
Energy: 0.8274072532050751
Energy: 0.7905118929495907
Energy: 0.943603636222271
Energy: 0.7905118929495907
Energy: 0.943603636222271
Energy: 0.7905118929495907
Energy: 0.943603636222271
Energy: 0.7883433194196291
Energy: 0.9538447966181042
Energy: 0.7883433194196291
Energy: 0.9538447966181042
Energy: 0.7883433194196291
Energy: 0.9538447966181042
Energy: 0.7710311186868631
Energy: 0.827152180610748
Energy: 0.7710311186879159
Energy: 0.827152180610748
Energy: 0.7710311186879159
Energy: 0.827152180610748

minimum gb energy = 0.6829348030358551 eV
minimum distance =  2.37774303237448 Angstroms
sigma value = 17


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

Energy: 1.03532570628364
Energy: 0.6742912374567067
Energy: 1.03532570628364
Energy: 0.6742912374554871
Energy: 1.0353257062840464
Energy: 0.6742912374575197
Energy: 0.8140806319197679
Energy: 0.8047391527951046
Energy: 0.8140806319201744
Energy: 0.804739152795511
Energy: 0.8140806319201744
Energy: 0.8047391527951046
Energy: 0.7627915520505617
Energy: 0.8023402179840794
Energy: 0.7627915520509683
Energy: 0.8023402179840794
Energy: 0.7627915520505617
Energy: 0.8023402179840794
Energy: 0.9277294346509043
Energy: 0.7413963181200345
Energy: 0.9277294346513109
Energy: 0.7413963181200345
Energy: 0.9277294346513109
Energy: 0.7413963181196278
Energy: 0.9816736187604332
Energy: 0.7811439163332128
Energy: 0.9816736187604332
Energy: 0.7811439163336193
Energy: 0.9816736187604332
Energy: 0.7811439163332128
Energy: 0.7346836756907855
Energy: 0.810728509823809
Energy: 0.7346836756911921
Energy: 0.810728509823809
Energy: 0.7346836756907855
Energy: 0.810728509823809
Energy: 0.8351784557826895
Energy: 0.7539509723940582
Energy: 0.8351784557822829
Energy: 0.7539509723940582
Energy: 0.8351784557826895
Energy: 0.7539509723948712
Energy: 0.8740191241448827
Energy: 0.8570949410512282
Energy: 0.8740191241444761
Energy: 0.8570949410508216
Energy: 0.8740191241440696
Energy: 0.8570949410508216
Energy: 0.8460014230234577
Energy: 0.8269975149641047
Energy: 0.8460014230234577
Energy: 0.8269975149636983
Energy: 0.8460014230230511
Energy: 0.8269975149636983
Energy: 0.7977421630801306
Energy: 0.6751133772358133
Energy: 0.7977421630801306
Energy: 0.6751133772358133
Energy: 0.7977421630801306
Energy: 0.6751133772358133
Energy: 0.8989819046798803
Energy: 0.8368958467224179
Energy: 0.8989819046798803
Energy: 0.8368958467220113
Energy: 0.8989819046802868
Energy: 0.8368958467224179
Energy: 0.7678050241113574
Energy: 0.9578811003540234
Energy: 0.767805024110951
Energy: 0.9578811003540234
Energy: 0.7678050241105445
Energy: 0.9578811003540234
Energy: 0.8341276338942046
Energy: 0.8023017454125748
Energy: 0.8341276338942046
Energy: 0.802301745413388
Energy: 0.8341276338942046
Energy: 0.8023017454125748
Energy: 0.9192620563584387
Energy: 0.7785294691929286
Energy: 0.9192620563580322
Energy: 0.7785294691929286
Energy: 0.9192620563580322
Energy: 0.7785294691929286
Energy: 0.8368247922447896
Energy: 0.9509530375987402
Energy: 0.8368247922439763
Energy: 0.9509530375987402
Energy: 0.8368247922447896
Energy: 0.9509530375991467
Energy: 0.7002112521886895
Energy: 0.8231399929137574
Energy: 0.7002112521882831
Energy: 0.8231399929133508
Energy: 0.7002112521890961
Energy: 0.8231399929133508
Energy: 0.7027101521471871
Energy: 0.7270897645004903
Energy: 0.702710152146374
Energy: 0.7270897645000838
Energy: 0.7027101521467806
Energy: 0.7270897645000838
Energy: 0.8830695620569486
Energy: 0.9008869022594611
Energy: 0.8830695620545095
Energy: 0.9008869022598677
Energy: 0.883069562054916
Energy: 0.9008869022598677
Energy: 0.7683202790011702
Energy: 0.8197145793695745
Energy: 0.7683202790011702
Energy: 0.8197145793703876
Energy: 0.7683202790007636
Energy: 0.819714579369981
Energy: 0.7016094232246717
Energy: 0.7652541570705267
Energy: 0.7016094232238587
Energy: 0.7652541570709332
Energy: 0.7016094232246717
Energy: 0.7652541570709332
Energy: 0.7682263432723595
Energy: 0.8199468798872236
Energy: 0.7682263432739856
Energy: 0.8199468798872236
Energy: 0.7682263432727661
Energy: 0.8199468798872236
Energy: 0.8829701633460078
Energy: 0.9007514398912898
Energy: 0.8829701633460078
Energy: 0.9007514398908834
Energy: 0.8829701633460078
Energy: 0.9007514398908834
Energy: 0.7027414300784602
Energy: 0.7269319235553113
Energy: 0.7027414300784602
Energy: 0.7269319235553113
Energy: 0.7027414300772407
Energy: 0.7269319235553113
Energy: 0.7001600467332597
Energy: 0.9055612945625945
Energy: 0.7001600467316336
Energy: 0.9055612945634077
Energy: 0.7001600467259422
Energy: 0.9055612945634077
Energy: 0.8361284752884623
Energy: 0.9509640045058187
Energy: 0.8361284752880559
Energy: 0.9509640045058187
Energy: 0.8361284752884623
Energy: 0.9509640045058187
Energy: 0.9193911294759185
Energy: 0.7783857559891626
Energy: 0.9193911294763251
Energy: 0.7783857559891626
Energy: 0.9193911294759185
Energy: 0.7783857559891626
Energy: 0.8339735903836897
Energy: 0.8025272926668368
Energy: 0.8339735903836897
Energy: 0.8025272926668368
Energy: 0.8339735903836897
Energy: 0.8025272926668368
Energy: 0.7679066636902074
Energy: 0.9582181733283033
Energy: 0.7679066636898009
Energy: 0.9582181733278967
Energy: 0.7679066636898009
Energy: 0.9582181733287096
Energy: 0.8991982575685553
Energy: 0.8368669598145281
Energy: 0.8991982575693683
Energy: 0.8368669598141216
Energy: 0.8991982575701813
Energy: 0.8368669598133085
Energy: 0.7976241599453389
Energy: 0.6750539899278692
Energy: 0.7976241599453389
Energy: 0.6750539899278692
Energy: 0.7976241599457454
Energy: 0.6750539899278692
Energy: 0.8461259605098529
Energy: 0.8269394230850764
Energy: 0.8461259605098529
Energy: 0.826939423085483
Energy: 0.8461259605098529
Energy: 0.826939423085483
Energy: 0.8740149997831635
Energy: 0.8570450611313426
Energy: 0.874014999782757
Energy: 0.8570450611313426
Energy: 0.874014999782757
Energy: 0.857045061130936
Energy: 0.8355893310929443
Energy: 0.7540164699182722
Energy: 0.8355893310925377
Energy: 0.7540164699186788
Energy: 0.8355893310929443
Energy: 0.7540164699182722
Energy: 0.7344605604900559
Energy: 0.7692580126696187
Energy: 0.7344605604900559
Energy: 0.7692580126696187
Energy: 0.7344605604900559
Energy: 0.7692580126696187
Energy: 0.9817573186787969
Energy: 0.7810852229281219
Energy: 0.9817573186787969
Energy: 0.7810852229277154
Energy: 0.9817573186787969
Energy: 0.7810852229285286
Energy: 0.9277104428608939
Energy: 0.8768805911911525
Energy: 0.9277104428608939
Energy: 0.8768805911911525
Energy: 0.9277104428613004
Energy: 0.8768805911911525
Energy: 0.7627211202748142
Energy: 0.8024824418475085
Energy: 0.7627211202752208
Energy: 0.8024824418471019
Energy: 0.7627211202744076
Energy: 0.8024824418475085
Energy: 0.8141350700854217
Energy: 0.7848497044026524
Energy: 0.8141350700854217
Energy: 0.784849704402246
Energy: 0.8141350700858282
Energy: 0.7848497044018394
Energy: 1.0353257062824202
Energy: 0.6742912374587393
Energy: 1.0353257062824202
Energy: 0.6742912374591459
Energy: 1.035325706282827
Energy: 0.6742912374579263
Energy: 0.8140806319201744
Energy: 0.8234552547588287
Energy: 0.8140806319197679
Energy: 0.8234552547588287
Energy: 0.8140806319201744
Energy: 0.8234552547588287
Energy: 0.7627915520509683
Energy: 0.8023402179840794
Energy: 0.7627915520509683
Energy: 0.8023402179840794
Energy: 0.7627915520509683
Energy: 0.8023402179840794
Energy: 0.9277294346509043
Energy: 0.7351507859729838
Energy: 0.9277294346509043
Energy: 0.7351507859729838
Energy: 0.9277294346504977
Energy: 0.7351507859725773
Energy: 0.9816736187588071
Energy: 0.7811439163323998
Energy: 0.9816736187588071
Energy: 0.7811439163315866
Energy: 0.9816736187588071
Energy: 0.7811439163319932

minimum gb energy = 0.6742912374554871 eV
minimum distance =  2.29469465376923 Angstroms
sigma value = 57


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

Energy: 0.9854187426220399
Energy: 0.6236354230556257
Energy: 0.9854187426220399
Energy: 0.6236354230556257
Energy: 0.9854187426227018
Energy: 0.6236354230556257
Energy: 0.7333756320697769
Energy: 0.7280334860482613
Energy: 0.7333756320677911
Energy: 0.7280334860482613
Energy: 0.7333756320691149
Energy: 0.7280334860482613
Energy: 0.7336166816558283
Energy: 0.7396865759722707
Energy: 0.7336166816558283
Energy: 0.7396865759716088
Energy: 0.7336166816551664
Energy: 0.7396865759722707
Energy: 0.8936234612997805
Energy: 0.6997419750394053
Energy: 0.8936234613004425
Energy: 0.6997419750394053
Energy: 0.8936234613004425
Energy: 0.6997419750400672
Energy: 0.8930113064086286
Energy: 0.7064081197142842
Energy: 0.8930113064086286
Energy: 0.7064081197149461
Energy: 0.8930113064086286
Energy: 0.7064081197162699
Energy: 0.6888007508204609
Energy: 0.7110555496728732
Energy: 0.688800750819799
Energy: 0.7110555496728732
Energy: 0.6888007508204609
Energy: 0.7110555496722113
Energy: 0.874620466837455
Energy: 0.780759806802535
Energy: 0.8746204668381168
Energy: 0.7807598068018731
Energy: 0.8746204668367928
Energy: 0.7807598068018731
Energy: 0.795716214561223
Energy: 0.8053384651039516
Energy: 0.7957162145618851
Energy: 0.8053384651065995
Energy: 0.7957162145618851
Energy: 0.8053384651065995
Energy: 0.7491393451211221
Energy: 0.7100033820194115
Energy: 0.7491393451211221
Energy: 0.7100033820207353
Energy: 0.7491393451204602
Energy: 0.7100033820200734
Energy: 0.7248746814889178
Energy: 0.6898791625536191
Energy: 0.7248746814882558
Energy: 0.6898791625529572
Energy: 0.7248746814889178
Energy: 0.6898791625536191
Energy: 0.8441030235003358
Energy: 0.8045704992112765
Energy: 0.8441030235009978
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Energy: 0.8441030235003358
Energy: 0.8045704992112765
Energy: 0.6632260112832091
Energy: 0.8226227265406347
Energy: 0.6632260112825472
Energy: 0.8226227265399729
Energy: 0.6632260112832091
Energy: 0.8226227265412968
Energy: 0.7250295879819754
Energy: 0.7314228524390977
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Energy: 0.7250295879819754
Energy: 0.7314228524390977
Energy: 0.8507544400266895
Energy: 0.7569290270867565
Energy: 0.8507544400273515
Energy: 0.7569290270874185
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Energy: 0.7569290270874185
Energy: 0.7107642158861146
Energy: 0.9176534320097329
Energy: 0.7107642158861146
Energy: 0.917653432009071
Energy: 0.7107642158867764
Energy: 0.9176534320084091
Energy: 0.7557927477053058
Energy: 0.7354251924362907
Energy: 0.7557927477053058
Energy: 0.7354251924349668
Energy: 0.7557927477053058
Energy: 0.7354251924369526
Energy: 0.8447889177996581
Energy: 0.722958974581151
Energy: 0.8447889177989962
Energy: 0.7229589745804891
Energy: 0.8447889177996581
Energy: 0.722958974579827
Energy: 0.7432166516471608
Energy: 0.9154130010649021
Energy: 0.7432166516471608
Energy: 0.9154130010649021
Energy: 0.7432166516471608
Energy: 0.9154130010642403
Energy: 0.7239070573083577
Energy: 0.7795605590499639
Energy: 0.7239070573083577
Energy: 0.7795605590499639
Energy: 0.7239070573076958
Energy: 0.7795605590499639
Energy: 0.8353277884206038
Energy: 0.6901377429520155
Energy: 0.8353277884206038
Energy: 0.6901377429520155
Energy: 0.8353277884206038
Energy: 0.6901377429520155
Energy: 0.7793585476490128
Energy: 0.8435024834069466
Energy: 0.779358547648351
Energy: 0.8435024834076085
Energy: 0.779358547648351
Energy: 0.8435024834069466
Energy: 0.645395535958112
Energy: 0.7790522119312804
Energy: 0.6453955359587741
Energy: 0.7790522119312804
Energy: 0.6453955359620837
Energy: 0.7790522119306184
Energy: 0.6479107665539062
Energy: 0.6602463705553151
Energy: 0.6479107665532443
Energy: 0.6602463705553151
Energy: 0.6479107665545681
Energy: 0.6602463705553151
Energy: 0.7116770263013864
Energy: 0.7822374680867322
Energy: 0.7116770263013864
Energy: 0.7822374680873941
Energy: 0.7116770263013864
Energy: 0.7822374680867322
Energy: 0.7284813063051678
Energy: 0.8239192422726491
Energy: 0.7284813063058297
Energy: 0.8239192422726491
Energy: 0.7284813063045059
Energy: 0.8239192422726491
Energy: 0.7271869269416383
Energy: 0.6601809519798982
Energy: 0.7271869269416383
Energy: 0.6601809519798982
Energy: 0.7271869269423002
Energy: 0.6601809519798982
Energy: 0.6424789647292085
Energy: 0.7828503792771474
Energy: 0.6424789647285465
Energy: 0.7828503792771474
Energy: 0.6424789647292085
Energy: 0.7828503792778094

minimum gb energy = 0.6236354230556257 eV
minimum distance =  2.33381973751787 Angstroms
sigma value = 43


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

Energy: 0.9215065517020476
Energy: 0.5606718405398432
Energy: 0.9215065517015654
Energy: 0.5606718405398432
Energy: 0.9215065517020476
Energy: 0.5606718405398432
Energy: 0.6428389212864916
Energy: 0.6612834021052699
Energy: 0.6428389212864916
Energy: 0.6612834021047876
Energy: 0.6428389212864916
Energy: 0.6612834021057522
Energy: 0.636787236978605
Energy: 0.6631351413819484
Energy: 0.6367872369790871
Energy: 0.6631351413819484
Energy: 0.6367872369790871
Energy: 0.6631351413824306
Energy: 0.8457763820425847
Energy: 0.5960890306427784
Energy: 0.8457763820421024
Energy: 0.5960890306427784
Energy: 0.8457763820421024
Energy: 0.5960890306427784
Energy: 0.7489890120905598
Energy: 0.7004596891614365
Energy: 0.7489890120900775
Energy: 0.7004596891614365
Energy: 0.7489890120900775
Energy: 0.7004596891614365
Energy: 0.5953830780790308
Energy: 0.6237373055360786
Energy: 0.5953830780799955
Energy: 0.6237373055365609
Energy: 0.5953830780790308
Energy: 0.6237373055365609
Energy: 0.7855146147430797
Energy: 0.6548745384830488
Energy: 0.7855146147430797
Energy: 0.6548745384830488
Energy: 0.7855146147425975
Energy: 0.6548745384830488
Energy: 0.775148163668904
Energy: 0.6869269400063903
Energy: 0.775148163668904
Energy: 0.6869269400063903
Energy: 0.775148163668904
Energy: 0.6869269400063903
Energy: 0.5669035464312292
Energy: 0.6156225251540267
Energy: 0.5669035464312292
Energy: 0.6156225251540267
Energy: 0.5669035464312292
Energy: 0.6156225251540267
Energy: 0.6269258024073614
Energy: 0.632981076148556
Energy: 0.6269258024088084
Energy: 0.6329810761490383
Energy: 0.6269258024083261
Energy: 0.632981076148556
Energy: 0.6952687574553698
Energy: 0.7115993677568758
Energy: 0.6952687574553698
Energy: 0.7115993677568758
Energy: 0.6952687574548875
Energy: 0.7115993677568758
Energy: 0.5354202081902107
Energy: 0.614632985030282
Energy: 0.5354202081897285
Energy: 0.6146329850307642
Energy: 0.5354202081902107
Energy: 0.6146329850297997
Energy: 0.6266224948161648
Energy: 0.5659863062231316
Energy: 0.626622494816647
Energy: 0.5659863062231316
Energy: 0.626622494816647
Energy: 0.5659863062226492
Energy: 0.709857780093758
Energy: 0.7084735762711206
Energy: 0.7098577800932757
Energy: 0.7084735762711206
Energy: 0.7098577800942403
Energy: 0.7084735762711206
Energy: 0.6317408037752767
Energy: 0.6147962105118875
Energy: 0.6317408037747946
Energy: 0.6147962105138165
Energy: 0.6317408037747946
Energy: 0.6147962105200864
Energy: 0.6427819497686822
Energy: 0.5975919032375223
Energy: 0.6427819497691645
Energy: 0.5975919032375223
Energy: 0.6427819497691645
Energy: 0.5975919032375223
Energy: 0.739936583435602
Energy: 0.7043781118408035
Energy: 0.7399365834351197
Energy: 0.7043781118403211
Energy: 0.739936583435602
Energy: 0.7043781118408035
Energy: 0.5689692283114115
Energy: 0.7588610379856564
Energy: 0.5689692283114115
Energy: 0.7588610379856564
Energy: 0.5689692283114115
Energy: 0.7588610379856564
Energy: 0.6217914869257681
Energy: 0.6343486789967826
Energy: 0.6217914869257681
Energy: 0.6343486789972649
Energy: 0.6217914869257681
Energy: 0.6343486789967826
Energy: 0.7277712447380544
Energy: 0.7631415302841826
Energy: 0.7277712447380544
Energy: 0.7631415302846649
Energy: 0.7277712447380544
Energy: 0.7631415302846649
Energy: 0.6077537841450674
Energy: 0.8943973008607605
Energy: 0.6077537841445851
Energy: 0.894397300859796
Energy: 0.6077537841450674
Energy: 0.8943973008607605
Energy: 0.6686768831971939
Energy: 0.6447181950668369
Energy: 0.6686768831971939
Energy: 0.6447181950668369
Energy: 0.6686768831976763
Energy: 0.6447181950668369
Energy: 0.7329000254075899
Energy: 0.6243180578078626
Energy: 0.7329000254075899
Energy: 0.6243180578083449
Energy: 0.7329000254075899
Energy: 0.6243180578083449
Energy: 0.6391207958832086
Energy: 0.8930590672479237
Energy: 0.6391207958832086
Energy: 0.8930590672479237
Energy: 0.6391207958832086
Energy: 0.8930590672479237
Energy: 0.6330592103423355
Energy: 0.6494344155226562
Energy: 0.6330592103418532
Energy: 0.649434415522174
Energy: 0.6330592103423355
Energy: 0.6494344155216917
Energy: 0.7001274139428338
Energy: 0.6019610250855617
Energy: 0.7001274139428338
Energy: 0.6019610250855617
Energy: 0.7001274139428338
Energy: 0.6019610250855617
Energy: 0.5858732662237045
Energy: 0.8285431703821734
Energy: 0.5858732662237045
Energy: 0.8285431703821734
Energy: 0.5858732662237045
Energy: 0.8285431703826557
Energy: 0.5929782046791523
Energy: 0.6313694858910235
Energy: 0.5929782046786701
Energy: 0.6313694858910235
Energy: 0.5929782046786701
Energy: 0.6313694858910235
Energy: 0.611090552256063
Energy: 0.5649750001541551
Energy: 0.611090552256063
Energy: 0.5649750001541551
Energy: 0.611090552256063
Energy: 0.5649750001536729
Energy: 0.6286882377579047
Energy: 0.7689687983461472
Energy: 0.6286882377579047
Energy: 0.7689687983461472
Energy: 0.6286882377579047
Energy: 0.7689687983461472
Energy: 0.6090746853654762
Energy: 0.8040479510903095
Energy: 0.6090746853654762
Energy: 0.8040479510903095
Energy: 0.6090746853654762
Energy: 0.8040479510903095
Energy: 0.6111767241145108
Energy: 0.5456373267721142
Energy: 0.6111767241140286
Energy: 0.5456373267716319
Energy: 0.6111767241140286
Energy: 0.5456373267716319
Energy: 0.5662708238334907
Energy: 0.6543351893208378
Energy: 0.5662708238325261
Energy: 0.6543351893218023
Energy: 0.566270823833973
Energy: 0.6543351893218023
Energy: 0.6752190095873936
Energy: 0.7820554367309904
Energy: 0.6752190095873936
Energy: 0.7820554367305081
Energy: 0.6752190095873936
Energy: 0.7820554367305081
Energy: 0.6218529925036909
Energy: 0.6083804687553015
Energy: 0.6218529925041731
Energy: 0.6083804687553015
Energy: 0.6218529925036909
Energy: 0.6083804687553015
Energy: 0.5543706672589233
Energy: 0.6075017568924749
Energy: 0.5543706672589233
Energy: 0.607501756892957
Energy: 0.5543706672589233
Energy: 0.6075017568924749

minimum gb energy = 0.5354202081897285 eV
minimum distance =  2.3434034618839 Angstroms
sigma value = 81


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

Energy: 0.2299800892934882
Energy: 0.2616728208898285
Energy: 0.03542633202900236
Energy: 0.2616728208898285
Energy: 0.2299800892934882
Energy: 0.2616728208898285
Energy: 0.627666103144532
Energy: 0.036494383941875375
Energy: 0.627666103144532
Energy: 0.0364943847229995
Energy: 0.627666103144532
Energy: 0.03649438428905284
Energy: 0.6471373425444042
Energy: 0.035852203395172054
Energy: 0.6471373425444042
Energy: 0.035852203395172054
Energy: 0.6471373425444042
Energy: 0.03585220339694409
Energy: 0.03542633202900236
Energy: 0.2616728208898285
Energy: 0.03542633202900236
Energy: 0.2616728208898285
Energy: 0.03542633202900236
Energy: 0.2616728208898285
Energy: 0.627666103144532
Energy: 0.036494308637370305
Energy: 0.627666103144532
Energy: 0.03649430991973805
Energy: 0.627666103144532
Energy: 0.03649430723984057
Energy: 0.6471373425444042
Energy: 0.035852203395172054
Energy: 0.6471373425444042
Energy: 0.035852203395172054
Energy: 0.6471373425444042
Energy: 0.035852203395172054
Energy: 0.2299800892934882
Energy: 0.2616728208898285
Energy: 0.03542633202900236
Energy: 0.2616728208898285
Energy: 0.2299800892934882
Energy: 0.2616728208898285
Energy: 0.627666103144532
Energy: 0.03649423588874056
Energy: 0.627666103144532
Energy: 0.03649423692491657
Energy: 0.627666103144532
Energy: 0.03649423606409125
Energy: 0.6471373425444042
Energy: 0.035852203395172054
Energy: 0.6471373425444042
Energy: 0.035852203395172054
Energy: 0.6471373425444042
Energy: 0.035852203395172054
Energy: 0.03542633202900236
Energy: 0.2616728208898285
Energy: 0.03542633202900236
Energy: 0.2616728208898285
Energy: 0.03542633202900236
Energy: 0.2616728208898285

minimum gb energy = 0.03542633202900236 eV
minimum distance =  2.51060137657156 Angstroms
sigma value = 3


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

Energy: 0.8709578301746905
Energy: 0.5448498357408953
Energy: 0.87095783017363
Energy: 0.5448498357408953
Energy: 0.8709578301741603
Energy: 0.5448498357408953
Energy: 0.5736303428492574
Energy: 0.6384587345534113
Energy: 0.5736303428492574
Energy: 0.6384587345534113
Energy: 0.5736303428492574
Energy: 0.6384587345534113
Energy: 0.638894309602225
Energy: 0.6431781994136021
Energy: 0.6388943096027553
Energy: 0.6431781994136021
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Energy: 0.6431781994136021
Energy: 0.7862369503776518
Energy: 0.5773894535359135
Energy: 0.7862369503781822
Energy: 0.5773894535359135
Energy: 0.7862369503776518
Energy: 0.5773894535359135
Energy: 0.6180373718365587
Energy: 0.6999426591291177
Energy: 0.6180373718365587
Energy: 0.6999426591285872
Energy: 0.6180373718365587
Energy: 0.6999426591285872
Energy: 0.5586541078384702
Energy: 0.620444846072029
Energy: 0.5586541078390007
Energy: 0.620444846072029
Energy: 0.5586541078384702
Energy: 0.6204448460725593
Energy: 0.7213522317212614
Energy: 0.6316199007533799
Energy: 0.7213522317212614
Energy: 0.6316199007528496
Energy: 0.7213522317217917
Energy: 0.6316199007533799
Energy: 0.6225678715332342
Energy: 0.6897901458261552
Energy: 0.6225678715332342
Energy: 0.6897901458261552
Energy: 0.6225678715332342
Energy: 0.6897901458250947
Energy: 0.6030974861184797
Energy: 0.6200317665411578
Energy: 0.6030974861184797
Energy: 0.6200317665411578
Energy: 0.60309748611901
Energy: 0.6200317665406274
Energy: 0.7331358617209452
Energy: 0.6101135983777372
Energy: 0.7331358617209452
Energy: 0.6101135983777372
Energy: 0.7331358617209452
Energy: 0.6101135983777372
Energy: 0.5980923606256084
Energy: 0.6779731750956995
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Energy: 0.6779731750956995
Energy: 0.5980923606256084
Energy: 0.6779731750951693
Energy: 0.6327216075350509
Energy: 0.6452390727078623
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Energy: 0.6452390727078623
Energy: 0.6327216075350509
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Energy: 0.6462437311741749
Energy: 0.6017527327963875
Energy: 0.6462437311731144
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Energy: 0.6462437311736445
Energy: 0.6017527327963875
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Energy: 0.6794234143410143
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Energy: 0.6794234143410143
Energy: 0.6071146846417069
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Energy: 0.6230734036853505
Energy: 0.6222098372177779
Energy: 0.6230734036848203
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Energy: 0.6230734036848203
Energy: 0.6222098372183082
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Energy: 0.6136198576806619
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Energy: 0.7056376072722423
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Energy: 0.6104220885865768
Energy: 0.7353402126914738
Energy: 0.6104220885871071
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Energy: 0.6023171603287233
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Energy: 0.6184417881551281
Energy: 0.8127619117117955
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Energy: 0.8127619117117955
Energy: 0.6184417881551281
Energy: 0.8127619117117955
Energy: 0.6137684137581942
Energy: 0.599466370751748
Energy: 0.6137684137592548
Energy: 0.599466370751748
Energy: 0.6137684137587246
Energy: 0.5994663707522784
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Energy: 0.6273469603402689
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Energy: 0.6802618045844138
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Energy: 0.5940553525844164
Energy: 0.8142489385436321
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Energy: 0.8142489385436321
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Energy: 0.8142489385436321
Energy: 0.6539239927176459
Energy: 0.5865882269821202
Energy: 0.6539239927192367
Energy: 0.5865882269826507
Energy: 0.6539239927181763
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Energy: 0.6318569464350462
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Energy: 0.5686027479186208
Energy: 0.6671208689303053
Energy: 0.5686027479186208
Energy: 0.6671208689303053
Energy: 0.5686027479186208
Energy: 0.6671208689308356
Energy: 0.6519268923090967
Energy: 0.5601276809519191
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Energy: 0.6519268923085665
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Energy: 0.6495461380150956
Energy: 0.6022009044656748
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Energy: 0.5406066205260635
Energy: 0.7642423716599812
Energy: 0.5406066205255331
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Energy: 0.5406066205255331
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Energy: 0.7411141867143698
Energy: 0.6110889852624567
Energy: 0.7411141867138635
Energy: 0.6110889852624567
Energy: 0.7411141867133332
Energy: 0.6110889852624567
Energy: 0.6573887616852185
Energy: 0.6092152364853136
Energy: 0.6573887616852185
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Energy: 0.6573887616857488
Energy: 0.6092152364853136
Energy: 0.6576305904328207
Energy: 0.6269812769997005
Energy: 0.6576305904333509
Energy: 0.6269812770002309
Energy: 0.6576305904333509
Energy: 0.6269812769991703
Energy: 0.6745428825014381
Energy: 0.6108711198102069
Energy: 0.6745428825019685
Energy: 0.6108711198096765
Energy: 0.6745428825014381
Energy: 0.6108711198096765

minimum gb energy = 0.5406066205255331 eV
minimum distance =  2.37140756825356 Angstroms
sigma value = 67


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

Energy: 0.8950985671499072
Energy: 0.7048138469529427
Energy: 0.8950985671506627
Energy: 0.7048138469529427
Energy: 0.8950985671506627
Energy: 0.7048138469529427
Energy: 0.7012416071491203
Energy: 0.7617007499749527
Energy: 0.7012416071491203
Energy: 0.7617007499741972
Energy: 0.7012416071491203
Energy: 0.7617007499749527
Energy: 0.7548730318258771
Energy: 0.7620344512056921
Energy: 0.7548730318258771
Energy: 0.7620344512056921
Energy: 0.7548730318258771
Energy: 0.7620344512056921
Energy: 0.806803913223935
Energy: 0.6911864412129702
Energy: 0.806803913223935
Energy: 0.6911864412129702
Energy: 0.806803913223935
Energy: 0.6911864412129702
Energy: 0.7551827552441052
Energy: 0.7613117934778404
Energy: 0.7551827552441052
Energy: 0.7613117934785961
Energy: 0.7551827552441052
Energy: 0.7613117934778404
Energy: 0.734556452369039
Energy: 0.7482574869972286
Energy: 0.734556452369039
Energy: 0.7482574869972286
Energy: 0.734556452369039
Energy: 0.7482574869972286
Energy: 0.7546345412053909
Energy: 0.7674555772429505
Energy: 0.7546345412038798
Energy: 0.767455577243706
Energy: 0.7546345412053909
Energy: 0.7674555772429505
Energy: 0.7364569475242464
Energy: 0.8645529282045425
Energy: 0.7364569475242464
Energy: 0.8645529282045425
Energy: 0.7364569475234908
Energy: 0.8645529282045425
Energy: 0.7977765920774854
Energy: 0.8114879230739891
Energy: 0.7977765920774854
Energy: 0.8114879230739891
Energy: 0.7977765920774854
Energy: 0.8114879230747449
Energy: 0.740657997661178
Energy: 0.762383353642197
Energy: 0.740657997661178
Energy: 0.7623833536414415
Energy: 0.740657997661178
Energy: 0.7623833536414415
Energy: 0.7453338688700235
Energy: 0.7893538532324617
Energy: 0.7453338688700235
Energy: 0.7893538532324617
Energy: 0.7453338688700235
Energy: 0.7893538532317059
Energy: 0.739045905083328
Energy: 0.7678708118970217
Energy: 0.739045905083328
Energy: 0.7678708118970217
Energy: 0.7390459050825724
Energy: 0.7678708118970217
Energy: 0.7402284931446009
Energy: 0.7085667162882638
Energy: 0.7402284931453565
Energy: 0.7085667162882638
Energy: 0.7402284931453565
Energy: 0.7085667162882638
Energy: 0.7464724992694539
Energy: 0.8654768780656582
Energy: 0.7464724992702094
Energy: 0.8654768780656582
Energy: 0.7464724992694539
Energy: 0.8654768780656582
Energy: 0.7299439781838585
Energy: 0.7287558675585799
Energy: 0.7299439781838585
Energy: 0.7287558675585799
Energy: 0.7299439781838585
Energy: 0.7287558675585799
Energy: 0.718623452272906
Energy: 0.7237244803744255
Energy: 0.7186234522751729
Energy: 0.7237244803736699
Energy: 0.7186234522774397
Energy: 0.7237244803744255
Energy: 0.71222248098838
Energy: 0.8693884816871559
Energy: 0.7122224809876245
Energy: 0.8693884816871559
Energy: 0.71222248098838
Energy: 0.8693884816871559
Energy: 0.762045969402184
Energy: 0.6747888146613449
Energy: 0.762045969402184
Energy: 0.6747888146613449
Energy: 0.7620459694014285
Energy: 0.6747888146613449
Energy: 0.8551828348055531
Energy: 0.7661842509571647
Energy: 0.8551828348063089
Energy: 0.7661842509571647
Energy: 0.8551828348063089
Energy: 0.7661842509571647
Energy: 0.789391887593602
Energy: 0.7671811541043153
Energy: 0.789391887593602
Energy: 0.7671811541043153
Energy: 0.789391887593602
Energy: 0.7671811541043153
Energy: 0.742246568945459
Energy: 0.6907048749104348
Energy: 0.742246568945459
Energy: 0.690704874909679
Energy: 0.742246568945459
Energy: 0.690704874909679
Energy: 0.7658310421703665
Energy: 0.7992207955809829
Energy: 0.7658310421703665
Energy: 0.7992207955802272
Energy: 0.7658310421703665
Energy: 0.7992207955802272
Energy: 0.7248379462667585
Energy: 0.7762441673543033
Energy: 0.7248379462667585
Energy: 0.776244167355059
Energy: 0.7248379462667585
Energy: 0.776244167355059

minimum gb energy = 0.6747888146613449 eV
minimum distance =  2.34082056868787 Angstroms
sigma value = 33


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

Energy: 0.9368268678012062
Energy: 0.753549826387972
Energy: 0.9368268678012062
Energy: 0.7535498263889306
Energy: 0.9368268678012062
Energy: 0.7535498263884512
Energy: 0.7778973825914939
Energy: 0.8458510243905679
Energy: 0.7778973825914939
Energy: 0.8458510243905679
Energy: 0.7778973825914939
Energy: 0.8458510243905679
Energy: 0.847105014348961
Energy: 0.8348893711456407
Energy: 0.8471050143494402
Energy: 0.8348893711456407
Energy: 0.8471050143494402
Energy: 0.8348893711456407
Energy: 0.8429424885086709
Energy: 0.7598534151402664
Energy: 0.8429424885086709
Energy: 0.7598534151397871
Energy: 0.8429424885086709
Energy: 0.7598534151397871
Energy: 0.86937081231611
Energy: 0.8662979700247752
Energy: 0.8693708123156308
Energy: 0.8662979700252544
Energy: 0.86937081231611
Energy: 0.8662979700252544
Energy: 0.9346745138008572
Energy: 0.8623459016365175
Energy: 0.9346745138008572
Energy: 0.8609214179744428
Energy: 0.9346745138008572
Energy: 0.860921417974922
Energy: 0.7798844246042392
Energy: 0.8666113155889296
Energy: 0.7798844246042392
Energy: 0.8666113155884502
Energy: 0.7798844246042392
Energy: 0.8666113155889296
Energy: 0.8347532708648097
Energy: 0.8352235258186964
Energy: 0.8347532708652889
Energy: 0.8352235258186964
Energy: 0.8347532708648097
Energy: 0.8352235258182171
Energy: 0.8307399051244033
Energy: 0.8478683704272298
Energy: 0.8307399051244033
Energy: 0.8478683704267506
Energy: 0.8307399051244033
Energy: 0.8478683704272298
Energy: 0.8928447754963559
Energy: 0.8108837881033817
Energy: 0.8928447754968352
Energy: 0.7946545330810965
Energy: 0.8928447754963559
Energy: 0.7946545330810965
Energy: 0.8218022315992797
Energy: 0.9060330525777783
Energy: 0.8218022315992797
Energy: 0.9060330525782141
Energy: 0.8218022315992797
Energy: 0.9060330525772989
Energy: 0.7778617390577356
Energy: 0.7871346904878624
Energy: 0.7778617390572563
Energy: 0.7871346904878624
Energy: 0.7778617390572563
Energy: 0.7871346904873832
Energy: 0.9345311195372608
Energy: 0.7912309664467995
Energy: 0.9345311195343847
Energy: 0.7912309664467995
Energy: 0.9345311195363021
Energy: 0.7912309664467995
Energy: 0.8028540649583703
Energy: 0.8319441150122358
Energy: 0.8028540649588497
Energy: 0.8319441150122358
Energy: 0.802854064957891
Energy: 0.831944115012715
Energy: 0.8190817343874052
Energy: 0.807177289326146
Energy: 0.8190817343874052
Energy: 0.807177289326146
Energy: 0.8190817343874052
Energy: 0.8071772893266254
Energy: 0.8429036625840529
Energy: 0.8569720147480169
Energy: 0.8429036625845323
Energy: 0.8569720147480169
Energy: 0.8429036625845323
Energy: 0.8569720147480169
Energy: 0.855809840430209
Energy: 0.8369885308512357
Energy: 0.8558098404297297
Energy: 0.8369885308512357
Energy: 0.855809840430209
Energy: 0.8369885308507563
Energy: 0.8771605520157955
Energy: 0.890305915593532
Energy: 0.8771605520153161
Energy: 0.890305915593532
Energy: 0.8771605520157955
Energy: 0.8903059155940113
Energy: 0.8299053164611303
Energy: 0.8910917790655131
Energy: 0.8299053164611303
Energy: 0.8910917790655131
Energy: 0.829905316460651
Energy: 0.8910917790650338
Energy: 0.8794299045153054
Energy: 0.8668644955019298
Energy: 0.8794299045153054
Energy: 0.8668644955033677
Energy: 0.8794299045153054
Energy: 0.8668644955009712
Energy: 0.8754268985074929
Energy: 0.8441640908011248
Energy: 0.8754268985074929
Energy: 0.844164090801604
Energy: 0.8754268985074929
Energy: 0.8441640908011248
Energy: 0.8194219224346325
Energy: 0.764183100025841
Energy: 0.8194219224341531
Energy: 0.7641831000253617
Energy: 0.8194219224346325
Energy: 0.764183100025841
Energy: 0.7827296129024554
Energy: 0.9060643838815561
Energy: 0.7827296129029346
Energy: 0.9060643838815561
Energy: 0.7827296129024554
Energy: 0.9060643838810767
Energy: 0.8824701438504445
Energy: 0.8049380916353422
Energy: 0.8824701438504445
Energy: 0.8049380916358215
Energy: 0.8824701438509239
Energy: 0.8049380916358215
Energy: 0.7776197269533262
Energy: 0.785122176637633
Energy: 0.7776197269528469
Energy: 0.785122176637633
Energy: 0.7776197269528469
Energy: 0.785122176637633
Energy: 0.7828844131957878
Energy: 0.9090428247308524
Energy: 0.7828844131957878
Energy: 0.9090428247308524
Energy: 0.7828844131953084
Energy: 0.9090428247313317
Energy: 0.779601844890888
Energy: 0.76171927487196
Energy: 0.7796018448899292
Energy: 0.7617192748714807
Energy: 0.7796018448904085
Energy: 0.7617192748714807
Energy: 0.8872260213011453
Energy: 0.885112620643018
Energy: 0.8872260213006659
Energy: 0.8851126206434974
Energy: 0.8872260213006659
Energy: 0.885112620643018
Energy: 0.8811611566781359
Energy: 0.9893547287708614
Energy: 0.8811611566776566
Energy: 0.9893547287713407
Energy: 0.8811611566776566
Energy: 0.9893547287708614
Energy: 0.7808014401642728
Energy: 0.8103236579181026
Energy: 0.7808014401642728
Energy: 0.8103236579181026
Energy: 0.7808014401642728
Energy: 0.8103236579181026
Energy: 0.9178428603537979
Energy: 0.9093419260181019
Energy: 0.9178428603537979
Energy: 0.9093419260181019
Energy: 0.9178428603542772
Energy: 0.9093419260181019
Energy: 0.8681127786558864
Energy: 0.8677281876853931
Energy: 0.8681127786554071
Energy: 0.8677281876853931
Energy: 0.8681127786558864
Energy: 0.8677281876853931
Energy: 0.8404165554142679
Energy: 0.8431887453417272
Energy: 0.8404165554137885
Energy: 0.8431887453412479
Energy: 0.8404165554142679
Energy: 0.8431887453417272
Energy: 0.8198841098009751
Energy: 0.8457554832807453
Energy: 0.8198841098009751
Energy: 0.8457554832807453
Energy: 0.8198841098009751
Energy: 0.8457554832802661
Energy: 0.8050123947108992
Energy: 0.8336225819438917
Energy: 0.8050123947113788
Energy: 0.8336225819438917
Energy: 0.8050123947108992
Energy: 0.8336225819443711
Energy: 0.9378356967699908
Energy: 0.7905882909770269
Energy: 0.9378356967690321
Energy: 0.7905882909770269
Energy: 0.9378356967690321
Energy: 0.7905882909770269
Energy: 0.7799705957492006
Energy: 0.826976563847678
Energy: 0.7799705957492006
Energy: 0.8269765638481573
Energy: 0.7799705957492006
Energy: 0.826976563847678

minimum gb energy = 0.753549826387972 eV
minimum distance =  2.3509138527878 Angstroms
sigma value = 41


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

Energy: 0.9812472622827515
Energy: 0.8615192989644604
Energy: 0.9812472622827515
Energy: 0.8615192989644604
Energy: 0.9812472622827515
Energy: 0.8615192989644604
Energy: 0.8640236051559738
Energy: 0.9398222152835075
Energy: 0.8640236051559738
Energy: 0.9398222152835075
Energy: 0.8640236051559738
Energy: 0.9398222152835075
Energy: 1.1626062395065027
Energy: 0.9591260168558288
Energy: 1.0284970159449478
Energy: 0.95912601685452
Energy: 1.0284970159423303
Energy: 0.95912601685452
Energy: 0.9708168544048541
Energy: 0.9488367266018118
Energy: 0.9708168544048541
Energy: 0.9488367266018118
Energy: 0.9708168544048541
Energy: 0.9488367266018118
Energy: 0.9413827247362451
Energy: 0.9485559961368566
Energy: 0.9413827247362451
Energy: 0.9485559961368566
Energy: 0.9413827247362451
Energy: 0.9485559961368566
Energy: 1.0780594859718937
Energy: 0.9887141870740017
Energy: 1.0780594859718937
Energy: 0.9887141870740017
Energy: 1.0780594859718937
Energy: 0.9887141870740017
Energy: 0.9687349091761959
Energy: 0.8797378247103024
Energy: 0.9687349091761959
Energy: 0.8797378247103024
Energy: 0.9687349091761959
Energy: 0.8797378247089936
Energy: 0.9322215151944628
Energy: 0.9596119896652426
Energy: 0.9322215151944628
Energy: 0.9596119896652426
Energy: 0.9322215151944628
Energy: 0.9596119896652426
Energy: 0.8659065329305936
Energy: 0.8881338811923812
Energy: 0.8659065329305936
Energy: 0.8881338811923812
Energy: 0.8659065329305936
Energy: 0.8881338811923812
Energy: 1.025982710715942
Energy: 0.8870963970934365
Energy: 1.025982710715942
Energy: 0.8870963970934365
Energy: 1.025982710715942
Energy: 0.8870963970934365
Energy: 0.9357942496627187
Energy: 0.9594704823625367
Energy: 0.9357942496627187
Energy: 0.9594704823625367
Energy: 0.9357942496627187
Energy: 0.9594704823625367
Energy: 0.9621834529916972
Energy: 0.9288237552700734
Energy: 0.9621834529916972
Energy: 0.9288237552700734
Energy: 0.9621834529916972
Energy: 0.9288237552700734
Energy: 0.9340147156783621
Energy: 0.9500487106056525
Energy: 0.9340147156783621
Energy: 0.9500487106056525
Energy: 0.9340147156783621
Energy: 0.9500487106056525
Energy: 0.9386622429037093
Energy: 0.9397102500530594
Energy: 0.9386622429037093
Energy: 0.9397102500530594
Energy: 0.9386622429037093
Energy: 0.9397102500530594

minimum gb energy = 0.8615192989644604 eV
minimum distance =  2.31890810984443 Angstroms
sigma value = 11


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

Energy: 1.1338057403782567
Energy: 1.0446996203725714
Energy: 1.1338057403782567
Energy: 1.0446996203725714
Energy: 1.1338057403776816
Energy: 1.0446996203731462
Energy: 1.068822282705245
Energy: 1.0631437248614022
Energy: 1.068822282705245
Energy: 1.0631437248614022
Energy: 1.068822282705245
Energy: 1.0631437248614022
Energy: 1.0490502136038642
Energy: 1.0712293104388004
Energy: 1.1103191434777475
Energy: 1.0712293104382251
Energy: 1.0490502136038642
Energy: 1.0712293104388004
Energy: 1.058483692382929
Energy: 0.9378987272923169
Energy: 1.058483692382929
Energy: 0.9378987272923169
Energy: 1.058483692382929
Energy: 0.937898727292892
Energy: 1.0515447736476227
Energy: 1.0091148868217392
Energy: 1.0515447736476227
Energy: 1.0091148868217392
Energy: 1.0515447736476227
Energy: 1.009114886822314
Energy: 0.9863319034126508
Energy: 1.0246853740256363
Energy: 0.9863319034126508
Energy: 1.0246853740262114
Energy: 0.9863319034126508
Energy: 1.0246853740262114
Energy: 1.1087383140655107
Energy: 1.0084148678538576
Energy: 1.1087383140655107
Energy: 1.0084148678538576
Energy: 1.1087383140655107
Energy: 1.0084148678538576
Energy: 1.0533773890207827
Energy: 1.0460296433082907
Energy: 1.0533773890202078
Energy: 1.0460296433077156
Energy: 1.0533773890207827
Energy: 1.0460296433082907
Energy: 1.0181092186620584
Energy: 1.0519564570002704
Energy: 1.0181092186620584
Energy: 1.0519564570002704
Energy: 1.0181092186620584
Energy: 1.0519564570002704
Energy: 1.0086711283166399
Energy: 1.003656252392654
Energy: 1.0086711283166399
Energy: 1.003656252392654
Energy: 1.0086711283166399
Energy: 1.003656252392654
Energy: 0.9467619942796701
Energy: 1.0898064733738013
Energy: 0.9467619942796701
Energy: 1.0898064733738013
Energy: 0.9467619942796701
Energy: 1.0898064733738013
Energy: 1.0480865701989275
Energy: 1.042251372231405
Energy: 1.0480865701989275
Energy: 1.042251372231405
Energy: 1.0480865701989275
Energy: 1.042251372231405
Energy: 1.1065648747965324
Energy: 1.014871917876207
Energy: 1.1065648747965324
Energy: 1.014871917876207
Energy: 1.1065648747965324
Energy: 1.014871917876207
Energy: 1.0149562158860301
Energy: 1.0786945443193992
Energy: 1.0149562158860301
Energy: 1.0786945443188243
Energy: 1.0149562158860301
Energy: 1.0786945443193992
Energy: 1.016677466301498
Energy: 1.0088737009845792
Energy: 1.016677466301498
Energy: 1.0088737009845792
Energy: 1.016677466301498
Energy: 1.0088737009840043
Energy: 1.0429249014336588
Energy: 1.0389415575136614
Energy: 1.0429249014342339
Energy: 1.0389415575130863
Energy: 1.0429249014342339
Energy: 1.0389415575130863
Energy: 0.9444276894102979
Energy: 1.1758436270658095
Energy: 0.9444276894102979
Energy: 1.1758436270658095
Energy: 0.9444276894102979
Energy: 1.1758436270658095
Energy: 1.112460356935482
Energy: 1.1013421163779924
Energy: 1.112460356935482
Energy: 1.1013421163779924
Energy: 1.1124603569349072
Energy: 1.1013421163779924
Energy: 1.071409749085185
Energy: 0.9432463517086543
Energy: 1.07140974908576
Energy: 0.9432463517086543
Energy: 1.07140974908576
Energy: 0.9432463517092292
Energy: 1.0434159544910486
Energy: 1.0283126017194877
Energy: 1.0434159544910486
Energy: 1.0283126017194877
Energy: 1.0434159544916237
Energy: 1.0283126017194877
Energy: 0.9951719049077532
Energy: 0.9698419823509318
Energy: 0.9951719049077532
Energy: 0.9698419823509318
Energy: 0.9951719049077532
Energy: 0.9698419823509318
Energy: 1.0900142943195712
Energy: 1.0700482845025618
Energy: 1.0900142943195712
Energy: 1.0700482845025618
Energy: 1.0900142943195712
Energy: 1.0700482845025618
Energy: 1.037703438429361
Energy: 1.0331879663976316
Energy: 1.037703438429361
Energy: 1.0331879663993566
Energy: 1.037703438429361
Energy: 1.0331879663976316
Energy: 1.0634436661511761
Energy: 1.046234655466284
Energy: 1.063443666150601
Energy: 1.046234655466284
Energy: 1.0634436661511761
Energy: 1.046234655466284
Energy: 0.9970871466767909
Energy: 0.991261867095205
Energy: 0.9970871466773659
Energy: 0.9912618670946302
Energy: 0.9970871466767909
Energy: 0.9912618670946302
Energy: 0.959022461246461
Energy: 1.083915888512705
Energy: 0.959022461246461
Energy: 1.083915888512705
Energy: 0.959022461246461
Energy: 1.083915888512705
Energy: 1.0401482149787697
Energy: 1.072969773895754
Energy: 1.0401482149781949
Energy: 1.072969773895754
Energy: 1.0401482149787697
Energy: 1.072969773895754
Energy: 1.0789333300749915
Energy: 1.0396104856939168
Energy: 1.0789333300749915
Energy: 1.0396104856939168
Energy: 1.0789333300749915
Energy: 1.039610485693342
Energy: 1.002369507383685
Energy: 1.0933306068103388
Energy: 1.002369507383685
Energy: 1.0933306068103388
Energy: 1.002369507383685
Energy: 1.0933306068103388
Energy: 0.9828063958663903
Energy: 0.9281000070025879
Energy: 0.9828063958663903
Energy: 0.9281000070025879
Energy: 0.9828063958669652
Energy: 0.9281000070031628
Energy: 1.0577148108666126
Energy: 1.0776030858633254
Energy: 1.0577148108666126
Energy: 1.0776030858633254
Energy: 1.0577148108666126
Energy: 1.0776030858633254

minimum gb energy = 0.9281000070025879 eV
minimum distance =  2.33468395087902 Angstroms
sigma value = 57


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

Energy: 1.0255855973654207
Energy: 0.9137283308351478
Energy: 1.0255855973654207
Energy: 0.9137283308351478
Energy: 1.0255855973654207
Energy: 0.9137283308351478
Energy: 1.0239067852335748
Energy: 1.1130415792558046
Energy: 1.0239067852335748
Energy: 1.1130415792558046
Energy: 1.0239067852335748
Energy: 1.1130415792558046
Energy: 1.0866034644504552
Energy: 0.9539782603647049
Energy: 1.0866034644504552
Energy: 0.9539782603657281
Energy: 1.0866034644504552
Energy: 0.9539782603647049
Energy: 1.0625636378652157
Energy: 1.0228265756043922
Energy: 1.0625636378652157
Energy: 1.0228265756043922
Energy: 1.0625636378652157
Energy: 1.0228265756043922
Energy: 1.0866085636833591
Energy: 0.9539975496793381
Energy: 1.0866085636833591
Energy: 0.9539975496793381
Energy: 1.0866085636833591
Energy: 0.9539975496793381
Energy: 1.0238743337382414
Energy: 1.0742128601075804
Energy: 1.0238743337382414
Energy: 0.9192935473768957
Energy: 1.0238743337392644
Energy: 0.9192935473768957
Energy: 1.0255855973654207
Energy: 0.9137283308351478
Energy: 1.0255855973654207
Energy: 0.9137283308351478
Energy: 1.0255855973654207
Energy: 0.9137283308351478
Energy: 1.0239067852335748
Energy: 1.1130415792558046
Energy: 1.0239067852335748
Energy: 1.1130415792558046
Energy: 1.0239067852335748
Energy: 1.1130415792547814
Energy: 1.0866034644514784
Energy: 0.9539782603647049
Energy: 1.0866034644514784
Energy: 0.9539782603647049
Energy: 1.0866034644514784
Energy: 0.9539782603647049
Energy: 1.0625636378652157
Energy: 1.0228265756033692
Energy: 1.0625636378641927
Energy: 1.0228265756033692
Energy: 1.0625636378652157
Energy: 1.0228265756033692
Energy: 1.0866085636833591
Energy: 0.9539975496793381
Energy: 1.0866085636833591
Energy: 0.9539975496783151
Energy: 1.0866085636833591
Energy: 0.9539975496793381
Energy: 1.0238743337382414
Energy: 1.0742128601065575
Energy: 1.0238743337382414
Energy: 0.9192935473768957
Energy: 1.0238743337382414
Energy: 0.9192935473768957
Energy: 1.0255855973654207
Energy: 0.9137283308351478
Energy: 1.0255855973654207
Energy: 0.9137283308351478
Energy: 1.0255855973654207
Energy: 0.9137283308351478
Energy: 1.0239067852325516
Energy: 1.1130415792558046
Energy: 1.0239067852325516
Energy: 1.1130415792558046
Energy: 1.0239067852325516
Energy: 1.1130415792558046
Energy: 1.0866034644504552
Energy: 0.9539782603647049
Energy: 1.0866034644504552
Energy: 0.9539782603647049
Energy: 1.0866034644504552
Energy: 0.9539782603647049
Energy: 1.0625636378652157
Energy: 1.0228265756043922
Energy: 1.0625636378652157
Energy: 1.0228265756043922
Energy: 1.0625636378652157
Energy: 1.0228265756043922
Energy: 1.0866085636833591
Energy: 0.9539975496793381
Energy: 1.0866085636833591
Energy: 0.9539975496793381
Energy: 1.0866085636833591
Energy: 0.9539975496793381

minimum gb energy = 0.9137283308351478 eV
minimum distance =  2.34381649883869 Angstroms
sigma value = 9


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

Energy: 1.0429620946961171
Energy: 1.0798098007414692
Energy: 1.0429620946961171
Energy: 1.0798098007414692
Energy: 1.0429620946961171
Energy: 1.0798098007414692
Energy: 1.0690201817356766
Energy: 1.0535338572098254
Energy: 1.0690201817348413
Energy: 1.0535338572089903
Energy: 1.0690201817356766
Energy: 1.0535338572098254
Energy: 1.0989952644785415
Energy: 1.0494902059186242
Energy: 1.123879235241067
Energy: 1.0494902059186242
Energy: 1.1238792352402318
Energy: 1.0494902059186242
Energy: 1.0499030919097148
Energy: 1.1009607160397112
Energy: 1.0499030919097148
Energy: 1.1009607160397112
Energy: 1.0499030919097148
Energy: 1.1009607160397112
Energy: 1.0787429474700947
Energy: 1.0690487558660513
Energy: 1.0787429474692594
Energy: 1.0690487558660513
Energy: 1.0787429474692594
Energy: 1.0690487558660513
Energy: 1.0225774117716564
Energy: 1.0025069850975548
Energy: 1.0225774117716564
Energy: 1.0025069850992256
Energy: 1.0225774117716564
Energy: 1.0025069850975548
Energy: 0.989736641700148
Energy: 1.0412685863012536
Energy: 0.989736641700148
Energy: 1.041268586302089
Energy: 0.989736641700148
Energy: 1.0412685863004183
Energy: 1.022615513173258
Energy: 1.0399403205840294
Energy: 1.022615513173258
Energy: 1.0399403205840294
Energy: 1.022615513173258
Energy: 1.0399403205840294
Energy: 1.1853521264469717
Energy: 1.0679763652329006
Energy: 1.185352126447807
Energy: 1.0679763652329006
Energy: 1.185352126447807
Energy: 1.0679763652329006
Energy: 1.0263788600575356
Energy: 1.0270070081812068
Energy: 1.0263788600575356
Energy: 1.0270070081812068
Energy: 1.0263788600575356
Energy: 1.0270070081812068
Energy: 1.00369890891549
Energy: 1.0664616538453182
Energy: 1.0036989089146546
Energy: 1.0664616538453182
Energy: 1.0036989089146546
Energy: 1.0664616538453182
Energy: 1.077237938889866
Energy: 1.0369341354748687
Energy: 1.077237938889866
Energy: 1.0369341354748687
Energy: 1.077237938889866
Energy: 1.0369341354748687
Energy: 1.0137533258473674
Energy: 1.2054919385916565
Energy: 1.013753325846532
Energy: 1.2054919385916565
Energy: 1.0137533258473674
Energy: 1.2054919385916565
Energy: 1.0167092727095777
Energy: 1.0840759973532972
Energy: 1.0167092727095777
Energy: 1.0840759973532972
Energy: 1.0167092727095777
Energy: 1.0840759973524616
Energy: 1.1826896170860135
Energy: 1.0646745439602774
Energy: 1.1826896170860135
Energy: 1.0646745439611127
Energy: 1.1826896170860135
Energy: 1.0646745439602774
Energy: 1.0283122035028982
Energy: 1.053796189021431
Energy: 1.0283122035028982
Energy: 1.053796189021431
Energy: 1.0283122035028982
Energy: 1.0537961890222662
Energy: 1.0840575404604298
Energy: 1.075874104670736
Energy: 1.0840575404595947
Energy: 1.0758741046715714
Energy: 1.0840575404604298
Energy: 1.0758741046715714
Energy: 1.1511159046225221
Energy: 1.0628508134033694
Energy: 1.1511159046225221
Energy: 1.0628508134033694
Energy: 1.1511159046225221
Energy: 1.0628508134033694
Energy: 0.9904498415651538
Energy: 1.083759800605424
Energy: 0.9904498415651538
Energy: 1.0837598006045888
Energy: 0.9904498415651538
Energy: 1.083759800605424
Energy: 1.1328479290388451
Energy: 1.1010018258085514
Energy: 1.1328479290388451
Energy: 1.1010018258077157
Energy: 1.1328479290380098
Energy: 1.1010018258077157
Energy: 1.0739981636372942
Energy: 1.0356458734198637
Energy: 1.0739981636381293
Energy: 1.0356458734198637
Energy: 1.0739981636381293
Energy: 1.0356458734190286

minimum gb energy = 0.989736641700148 eV
minimum distance =  2.33822787683976 Angstroms
sigma value = 27


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

Energy: 1.0593779075190473
Energy: 1.212218973560261
Energy: 1.0249781950337633
Energy: 1.212218973559557
Energy: 1.0593779075190473
Energy: 1.2122189735588529
Energy: 1.0573459086547734
Energy: 1.0437328517059925
Energy: 1.0573459086554775
Energy: 1.0437328517059925
Energy: 1.0573459086547734
Energy: 1.0437328517052884
Energy: 1.0311083698215793
Energy: 0.9946208527899044
Energy: 1.0311083698222832
Energy: 0.9946208527892004
Energy: 1.0311083698215793
Energy: 0.9946208527906086
Energy: 0.9454433728458662
Energy: 1.061737273943707
Energy: 0.9454433728465704
Energy: 1.061737273943707
Energy: 0.9454433728458662
Energy: 1.0617372739422986
Energy: 1.0120236366220825
Energy: 1.085726500052005
Energy: 1.0120236366220825
Energy: 1.085726500051301
Energy: 1.0120236366227864
Energy: 1.085726500052005
Energy: 1.1015336756312377
Energy: 1.041509087624535
Energy: 1.1015336756305336
Energy: 1.041509087624535
Energy: 1.1015336756312377
Energy: 1.041509087624535
Energy: 0.983419744648339
Energy: 1.0589008523161823
Energy: 0.9834197446497475
Energy: 1.0589008523161823
Energy: 0.9834197446490432
Energy: 1.0589008523168868
Energy: 1.1050768489175298
Energy: 1.031371818972691
Energy: 1.1050768489168254
Energy: 1.0313718189719867
Energy: 1.1050768489175298
Energy: 1.0313718189719867
Energy: 1.0983831254589762
Energy: 0.9493586796004956
Energy: 1.098229901471962
Energy: 0.9493586796004956
Energy: 1.0983831254582719
Energy: 0.9493586796004956
Energy: 1.0468720889230767
Energy: 1.0616390504363342
Energy: 1.0470041620586266
Energy: 1.0616390504363342
Energy: 1.0468720889230767
Energy: 1.0616390504363342
Energy: 1.046942881907281
Energy: 1.126051559856224
Energy: 1.0471109566158463
Energy: 1.126051559856224
Energy: 1.046942881907281
Energy: 1.1260515598569278
Energy: 1.0710399477984693
Energy: 0.9843384787362819
Energy: 1.0710399477998773
Energy: 0.9843384787362819
Energy: 1.0710399477984693
Energy: 0.9843384787355779
Energy: 0.9962163004799435
Energy: 1.063421542724761
Energy: 0.9962163004806475
Energy: 1.063421542724761
Energy: 0.9962163004813517
Energy: 1.0634215427233527
Energy: 0.9457760107932585
Energy: 1.0167876795769644
Energy: 0.9457760107932585
Energy: 1.0167876795776685
Energy: 0.9457760107932585
Energy: 1.016787679579077
Energy: 1.1613134588882783
Energy: 1.0394122816669757
Energy: 1.1576802357501694
Energy: 1.0394122816669757
Energy: 1.1613134588882783
Energy: 1.0394122816669757
Energy: 1.0459693278220217
Energy: 1.064319278080966
Energy: 1.0459693278213493
Energy: 1.064319278080966
Energy: 1.0459693278220217
Energy: 1.06431927808167
Energy: 0.9852027004888066
Energy: 1.0331816268688776
Energy: 0.9852027004888066
Energy: 1.0331816268688776
Energy: 0.9852027004888066
Energy: 1.0331816268688776
Energy: 1.0615837506775787
Energy: 0.9767216195432071
Energy: 1.0615837506775787
Energy: 0.9767216195432071
Energy: 1.0615837506782828
Energy: 0.9767216195439113
Energy: 1.0642374136971997
Energy: 1.0039024357031348
Energy: 1.0021337120798466
Energy: 1.0039024357024307
Energy: 1.0642374136979038
Energy: 1.0039024357031348
Energy: 1.0593779075190473
Energy: 1.212218973559557
Energy: 1.0249781950330592
Energy: 1.212218973559557
Energy: 1.0593779075183432
Energy: 1.2122189735588529
Energy: 1.0573459086554775
Energy: 1.0437328517066966
Energy: 1.0573459086561818
Energy: 1.0437328517066966
Energy: 1.0573459086554775
Energy: 1.0437328517066966
Energy: 1.0311083698215793
Energy: 0.9946208527906086
Energy: 1.031108369820875
Energy: 0.9946208527913128
Energy: 1.0311083698215793
Energy: 0.9946208527913128
Energy: 0.9454433728458662
Energy: 1.0617372739422986
Energy: 0.9454433728458662
Energy: 1.0617372739422986
Energy: 0.9454433728458662
Energy: 1.0617372739415945
Energy: 1.0120236366220825
Energy: 1.0857265000527092
Energy: 1.0120236366227864
Energy: 1.0857265000527092
Energy: 1.0120236366213782
Energy: 1.0857265000534133
Energy: 1.1015336756312377
Energy: 1.0415090876252389
Energy: 1.1015336756305336
Energy: 1.0415090876252389
Energy: 1.1015336756305336
Energy: 1.0415090876252389

minimum gb energy = 0.9454433728458662 eV
minimum distance =  2.33146008582526 Angstroms
sigma value = 19


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

Energy: 0.952283169636516
Energy: 1.108344416592017
Energy: 0.952283169636516
Energy: 1.108344416592017
Energy: 0.9522831696371238
Energy: 1.108344416592017
Energy: 1.0296297659559877
Energy: 0.9688402417753109
Energy: 1.0296297659565954
Energy: 0.9688402417747032
Energy: 1.0296297659559877
Energy: 0.9688402417747032
Energy: 1.118673834791035
Energy: 0.9271007207578537
Energy: 1.118673834791035
Energy: 0.9271007207578537
Energy: 1.118673834791035
Energy: 0.9271007207578537
Energy: 0.9185975196913174
Energy: 1.0118968647668813
Energy: 0.9185975196913174
Energy: 1.0118968647668813
Energy: 0.9185975196913174
Energy: 1.0118968647668813
Energy: 0.9784087514830712
Energy: 1.0304180759446873
Energy: 0.9784087514824634
Energy: 1.0304180759446873
Energy: 0.9784087514824634
Energy: 1.0304180759446873
Energy: 1.0320747058514532
Energy: 0.9242783861579883
Energy: 1.0320747058514532
Energy: 0.9242783861579883
Energy: 1.0320747058514532
Energy: 0.9242783861579883
Energy: 0.9374399983803902
Energy: 1.1104894801370457
Energy: 0.9374399983803902
Energy: 1.1104894801370457
Energy: 0.9374399983803902
Energy: 1.1104894801370457
Energy: 0.9440916142472286
Energy: 1.1377195492988716
Energy: 0.9440916142472286
Energy: 1.1377195492988716
Energy: 0.9440916142472286
Energy: 1.1377195492988716
Energy: 1.0226139692795417
Energy: 0.9050735356337003
Energy: 1.0226139692795417
Energy: 0.9050735356337003
Energy: 1.0226139692795417
Energy: 0.905073535634308
Energy: 1.0031271210914334
Energy: 1.0133499250019715
Energy: 1.0031271210914334
Energy: 1.0133499250013636
Energy: 1.0031271210914334
Energy: 1.0133499250013636
Energy: 0.9062839248459529
Energy: 1.1402133169782174
Energy: 0.906283924845345
Energy: 1.1402133169776096
Energy: 0.906283924845345
Energy: 1.1402133169782174
Energy: 1.0477545104410897
Energy: 0.9232702541672606
Energy: 1.0477545104416972
Energy: 0.9232702541672606
Energy: 1.0477545104410897
Energy: 0.9232702541672606
Energy: 1.001450949435505
Energy: 0.9749999048276047
Energy: 1.001450949434897
Energy: 0.9749999048282125
Energy: 1.001450949435505
Energy: 0.9749999048282125
Energy: 0.9227073610730853
Energy: 1.010590332800126
Energy: 0.922707361073693
Energy: 1.010590332800126
Energy: 0.9227073610730853
Energy: 1.010590332800126
Energy: 1.083388771895529
Energy: 0.9538596708075064
Energy: 1.0833887718949213
Energy: 0.9538596708068987
Energy: 1.083388771895529
Energy: 0.9538596708068987
Energy: 1.1314844475361157
Energy: 0.9051580763504152
Energy: 1.1314844475361157
Energy: 0.9051580763504152
Energy: 1.1314844475361157
Energy: 0.9051580763504152
Energy: 0.929400623090127
Energy: 1.0142588585428218
Energy: 0.929400623090127
Energy: 1.0142588585428218
Energy: 0.929400623090127
Energy: 1.0142588585428218
Energy: 1.0145999269055517
Energy: 1.1149161494947588
Energy: 1.0145999269055517
Energy: 1.1149161494947588
Energy: 1.0145999269061596
Energy: 1.1149161494947588
Energy: 1.1003206720863465
Energy: 0.9228342798032194
Energy: 1.1003206720863465
Energy: 0.9228342798032194
Energy: 1.1003206720863465
Energy: 0.9228342798026116
Energy: 0.9313220188052572
Energy: 1.0291397228623678
Energy: 0.9313220188052572
Energy: 1.0291397228623678
Energy: 0.9313220188052572
Energy: 1.0291397228623678
Energy: 0.9016726214613207
Energy: 1.155739757652918
Energy: 0.9016726214613207
Energy: 1.15573975765231
Energy: 0.9016726214613207
Energy: 1.155739757652918
Energy: 1.0424626156009205
Energy: 0.927006493851834
Energy: 1.0424626156009205
Energy: 0.927006493851834
Energy: 1.0424626156009205
Energy: 0.927006493851834
Energy: 1.044177543621129
Energy: 1.0783945306051756
Energy: 1.0441775436217369
Energy: 1.0783945306051756
Energy: 1.0441775436217369
Energy: 1.0783945306051756
Energy: 0.9444489133548502
Energy: 1.1253835772714387
Energy: 0.9444489133578893
Energy: 1.1253835772714387
Energy: 0.944448913356066
Energy: 1.1253835772714387
Energy: 0.9661170672783899
Energy: 0.9270839056907786
Energy: 0.9661170672789976
Energy: 0.9270839056901707
Energy: 0.9661170672789976
Energy: 0.9270839056907786
Energy: 1.0634575797045698
Energy: 0.9194307261043855
Energy: 1.0634575797045698
Energy: 0.9194307261043855
Energy: 1.0634575797051775
Energy: 0.9194307261043855
Energy: 0.9029198978042365
Energy: 0.9796657465992095
Energy: 0.9029198978048442
Energy: 0.9796657465992095
Energy: 0.9029198978048442
Energy: 0.9796657465992095
Energy: 1.0486222392640943
Energy: 0.9223439023389783
Energy: 1.0486222392634863
Energy: 0.9223439023389783
Energy: 1.0486222392640943
Energy: 0.9223439023389783
Energy: 1.0063656680287907
Energy: 0.9224050129197965
Energy: 1.0063656680287907
Energy: 0.9224050129204042
Energy: 1.0063656680287907
Energy: 0.9224050129197965

minimum gb energy = 0.9016726214613207 eV
minimum distance =  2.33357561949915 Angstroms
sigma value = 101


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

Energy: 0.8940997614413977
Energy: 1.0334993650743551
Energy: 0.894099761441932
Energy: 1.0334993650748894
Energy: 0.8940997614408633
Energy: 1.0334993650748894
Energy: 0.9554629429289888
Energy: 0.8786803766776233
Energy: 0.9554629429327288
Energy: 0.8786803766776233
Energy: 0.9554629429300575
Energy: 0.8786803766776233
Energy: 1.0146169431369805
Energy: 0.8812664741490446
Energy: 1.0146169431369805
Energy: 0.8812664741495789
Energy: 1.0146169431369805
Energy: 0.8812664741490446
Energy: 0.8568243294352822
Energy: 1.1168212425892656
Energy: 0.8568243294352822
Energy: 1.1168212425892656
Energy: 0.8568243294352822
Energy: 1.1168212425892656
Energy: 0.9314075616707707
Energy: 0.9798186459983674
Energy: 0.9314075616718391
Energy: 0.979818645997833
Energy: 0.9314075616718391
Energy: 0.9798186459983674
Energy: 0.9892057304579573
Energy: 0.8683105316131777
Energy: 0.9892057304584917
Energy: 0.8683105316131777
Energy: 0.9892057304579573
Energy: 0.8683105316131777
Energy: 0.8785439807746301
Energy: 1.1476411580832744
Energy: 0.8785439807746301
Energy: 1.1476411580832744
Energy: 0.8785439807746301
Energy: 1.1476411580832744
Energy: 0.8681502120880669
Energy: 1.1410603354255815
Energy: 0.8681502120880669
Energy: 1.0634445363596194
Energy: 0.8681502120880669
Energy: 1.0634445363596194
Energy: 1.0020867124490627
Energy: 0.8696565960742533
Energy: 1.0020867124495971
Energy: 0.8696565960747875
Energy: 1.0020867124495971
Energy: 0.8696565960742533
Energy: 0.9320062337484535
Energy: 1.0085942624216946
Energy: 0.9320062337484535
Energy: 1.013166764582909
Energy: 0.9320062337484535
Energy: 1.013166764582909
Energy: 0.8555826783092456
Energy: 1.0524660348784722
Energy: 0.8555826783092456
Energy: 1.0524660348784722
Energy: 0.8555826783092456
Energy: 1.0524660348784722
Energy: 1.0404987038452131
Energy: 0.8784348080448426
Energy: 1.0404987038452131
Energy: 0.8784348080448426
Energy: 1.0404987038457474
Energy: 0.8784348080448426
Energy: 0.9870890621046188
Energy: 0.881585114306249
Energy: 0.9870890621046188
Energy: 0.8815851143057146
Energy: 0.987089062105153
Energy: 0.881585114306249
Energy: 0.8941668800194057
Energy: 1.092285728596966
Energy: 0.8941668800188715
Energy: 1.0922857285975003
Energy: 0.8941668800194057
Energy: 1.0922857285975003
Energy: 0.9961247644838418
Energy: 0.9690818109515339
Energy: 0.9961247644849103
Energy: 0.9690818109515339
Energy: 0.9961247644833073
Energy: 0.9690818109515339
Energy: 1.0134167385624948
Energy: 0.8836022519306219
Energy: 1.0134167385624948
Energy: 0.8836022519300877
Energy: 1.0134167385624948
Energy: 0.8836022519300877
Energy: 0.8556419475063074
Energy: 1.2249498625275375
Energy: 0.8556419475068416
Energy: 1.2249498625291404
Energy: 0.8556419475068416
Energy: 1.2249498625291404
Energy: 0.8558421550867494
Energy: 0.9796537864760454
Energy: 0.8558421550867494
Energy: 0.9796537864760454
Energy: 0.855842155086215
Energy: 0.9796537864760454
Energy: 0.9890277158115786
Energy: 0.8696221930264318
Energy: 0.9890277158121127
Energy: 0.8696221930258976
Energy: 0.9890277158115786
Energy: 0.8696221930264318
Energy: 0.879345955864683
Energy: 1.0426078521908189
Energy: 0.8793459558636145
Energy: 1.042607852191353
Energy: 0.8793459558636145
Energy: 1.042607852191353
Energy: 0.8702695989637661
Energy: 1.0930464250683236
Energy: 0.8702695989637661
Energy: 1.0930464250683236
Energy: 0.8702695989637661
Energy: 1.093046425069392
Energy: 1.2089640537304858
Energy: 0.8685489205641238
Energy: 1.2089640537304858
Energy: 0.8685489205646337
Energy: 1.2089640537310202
Energy: 0.8685489205646337
Energy: 1.0140681384174732
Energy: 0.8688985303946847
Energy: 1.0140681384174732
Energy: 0.8688985303952189
Energy: 1.0140681384174732
Energy: 0.8688985303946847
Energy: 0.8568161704063546
Energy: 0.9828423107686354
Energy: 0.8568161704063546
Energy: 0.9828423107686354
Energy: 0.8568161704063546
Energy: 0.9828423107686354
Energy: 1.0399321588020962
Energy: 0.8912274581304392
Energy: 1.039932158801562
Energy: 0.8912274581304392
Energy: 1.0399321588020962
Energy: 0.8912274581304392
Energy: 1.0821927501475208
Energy: 0.883421606737085
Energy: 1.0821927501469866
Energy: 0.8834216067365508
Energy: 1.0821927501469866
Energy: 0.8834216067365508
Energy: 0.8941518294733423
Energy: 1.1808899848174994
Energy: 0.8941518294712052
Energy: 1.180889984816965
Energy: 0.8941518294728079
Energy: 1.180889984816965
Energy: 0.8944639522341407
Energy: 1.0045946232807554
Energy: 0.8944639522341407
Energy: 1.0045946232807554
Energy: 0.8944639522341407
Energy: 1.0045946232807554
Energy: 0.9829152222690013
Energy: 0.8812819813480304
Energy: 0.9829152222690013
Energy: 0.8812819813480304
Energy: 0.9829152222690013
Energy: 0.8812819813480304
Energy: 0.8562340522922758
Energy: 1.1182759109354738
Energy: 0.8562340522922758
Energy: 1.1182759109349396
Energy: 0.8562340522922758
Energy: 1.1182759109354738
Energy: 0.855649339083475
Energy: 0.9518474106064011
Energy: 0.855649339083475
Energy: 0.9518474106064011
Energy: 0.855649339083475
Energy: 0.9518474106064011
Energy: 1.0925697224124902
Energy: 0.868422593060405
Energy: 1.0925697224124902
Energy: 0.8684225930609394
Energy: 1.0925697224124902
Energy: 0.868422593060405
Energy: 1.1439343589400184
Energy: 0.8688808458878001
Energy: 1.1439343589400184
Energy: 0.8688808458878001
Energy: 1.1439343589400184
Energy: 0.8688808458883344

minimum gb energy = 0.8555826783092456 eV
minimum distance =  2.34935818547211 Angstroms
sigma value = 33


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

Energy: 0.015499874000042782
Energy: 0.806406206612856
Energy: 0.015499874000042782
Energy: 0.806406206612856
Energy: 0.015499874000042782
Energy: 0.806406206612856
Energy: 0.01616661473211329
Energy: 0.2558857258183896
Energy: 0.01616661473211329
Energy: 0.2558857258188335
Energy: 0.01616661473211329
Energy: 0.2558857258183896
Energy: 0.80712833582237
Energy: 0.25544469099455214
Energy: 0.807106587942813
Energy: 0.25544469099455214
Energy: 0.8070792319816198
Energy: 0.255444690994996
Energy: 0.016166614732557216
Energy: 0.2558857258188335
Energy: 0.01616661473211329
Energy: 0.2558857258188335
Energy: 0.016166614732557216
Energy: 0.2558857258188335

minimum gb energy = 0.015499874000042782 eV
minimum distance =  2.54253903094852 Angstroms
sigma value = 1