Model name: model_name=EAM_Dynamo_SturgeonLaird_2000_Al__MO_120808805541_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.050010219216347
cohesive_energy=3.3902685453001857
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.010440647348430789
Energy: 0.4736050670773176
Energy: 0.010440647348680646
Energy: 0.4736050670773176
Energy: 0.010440647348680646
Energy: 0.4736050670773176
Energy: 0.47360506707756744
Energy: 0.010659728267420038
Energy: 0.4736050670773176
Energy: 0.010659728265698798
Energy: 0.4736050670773176
Energy: 0.01065972826644837
Energy: 0.010440647348430789
Energy: 0.4736050670773176
Energy: 0.010440647348680646
Energy: 0.4736050670773176
Energy: 0.010440647348680646
Energy: 0.4736050670773176
Energy: 0.47360506707756744
Energy: 0.010659728265476703
Energy: 0.4736050670773176
Energy: 0.010659728266198513
Energy: 0.4736050670773176
Energy: 0.01065972826644837
Energy: 0.010440647348430789
Energy: 0.4736050670773176
Energy: 0.010440647348680646
Energy: 0.4736050670773176
Energy: 0.010440647348430789
Energy: 0.4736050670773176
Energy: 0.4736050670773176
Energy: 0.010659728265948656
Energy: 0.4736050670773176
Energy: 0.010659728265476703
Energy: 0.4736050670773176
Energy: 0.010659728265476703

minimum gb energy = 0.010440647348430789 eV
minimum distance =  2.86006497699093 Angstroms
sigma value = 1


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

Energy: 0.5756414786134664
Energy: 0.5466246777774983
Energy: 0.575641478612865
Energy: 0.5466246777774983
Energy: 0.575641478612865
Energy: 0.5466246777774983
Energy: 0.6296923573132226
Energy: 0.5118598838121506
Energy: 0.6296923573144255
Energy: 0.5118598838121506
Energy: 0.6296923573144255
Energy: 0.5118598838121506
Energy: 0.5472750997239866
Energy: 0.5763085789357173
Energy: 0.5472750997239866
Energy: 0.5763085789363187
Energy: 0.5472750997233851
Energy: 0.5763085789369202
Energy: 0.616334181791461
Energy: 0.5361769608435822
Energy: 0.6163341817908595
Energy: 0.5361769608435822
Energy: 0.6163341817908595
Energy: 0.5361769608435822
Energy: 0.5512295733442559
Energy: 0.6074719041766353
Energy: 0.5512295733436546
Energy: 0.6074719041766353
Energy: 0.5512295733436546
Energy: 0.6074719041766353
Energy: 0.5780021141095099
Energy: 0.5218302858851939
Energy: 0.5780021141095099
Energy: 0.5218302858851939
Energy: 0.5780021141089084
Energy: 0.5218302858851939
Energy: 0.5486240263148302
Energy: 0.5657292241732879
Energy: 0.5486240263142288
Energy: 0.5657292241738894
Energy: 0.5486240263160331
Energy: 0.5657292241738894
Energy: 0.5345217703521628
Energy: 0.6076782411992516
Energy: 0.5345217703515613
Energy: 0.6076782412004543
Energy: 0.5345217703515613
Energy: 0.6076782411992516
Energy: 0.590853819123753
Energy: 0.5701807123112489
Energy: 0.5908538191231515
Energy: 0.5701807123118504
Energy: 0.590853819123753
Energy: 0.5701807123112489
Energy: 0.5045779724289583
Energy: 0.6015612809714388
Energy: 0.5045779724295597
Energy: 0.6015612809720402
Energy: 0.5045779724289583
Energy: 0.6015612809702359
Energy: 0.6720874608348375
Energy: 0.5208292725933255
Energy: 0.6720874608348375
Energy: 0.5208292725939269
Energy: 0.6720874608348375
Energy: 0.5208292725933255
Energy: 0.49818839236578555
Energy: 0.5911459298705213
Energy: 0.4981883923651842
Energy: 0.5911459298669126
Energy: 0.4981883923651842
Energy: 0.5911459298699198
Energy: 0.6246959264423686
Energy: 0.49331514123928155
Energy: 0.6246959264411658
Energy: 0.49331514123928155
Energy: 0.6246959264411658
Energy: 0.49331514123928155
Energy: 0.5291219123004397
Energy: 0.5416236861721391
Energy: 0.5291219123004397
Energy: 0.5416236861721391
Energy: 0.5291219123004397
Energy: 0.5416236861721391
Energy: 0.6386189480597594
Energy: 0.5114588958919047
Energy: 0.6386189480579548
Energy: 0.5114588958919047
Energy: 0.6386189480579548
Energy: 0.5114588958919047
Energy: 0.6388004727889581
Energy: 0.578370860156699
Energy: 0.6388004727889581
Energy: 0.5783708601573007
Energy: 0.6388004727889581
Energy: 0.578370860156699
Energy: 0.5605715004757724
Energy: 0.565826115390577
Energy: 0.5605715004763738
Energy: 0.5658261153899755
Energy: 0.5605715004763738
Energy: 0.5658261153899755
Energy: 0.5605763839433986
Energy: 0.5379461968017889
Energy: 0.5605763839427972
Energy: 0.5379461968017889
Energy: 0.5605763839433986
Energy: 0.5379461968017889
Energy: 0.5109446518304928
Energy: 0.5373720369916097
Energy: 0.5109446518304928
Energy: 0.537372036992211
Energy: 0.5109446518304928
Energy: 0.537372036992211
Energy: 0.5839485925898631
Energy: 0.5219604966653971
Energy: 0.5839485925892615
Energy: 0.5219604966653971
Energy: 0.5839485925898631
Energy: 0.5219604966647957
Energy: 0.517438012823742
Energy: 0.6104348779348069
Energy: 0.517438012823742
Energy: 0.6104348779348069
Energy: 0.517438012823742
Energy: 0.6104348779354085
Energy: 0.5814572035085819
Energy: 0.5669678793945415
Energy: 0.5814572035079805
Energy: 0.5669678793945415
Energy: 0.5814572035085819
Energy: 0.5669678793945415
Energy: 0.48923305719314525
Energy: 0.6126934742581911
Energy: 0.48923305719314525
Energy: 0.612693474257617
Energy: 0.48923305719314525
Energy: 0.612693474259394

minimum gb energy = 0.48923305719314525 eV
minimum distance =  2.58230352877456 Angstroms
sigma value = 33


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

Energy: 0.5735160516436099
Energy: 0.597232488912004
Energy: 0.5735160516436099
Energy: 0.597232488912004
Energy: 0.5735160516425836
Energy: 0.5972324889123461
Energy: 0.5825218974404842
Energy: 0.5395149159464969
Energy: 0.5825218974404842
Energy: 0.5395149159461549
Energy: 0.5825218974408263
Energy: 0.5395149159464969
Energy: 0.4956702452868452
Energy: 0.5402260011779946
Energy: 0.49567024528718734
Energy: 0.5402260011779946
Energy: 0.49567024528718734
Energy: 0.540226001179021
Energy: 0.589002891992932
Energy: 0.594904108534345
Energy: 0.589002891993274
Energy: 0.5949041085346871
Energy: 0.589002891992932
Energy: 0.5949041085346871
Energy: 0.538734873190272
Energy: 0.5630079015314627
Energy: 0.5387348731912982
Energy: 0.5630079015318048
Energy: 0.5387348731919824
Energy: 0.5630079015307786
Energy: 0.5400198184824848
Energy: 0.49555267821119153
Energy: 0.5400198184828269
Energy: 0.49555267821119153
Energy: 0.5400198184821428
Energy: 0.49555267821119153
Energy: 0.5978644605398373
Energy: 0.5737816350290311
Energy: 0.5978644605381269
Energy: 0.5737816350290311
Energy: 0.5978644605364164
Energy: 0.573781635028347
Energy: 0.493365737100877
Energy: 0.5739317473207697
Energy: 0.493365737100877
Energy: 0.5739317473204275
Energy: 0.4933657371001928
Energy: 0.5739317473200855
Energy: 0.5192691793474026
Energy: 0.4962773332689869
Energy: 0.5192691793480868
Energy: 0.4962773332689869
Energy: 0.5192691793480868
Energy: 0.4962773332689869
Energy: 0.4903444096352663
Energy: 0.5437654127037004
Energy: 0.4903444096352663
Energy: 0.5437654127047267
Energy: 0.4903444096349241
Energy: 0.5437654127033582
Energy: 0.5450293293171564
Energy: 0.4880480874145255
Energy: 0.5450293293144196
Energy: 0.4880480874145255
Energy: 0.5450293293195512
Energy: 0.4880480874145255
Energy: 0.4947321201721079
Energy: 0.5181081577242329
Energy: 0.4947321201721079
Energy: 0.5181081577242329
Energy: 0.49473212017244994
Energy: 0.5181081577242329
Energy: 0.5743192306801025
Energy: 0.49144100025209914
Energy: 0.5743192306828392
Energy: 0.49144100025244125
Energy: 0.574319230681813
Energy: 0.49144100025244125
Energy: 0.5790938317322882
Energy: 0.6005605304914534
Energy: 0.5790938317316039
Energy: 0.6005605304921375
Energy: 0.5790938317319461
Energy: 0.6005605304921375
Energy: 0.5442473605688742
Energy: 0.5401864057377499
Energy: 0.5442473605699006
Energy: 0.5401864057387762
Energy: 0.5442473605692163
Energy: 0.5401864057387762
Energy: 0.49536497816117936
Energy: 0.5381019968494468
Energy: 0.49536497816083724
Energy: 0.5381019968508153
Energy: 0.49536497816117936
Energy: 0.5381019968504731
Energy: 0.5921929411849601
Energy: 0.5898281854401086
Energy: 0.5921929411849601
Energy: 0.5898281854397666
Energy: 0.5921929411849601
Energy: 0.5898281854401086
Energy: 0.540266679456633
Energy: 0.49539805004709303
Energy: 0.540266679456633
Energy: 0.49539805004709303
Energy: 0.540266679456633
Energy: 0.49539805004709303
Energy: 0.5413854736212875
Energy: 0.5435996115922935
Energy: 0.5413854736209455
Energy: 0.5435996115926356
Energy: 0.5413854736206034
Energy: 0.5435996115926356
Energy: 0.5980465029995231
Energy: 0.574917516361762
Energy: 0.5980465029998652
Energy: 0.5749175163614199
Energy: 0.5980465029998652
Energy: 0.574917516361762
Energy: 0.49124079928481695
Energy: 0.5744979515112667
Energy: 0.4912407992851592
Energy: 0.5744979515092141
Energy: 0.4912407992851592
Energy: 0.5744979515068195
Energy: 0.539728144280351
Energy: 0.49633785777067435
Energy: 0.539728144280351
Energy: 0.49633785777067435
Energy: 0.5397281442824035
Energy: 0.49633785777067435
Energy: 0.48724018664935864
Energy: 0.5456374221633656
Energy: 0.48724018664935864
Energy: 0.5456374221684971
Energy: 0.48724018664970076
Energy: 0.5456374221643919
Energy: 0.5443458347658191
Energy: 0.5401363653281855
Energy: 0.5443458347572668
Energy: 0.5401363653285276
Energy: 0.5443458347589772
Energy: 0.5401363653285276
Energy: 0.4956696147982768
Energy: 0.540228553428459
Energy: 0.4956696147979347
Energy: 0.5402285534311957
Energy: 0.49566961479861893
Energy: 0.5402285534311957
Energy: 0.5736785039748429
Energy: 0.5855904295819367
Energy: 0.5736785039748429
Energy: 0.5855904295812526
Energy: 0.5736785039751849
Energy: 0.5855904295812526
Energy: 0.5737328489957234
Energy: 0.5855910521719648
Energy: 0.5737328489957234
Energy: 0.5855910521712807
Energy: 0.5737328489946971
Energy: 0.5855910521702544
Energy: 0.49564559483652615
Energy: 0.5401118180199107
Energy: 0.49564559483652615
Energy: 0.5401118180192265
Energy: 0.49564559483652615
Energy: 0.5401118180195686
Energy: 0.5452579401494321
Energy: 0.5400393488351379
Energy: 0.5452579401559007
Energy: 0.5400393488351379
Energy: 0.5452579401538482
Energy: 0.5400393488354801
Energy: 0.4872255803124915
Energy: 0.5452900461671334
Energy: 0.4872255803124915
Energy: 0.5452900461630282
Energy: 0.4872255803128336
Energy: 0.5452900461650808
Energy: 0.5396936973843788
Energy: 0.49631920823330705
Energy: 0.5396936973847208
Energy: 0.49631920823330705
Energy: 0.5396936973864314
Energy: 0.49631920823330705
Energy: 0.49127868365794897
Energy: 0.5744418790756992
Energy: 0.49127868365726474
Energy: 0.574441879078436
Energy: 0.49127868365794897
Energy: 0.5744418790791201
Energy: 0.5980410726981732
Energy: 0.5749261111122792
Energy: 0.5980410726985153
Energy: 0.5749261111119371
Energy: 0.5980410726981732
Energy: 0.5749261111122792
Energy: 0.5412185278823022
Energy: 0.5435808608390328
Energy: 0.5412185278823022
Energy: 0.5435808608393748
Energy: 0.5412185278826442
Energy: 0.5435808608386906
Energy: 0.540140983215884
Energy: 0.49535920964378166
Energy: 0.5401409832162262
Energy: 0.49535920964378166
Energy: 0.5401409832151999
Energy: 0.49535920964378166
Energy: 0.5921798574593098
Energy: 0.5898196831171861
Energy: 0.5921798574593098
Energy: 0.5898196831171861
Energy: 0.5921798574593098
Energy: 0.5898196831171861
Energy: 0.49535250815966514
Energy: 0.5384204144142204
Energy: 0.49535250815966514
Energy: 0.5384204144131941
Energy: 0.49535250815966514
Energy: 0.5384204144152467
Energy: 0.5442134119604071
Energy: 0.5403888202385593
Energy: 0.544213411960065
Energy: 0.5403888202389013
Energy: 0.544213411959723
Energy: 0.5403888202382172
Energy: 0.5789270134311274
Energy: 0.6005583510284828
Energy: 0.5789270134311274
Energy: 0.6005583510288248
Energy: 0.5789270134314695
Energy: 0.600558351029167
Energy: 0.5743040015377806
Energy: 0.4915556973966809
Energy: 0.5743040015360702
Energy: 0.49155569739633875
Energy: 0.574304001535386
Energy: 0.49155569739633875
Energy: 0.49472051023607033
Energy: 0.5181225902971931
Energy: 0.4947205102364125
Energy: 0.5181225902975352
Energy: 0.4947205102364125
Energy: 0.5181225902971931

minimum gb energy = 0.4872255803124915 eV
minimum distance =  2.6930960981845 Angstroms
sigma value = 51


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

Energy: 0.567333775094223
Energy: 0.5747716548028122
Energy: 0.567333775094223
Energy: 0.5747716548020196
Energy: 0.567333775094223
Energy: 0.5747716548020196
Energy: 0.6083101267710348
Energy: 0.5431290393277618
Energy: 0.6083101267702422
Energy: 0.5431290393277618
Energy: 0.6083101267710348
Energy: 0.5431290393277618
Energy: 0.5282784450172818
Energy: 0.5732443944681674
Energy: 0.5282784450180744
Energy: 0.5732443944673747
Energy: 0.5282784450180744
Energy: 0.5732443944673747
Energy: 0.5660612909468439
Energy: 0.5066353472431298
Energy: 0.5660612909468439
Energy: 0.5066353472431298
Energy: 0.5660612909468439
Energy: 0.5066353472431298
Energy: 0.5754169497623138
Energy: 0.550216055283785
Energy: 0.5754169497623138
Energy: 0.550216055283785
Energy: 0.5754169497623138
Energy: 0.550216055283785
Energy: 0.5739908983335784
Energy: 0.5501229950041121
Energy: 0.5739908983335784
Energy: 0.5501229950041121
Energy: 0.5739908983335784
Energy: 0.5501229950049048
Energy: 0.5533572161696115
Energy: 0.5500318017642052
Energy: 0.5533572161696115
Energy: 0.5500318017642052
Energy: 0.5533572161696115
Energy: 0.5500318017642052
Energy: 0.5245446353927914
Energy: 0.5503636537149461
Energy: 0.5245446353919987
Energy: 0.5503636537149461
Energy: 0.5245446353927914
Energy: 0.5503636537149461
Energy: 0.6442663457309471
Energy: 0.5046263465992414
Energy: 0.6442663457301546
Energy: 0.5046263465992414
Energy: 0.6442663457301546
Energy: 0.5046263465992414
Energy: 0.5182643750920655
Energy: 0.5836133442007861
Energy: 0.5182643750920655
Energy: 0.5836133442023714
Energy: 0.5182643750920655
Energy: 0.583613344203164
Energy: 0.6028809142494671
Energy: 0.5035716220628672
Energy: 0.6028809142494671
Energy: 0.5035716220628672
Energy: 0.6028809142494671
Energy: 0.5035716220628672
Energy: 0.5688974815517174
Energy: 0.5764642843581045
Energy: 0.5688974815517174
Energy: 0.5764642843581045
Energy: 0.5688974815509247
Energy: 0.5764642843581045
Energy: 0.6075616592872539
Energy: 0.5427385073410262
Energy: 0.6075616592880465
Energy: 0.5427385073410262
Energy: 0.6075616592888391
Energy: 0.5427385073410262
Energy: 0.5437967437270902
Energy: 0.5323225199003162
Energy: 0.5437967437278827
Energy: 0.5323225199011088
Energy: 0.5437967437278827
Energy: 0.5323225199003162
Energy: 0.5662097908193687
Energy: 0.5728753334369582
Energy: 0.5662097908193687
Energy: 0.5728753334369582
Energy: 0.5662097908193687
Energy: 0.5728753334369582
Energy: 0.5738600097500302
Energy: 0.5500196461323471
Energy: 0.5738600097500302
Energy: 0.5500196461323471
Energy: 0.5738600097500302
Energy: 0.5500196461331397
Energy: 0.5744809189218161
Energy: 0.5908492007657268
Energy: 0.5744809189210234
Energy: 0.5908492007657268
Energy: 0.5744809189210234
Energy: 0.5908492007657268
Energy: 0.5663129969488977
Energy: 0.5525214442936263
Energy: 0.5663129969488977
Energy: 0.5525214442936263
Energy: 0.5663129969488977
Energy: 0.5525214442936263

minimum gb energy = 0.5035716220628672 eV
minimum distance =  2.58083113275495 Angstroms
sigma value = 19


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

Energy: 0.5092111519411636
Energy: 0.518961690441534
Energy: 0.48078540835955275
Energy: 0.5189616904420042
Energy: 0.5092111519411636
Energy: 0.5189616904434147
Energy: 0.5582912692195926
Energy: 0.5703241454041481
Energy: 0.5582912692191225
Energy: 0.5703241454041481
Energy: 0.5582912692195926
Energy: 0.5703241454036778
Energy: 0.48864407152748823
Energy: 0.5029179067912323
Energy: 0.48864407152795836
Energy: 0.5029179067912323
Energy: 0.48864407152748823
Energy: 0.5029179067898218
Energy: 0.5365633634599587
Energy: 0.4886284776501898
Energy: 0.5365633634590183
Energy: 0.4886284776501898
Energy: 0.5365633634604288
Energy: 0.48862847765113016
Energy: 0.5035732844668439
Energy: 0.4795459029720979
Energy: 0.5035732844659034
Energy: 0.4795459029720979
Energy: 0.5035732844668439
Energy: 0.47954590297256805
Energy: 0.4744838678218195
Energy: 0.47961575734549267
Energy: 0.4744838678213493
Energy: 0.47961575734549267
Energy: 0.4744838678218195
Energy: 0.47961575734596285
Energy: 0.5030374296158715
Energy: 0.48867052363654834
Energy: 0.5030374296163416
Energy: 0.48867052363607816
Energy: 0.5030374296158715
Energy: 0.4886705236370185
Energy: 0.4886115573249017
Energy: 0.5984144584244782
Energy: 0.48860998633675246
Energy: 0.5984144584258887
Energy: 0.4886115573249017
Energy: 0.5984144584244782
Energy: 0.55446922701914
Energy: 0.5827956309649168
Energy: 0.5544692270196102
Energy: 0.5827956309653871
Energy: 0.5544692270196102
Energy: 0.5827956309667975
Energy: 0.48078540835955275
Energy: 0.5189616904420042
Energy: 0.48078540835955275
Energy: 0.5189616904420042
Energy: 0.48078540835955275
Energy: 0.5189616904434147
Energy: 0.5582912692195926
Energy: 0.5703241454032076
Energy: 0.5582912692191225
Energy: 0.5703241454032076
Energy: 0.5582912692195926
Energy: 0.5703241454022674
Energy: 0.48864407152795836
Energy: 0.5029179067912323
Energy: 0.48864407152842854
Energy: 0.5029179067912323
Energy: 0.48864407152795836
Energy: 0.5029179067898218
Energy: 0.5365633634604288
Energy: 0.48863571636687375
Energy: 0.5365633634599587
Energy: 0.48863571636687375
Energy: 0.5365633634604288
Energy: 0.4886357163659334
Energy: 0.503573284467314
Energy: 0.47954590297303823
Energy: 0.5035732844668439
Energy: 0.47954590297256805
Energy: 0.503573284467314
Energy: 0.47954590297256805
Energy: 0.4744838678218195
Energy: 0.47961575734549267
Energy: 0.4744838678213493
Energy: 0.47961575734549267
Energy: 0.4744838678218195
Energy: 0.47961575734596285
Energy: 0.5030374296158715
Energy: 0.48867052363560803
Energy: 0.5030374296172819
Energy: 0.48867052363560803
Energy: 0.5030374296158715
Energy: 0.48867052363654834
Energy: 0.4886165269587121
Energy: 0.5984144584230677
Energy: 0.4886031161374546
Energy: 0.598414458424008
Energy: 0.4886165269587121
Energy: 0.598414458424008
Energy: 0.5311049971378218
Energy: 0.5827956309663274
Energy: 0.5544692270210206
Energy: 0.5827956309663274
Energy: 0.5311049971364113
Energy: 0.5827956309686568
Energy: 0.509211151942574
Energy: 0.5189616904424742
Energy: 0.48078540835955275
Energy: 0.5189616904424742
Energy: 0.509211151942574
Energy: 0.5189616904438848
Energy: 0.5582912692200629
Energy: 0.5703241454032076
Energy: 0.5582912692191225
Energy: 0.5703241454036778
Energy: 0.5582912692200629
Energy: 0.5703241454022674
Energy: 0.48864407152842854
Energy: 0.5029179067921726
Energy: 0.48864407152936884
Energy: 0.5029179067912323
Energy: 0.48864407152842854
Energy: 0.5029179067888816
Energy: 0.5365633634608776
Energy: 0.4886284776497196
Energy: 0.5365633634604288
Energy: 0.4886284776497196
Energy: 0.5365633634608776
Energy: 0.4886284776497196
Energy: 0.503573284467314
Energy: 0.4795459029716277
Energy: 0.503573284467314
Energy: 0.4795459029716277
Energy: 0.5035732844677842
Energy: 0.4795459029720979
Energy: 0.4744838678213493
Energy: 0.47961575734596285
Energy: 0.4744838678208792
Energy: 0.47961575734549267
Energy: 0.4744838678213493
Energy: 0.4796157573464331
Energy: 0.5030374296154013
Energy: 0.48867052363654834
Energy: 0.5030374296163416
Energy: 0.48867052363654834
Energy: 0.5030374296154013
Energy: 0.4886705236379588
Energy: 0.4886115573263122
Energy: 0.5984144584225976
Energy: 0.4886099863372012
Energy: 0.598414458424008
Energy: 0.4886115573263122
Energy: 0.5984144584235378
Energy: 0.5544692270182211
Energy: 0.5827956309644468
Energy: 0.55446922701914
Energy: 0.5827956309644468
Energy: 0.5544692270186913
Energy: 0.5827956309672677
Energy: 0.48078540835955275
Energy: 0.5189616904424742
Energy: 0.48078540835955275
Energy: 0.5189616904424742
Energy: 0.48078540835955275
Energy: 0.5189616904438848
Energy: 0.5582912692200629
Energy: 0.5703241454027375
Energy: 0.5582912692191225
Energy: 0.5703241454027375
Energy: 0.5582912692200629
Energy: 0.5703241454017972
Energy: 0.48864407152795836
Energy: 0.5029179067912323
Energy: 0.48864407152842854
Energy: 0.5029179067926429
Energy: 0.48864407152795836
Energy: 0.5029179067921726

minimum gb energy = 0.4744838678208792 eV
minimum distance =  2.69819216809943 Angstroms
sigma value = 27


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

Energy: 0.471910927679053
Energy: 0.4585973382949974
Energy: 0.471910927679053
Energy: 0.4585973382949974
Energy: 0.471910927679053
Energy: 0.4585973382949974
Energy: 0.5381872960657194
Energy: 0.4755989261767607
Energy: 0.5381872960611127
Energy: 0.4755989261767607
Energy: 0.5381872960645677
Energy: 0.4755989261767607
Energy: 0.4760163155542808
Energy: 0.5246609298205003
Energy: 0.47601631555312907
Energy: 0.5246609298193486
Energy: 0.47601631555197743
Energy: 0.5246609298193486
Energy: 0.5267039576886653
Energy: 0.4462717359556986
Energy: 0.5267039576898169
Energy: 0.4462717359556986
Energy: 0.5267039576898169
Energy: 0.4462717359556986
Energy: 0.5250192853199758
Energy: 0.44617345237878525
Energy: 0.5250192853211274
Energy: 0.4461734523776336
Energy: 0.5250192853199758
Energy: 0.44617345237878525
Energy: 0.5305240175788526
Energy: 0.5529290420244872
Energy: 0.5305240175788526
Energy: 0.5529290420244872
Energy: 0.5305240175788526
Energy: 0.5529290420256389
Energy: 0.4962821479451336
Energy: 0.4779233827611403
Energy: 0.4962821479462852
Energy: 0.4779233827611403
Energy: 0.4962821479462852
Energy: 0.4779233827611403
Energy: 0.4695963538565182
Energy: 0.4607532579374841
Energy: 0.4695963538565182
Energy: 0.4607532579374841
Energy: 0.4695963538553665
Energy: 0.4607532579374841
Energy: 0.53757638529141
Energy: 0.4766886844254044
Energy: 0.5375763852902584
Energy: 0.4766886844254044
Energy: 0.5375763852902584
Energy: 0.47668868442655604
Energy: 0.5130290094669856
Energy: 0.5326961697627386
Energy: 0.5130290094669856
Energy: 0.5326961697604351
Energy: 0.5130290094669856
Energy: 0.5326961697615868
Energy: 0.4589386863880592
Energy: 0.44658418349773965
Energy: 0.4589386863880592
Energy: 0.44658418349773965
Energy: 0.4589386863880592
Energy: 0.44658418349773965
Energy: 0.5495933426765821
Energy: 0.5048069687409205
Energy: 0.5495933426765821
Energy: 0.5048069687409205
Energy: 0.5495933426765821
Energy: 0.5048069687409205

minimum gb energy = 0.4461734523776336 eV
minimum distance =  2.57236775528647 Angstroms
sigma value = 9


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

Energy: 0.46530224887842264
Energy: 0.45070002193766656
Energy: 0.4653022488777755
Energy: 0.4507000219379902
Energy: 0.4653022488787462
Energy: 0.4507000219379902
Energy: 0.45224252457346237
Energy: 0.43512071199778046
Energy: 0.45224252457928693
Energy: 0.43512071199778046
Energy: 0.4522425245724916
Energy: 0.43512071199778046
Energy: 0.414174136623478
Energy: 0.4579423585113338
Energy: 0.41417413662444874
Energy: 0.4579423585113338
Energy: 0.4141741366228308
Energy: 0.45794235851198095
Energy: 0.42555149518771707
Energy: 0.4158280620576398
Energy: 0.42555149518868784
Energy: 0.4158280620576398
Energy: 0.4255514951883642
Energy: 0.4158280620576398
Energy: 0.4537804042981313
Energy: 0.44082902984230066
Energy: 0.4537804042978078
Energy: 0.44082902984230066
Energy: 0.4537804042981313
Energy: 0.44082902984230066
Energy: 0.4583806474975816
Energy: 0.45158445695534155
Energy: 0.45838064749790525
Energy: 0.45158445695534155
Energy: 0.45838064749725804
Energy: 0.4515844569556651
Energy: 0.4308393096994639
Energy: 0.47271546656139507
Energy: 0.43083930969914036
Energy: 0.47271546656139507
Energy: 0.43083930969914036
Energy: 0.4727154665617186
Energy: 0.40063899679886367
Energy: 0.456833188777225
Energy: 0.4006389967995108
Energy: 0.45683318877754864
Energy: 0.40063899679918724
Energy: 0.456833188777225
Energy: 0.45936661165317677
Energy: 0.4407449557674009
Energy: 0.459366611652206
Energy: 0.4407449557674009
Energy: 0.459366611652206
Energy: 0.4407449557674009
Energy: 0.4546372858265403
Energy: 0.4893167192315625
Energy: 0.45463728582880536
Energy: 0.48931671923253334
Energy: 0.45463728582848173
Energy: 0.48931671923123893
Energy: 0.4261920248764132
Energy: 0.41289046346546954
Energy: 0.426192024875766
Energy: 0.41289046346546954
Energy: 0.4261920248767368
Energy: 0.41289046346546954
Energy: 0.43274771877349794
Energy: 0.46351792919707857
Energy: 0.43274771877382157
Energy: 0.46351792919772566
Energy: 0.43274771877252716
Energy: 0.46351792919837287
Energy: 0.4445463585507003
Energy: 0.4427057180549466
Energy: 0.4445463585494059
Energy: 0.4427057180549466
Energy: 0.44454635855005314
Energy: 0.4427057180549466
Energy: 0.46320040107759797
Energy: 0.42273768947488205
Energy: 0.46320040107662713
Energy: 0.4227376894768235
Energy: 0.4632004010779215
Energy: 0.4227376894768235
Energy: 0.41679589978529547
Energy: 0.45786665044001856
Energy: 0.4167958997846483
Energy: 0.45786665044001856
Energy: 0.4167958997849719
Energy: 0.4578666504403421
Energy: 0.41902553481147214
Energy: 0.4314878425080227
Energy: 0.41902553481114857
Energy: 0.43148784250769906
Energy: 0.41902553481211935
Energy: 0.43148784250737554
Energy: 0.5297740316053405
Energy: 0.40976925968710237
Energy: 0.5297740316059878
Energy: 0.40976925968710237
Energy: 0.5297740316053405
Energy: 0.40976925968710237
Energy: 0.4252488726028789
Energy: 0.43741500680374856
Energy: 0.4252488726038497
Energy: 0.43741500680374856
Energy: 0.4252488726038497
Energy: 0.43741500680374856
Energy: 0.4038048790623369
Energy: 0.5335757525090407
Energy: 0.40380487906104257
Energy: 0.5335757525090407
Energy: 0.40380487906298407
Energy: 0.5335757525096878
Energy: 0.488511372097571
Energy: 0.40718603246880664
Energy: 0.48851137209854184
Energy: 0.407186032468483
Energy: 0.4885113720982182
Energy: 0.40718603246880664
Energy: 0.40314387021281783
Energy: 0.5334682735596279
Energy: 0.4031438702131414
Energy: 0.5334682735589806
Energy: 0.40314387021378856
Energy: 0.5334682735570391
Energy: 0.4250687107094682
Energy: 0.4374337126779024
Energy: 0.42506871070979185
Energy: 0.43743371267822595
Energy: 0.42506871070914465
Energy: 0.43743371267822595
Energy: 0.5297284225799898
Energy: 0.40951109185366236
Energy: 0.5297284225799898
Energy: 0.4095110918530152
Energy: 0.529728422579019
Energy: 0.40951109185430956
Energy: 0.41906193612515397
Energy: 0.454809715849835
Energy: 0.4190619361241832
Energy: 0.4548097158504822
Energy: 0.4190619361241832
Energy: 0.4548097158504822
Energy: 0.4167787796719219
Energy: 0.4578897200495909
Energy: 0.41677877967159827
Energy: 0.4578897200495909
Energy: 0.41677877967159827
Energy: 0.4578897200495909
Energy: 0.46317512074280487
Energy: 0.4537809964841845
Energy: 0.4631751207421576
Energy: 0.4537809964841845
Energy: 0.46317512074248124
Energy: 0.45378099648386094
Energy: 0.4444545505492729
Energy: 0.4427931835823783
Energy: 0.44445455054992006
Energy: 0.44279318358270187
Energy: 0.44445455054797856
Energy: 0.44279318358270187
Energy: 0.43273397241398387
Energy: 0.4400731666326783
Energy: 0.43273397241430744
Energy: 0.4400731666330019
Energy: 0.43273397241430744
Energy: 0.4400731666320311
Energy: 0.4263159085522444
Energy: 0.4128026694793918
Energy: 0.42631590855159723
Energy: 0.4128026694793918
Energy: 0.42631590855095003
Energy: 0.4128026694793918
Energy: 0.45459588129644785
Energy: 0.42841083487992293
Energy: 0.4545958812958007
Energy: 0.4284108348844238
Energy: 0.4545958812977422
Energy: 0.4284108348847474
Energy: 0.45925494826379254
Energy: 0.4410797547463659
Energy: 0.45925494826411617
Energy: 0.4410797547463659
Energy: 0.4592549482647633
Energy: 0.4410797547463659
Energy: 0.40057052876703114
Energy: 0.45656471026384793
Energy: 0.4005705287676783
Energy: 0.45656471026384793
Energy: 0.4005705287660604
Energy: 0.45656471026417145
Energy: 0.4308803634042819
Energy: 0.4726100831535853
Energy: 0.4308803634029875
Energy: 0.4726100831535853
Energy: 0.43088036340266395
Energy: 0.4726100831539089
Energy: 0.4583202985736436
Energy: 0.4464339138922227
Energy: 0.45832029857202566
Energy: 0.4464339138915755
Energy: 0.45832029857170203
Energy: 0.44643391389060477
Energy: 0.4538265820985363
Energy: 0.4406584673968795
Energy: 0.4538265820988599
Energy: 0.4406584673968795
Energy: 0.4538265820985363
Energy: 0.4406584673968795
Energy: 0.42554192165616284
Energy: 0.41070042954926167
Energy: 0.42554192165616284
Energy: 0.4107004295489381
Energy: 0.42554192165551563
Energy: 0.4107004295489381
Energy: 0.41416278188960665
Energy: 0.4579176460592231
Energy: 0.4141627818899303
Energy: 0.4579176460588995
Energy: 0.4141627818899303
Energy: 0.4579176460592231
Energy: 0.45283210531130563
Energy: 0.40892810928286516
Energy: 0.4528321053096877
Energy: 0.4089281092825416
Energy: 0.45283210530904044
Energy: 0.4089281092825416
Energy: 0.46530224887648103
Energy: 0.45070002193863734
Energy: 0.46530224887551025
Energy: 0.45070002193863734
Energy: 0.4653022488761575
Energy: 0.45070002193863734
Energy: 0.4522425245789633
Energy: 0.43512071200069274
Energy: 0.4522425245786397
Energy: 0.43512071200069274
Energy: 0.4522425245809049
Energy: 0.4351207120010163
Energy: 0.41417413662541946
Energy: 0.45794235851003945
Energy: 0.41417413662606667
Energy: 0.4579423585113338
Energy: 0.41417413662541946
Energy: 0.4579423585129517
Energy: 0.42555149518868784
Energy: 0.4158280620586106
Energy: 0.42555149518933494
Energy: 0.4158280620586106
Energy: 0.4255514951896585
Energy: 0.41582806205828704
Energy: 0.4537804042987786
Energy: 0.44082902984068273
Energy: 0.4537804042981313
Energy: 0.44082902984132993
Energy: 0.4537804042991021
Energy: 0.44082902984132993

minimum gb energy = 0.4005705287660604 eV
minimum distance =  2.63400968077321 Angstroms
sigma value = 57


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

Energy: 0.2053808005837514
Energy: 0.21007051685863734
Energy: 0.20538080058301475
Energy: 0.21007051685863734
Energy: 0.20538080058301475
Energy: 0.21007051685863734
Energy: 0.25881780738238996
Energy: 0.20629147814733417
Energy: 0.25881780738238996
Energy: 0.20629147814659762
Energy: 0.25881780738238996
Energy: 0.20629147814733417
Energy: 0.2297136807049237
Energy: 0.2531467009018154
Energy: 0.2297136807049237
Energy: 0.2531467009018154
Energy: 0.22971368070418713
Energy: 0.2531467009018154
Energy: 0.21151316163588174
Energy: 0.20528709821879026
Energy: 0.21151316163809156
Energy: 0.20528709821952687
Energy: 0.21151316163809156
Energy: 0.20528709822026348
Energy: 0.25867087382359805
Energy: 0.26163295325099944
Energy: 0.25867087382359805
Energy: 0.26163295325099944
Energy: 0.25867087382359805
Energy: 0.26163295325099944
Energy: 0.20547828814491595
Energy: 0.22993282395365738
Energy: 0.20547828814491595
Energy: 0.22993282395365738
Energy: 0.20547828814491595
Energy: 0.22993282395365738
Energy: 0.20539066694243274
Energy: 0.22991344362781005
Energy: 0.20539066694316935
Energy: 0.22991344362707342
Energy: 0.20539066694390598
Energy: 0.22991344362781005
Energy: 0.25864489858814455
Energy: 0.261593441968943
Energy: 0.2586448985888811
Energy: 0.261593441968943
Energy: 0.2586448985888811
Energy: 0.261593441968943
Energy: 0.2115166464079295
Energy: 0.20527581975399345
Energy: 0.21151664640571965
Energy: 0.20527581975325684
Energy: 0.21151664640571965
Energy: 0.20527581975325684
Energy: 0.22968665957551812
Energy: 0.25319697004892283
Energy: 0.22968665957551812
Energy: 0.25319697004965946
Energy: 0.22968665957551812
Energy: 0.25319697004892283
Energy: 0.2586002581744312
Energy: 0.20671402692215315
Energy: 0.25860025817516785
Energy: 0.2067140269258362
Energy: 0.25860025817516785
Energy: 0.20671402692362636
Energy: 0.20538080058301475
Energy: 0.21007051685716413
Energy: 0.20538080058301475
Energy: 0.21007051685937397
Energy: 0.20538080058301475
Energy: 0.21007051685937397
Energy: 0.25881780738238996
Energy: 0.206291478149544
Energy: 0.25881780738238996
Energy: 0.206291478149544
Energy: 0.25881780738238996
Energy: 0.2062914781488074
Energy: 0.2297136807049237
Energy: 0.2531467009018154
Energy: 0.2297136807049237
Energy: 0.2531467009018154
Energy: 0.2297136807049237
Energy: 0.2531467009018154
Energy: 0.2115131616395648
Energy: 0.20528709821879026
Energy: 0.2115131616395648
Energy: 0.20528709821952687
Energy: 0.2115131616395648
Energy: 0.20528709821952687
Energy: 0.2586708738228614
Energy: 0.26163295325099944
Energy: 0.2586708738228614
Energy: 0.26163295325099944
Energy: 0.25867087382359805
Energy: 0.26163295325099944
Energy: 0.20547828814491595
Energy: 0.2299328239529208
Energy: 0.20547828814491595
Energy: 0.22993282395365738
Energy: 0.20547828814491595
Energy: 0.2299328239529208
Energy: 0.20539066694390598
Energy: 0.22991344362707342
Energy: 0.20539066694316935
Energy: 0.22991344362781005
Energy: 0.20539066694316935
Energy: 0.22991344362707342
Energy: 0.25864489858814455
Energy: 0.261593441968943
Energy: 0.2586448985888811
Energy: 0.261593441968943
Energy: 0.25864489858814455
Energy: 0.261593441968943

minimum gb energy = 0.20527581975325684 eV
minimum distance =  2.74376040099539 Angstroms
sigma value = 11


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

Energy: 0.39446405665790707
Energy: 0.4452082695416063
Energy: 0.39446405665790707
Energy: 0.4452082695416063
Energy: 0.3944640566562883
Energy: 0.4452082695416063
Energy: 0.45296885997146275
Energy: 0.3876242925053733
Energy: 0.45296885997092323
Energy: 0.3876242925053733
Energy: 0.45296885997146275
Energy: 0.3876242925053733
Energy: 0.44792416427089593
Energy: 0.5090762247475977
Energy: 0.44792416426981685
Energy: 0.5090762247475977
Energy: 0.44792416427089593
Energy: 0.5090762247481372
Energy: 0.46151501036933296
Energy: 0.3503091146726566
Energy: 0.4615150103650164
Energy: 0.35030911467319614
Energy: 0.46151501036933296
Energy: 0.3503091146726566
Energy: 0.4257145389012502
Energy: 0.3381729752394735
Energy: 0.42571453890071065
Energy: 0.3381729752394735
Energy: 0.4257145389012502
Energy: 0.3381729752394735
Energy: 0.40942828259687714
Energy: 0.3458494871725863
Energy: 0.40942828259741665
Energy: 0.3458494871725863
Energy: 0.40942828259633757
Energy: 0.3458494871731259
Energy: 0.3338542597847507
Energy: 0.3682107581950546
Energy: 0.33385425978582983
Energy: 0.3682107581950546
Energy: 0.33385425978421107
Energy: 0.3682107581955941
Energy: 0.44474653115638507
Energy: 0.3235448138795154
Energy: 0.4447465311558455
Energy: 0.3235448138795154
Energy: 0.44474653115638507
Energy: 0.3235448138789758
Energy: 0.4408141524122968
Energy: 0.3257071479966123
Energy: 0.4408141524122968
Energy: 0.3257071479966123
Energy: 0.4408141524122968
Energy: 0.3257071479966123
Energy: 0.33112780484894366
Energy: 0.4791548038124525
Energy: 0.33112780484894366
Energy: 0.4791548038124525
Energy: 0.33112780484894366
Energy: 0.4791548038129921
Energy: 0.423246973950467
Energy: 0.4156340871457881
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Energy: 0.4156340871457881
Energy: 0.42324697395100663
Energy: 0.4156340871457881
Energy: 0.3863569273868539
Energy: 0.3399531778677369
Energy: 0.3863569273879331
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Energy: 0.3863569273868539
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Energy: 0.4520359299658004
Energy: 0.35276077696443237
Energy: 0.4520359299663399
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Energy: 0.4520359299663399
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Energy: 0.47978347489754325
Energy: 0.49445355263567536
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Energy: 0.49445355263513585
Energy: 0.4797834748970037
Energy: 0.49445355263567536
Energy: 0.46034848285758184
Energy: 0.38774805419120917
Energy: 0.4603484828570423
Energy: 0.38774805419120917
Energy: 0.46034848285758184
Energy: 0.3877480541917488
Energy: 0.3693897755332721
Energy: 0.4421316575867542
Energy: 0.36938977553381175
Energy: 0.4421316575867542
Energy: 0.3693897755332721
Energy: 0.4421316575867542
Energy: 0.39309734865796236
Energy: 0.3836676564211685
Energy: 0.39309734865850193
Energy: 0.3836676564211685
Energy: 0.3930973486590415
Energy: 0.3836676564200894
Energy: 0.5487241685528897
Energy: 0.4341201272286581
Energy: 0.5487241685534293
Energy: 0.43412012722919774
Energy: 0.5487241685534293
Energy: 0.43412012722919774
Energy: 0.4150679024072998
Energy: 0.34839862368467295
Energy: 0.41506790240622066
Energy: 0.3483986236835938
Energy: 0.4150679024072998
Energy: 0.34839862368521257
Energy: 0.34850243277816984
Energy: 0.39573307666121416
Energy: 0.34850243277709064
Energy: 0.39573307666067453
Energy: 0.3485024327787094
Energy: 0.39573307666067453
Energy: 0.33169697237421936
Energy: 0.3473471344028025
Energy: 0.3316969723736798
Energy: 0.3473471344028025
Energy: 0.33169697237421936
Energy: 0.3473471344028025
Energy: 0.35337146012371845
Energy: 0.36753076855913397
Energy: 0.353371460124258
Energy: 0.36753076856021305
Energy: 0.35337146012317894
Energy: 0.36753076855913397
Energy: 0.3989463916138506
Energy: 0.3980715281172741
Energy: 0.398946391613311
Energy: 0.3980715281167345
Energy: 0.3989463916138506
Energy: 0.3980715281172741
Energy: 0.44025711028838366
Energy: 0.34320110019075123
Energy: 0.4402571102889232
Energy: 0.3432011001918303
Energy: 0.4402571102873045
Energy: 0.34320110019129074
Energy: 0.33171369960807734
Energy: 0.47962158662456733
Energy: 0.3317136996075378
Energy: 0.47962158662456733
Energy: 0.33171369960807734
Energy: 0.47962158662456733
Energy: 0.6157718722896539
Energy: 0.4156355569114346
Energy: 0.6157718722891145
Energy: 0.41563555691197424
Energy: 0.6157718722891145
Energy: 0.4156355569125138

minimum gb energy = 0.3235448138789758 eV
minimum distance =  2.63368521459639 Angstroms
sigma value = 41


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

Energy: 0.4377700536920167
Energy: 0.37533763568883793
Energy: 0.4377700536920167
Energy: 0.37533763568883793
Energy: 0.4377700536920167
Energy: 0.37533763568883793
Energy: 0.4815342549863607
Energy: 0.453557964933157
Energy: 0.4815342549872113
Energy: 0.453557964933157
Energy: 0.4815342549863607
Energy: 0.453557964933157
Energy: 0.42934446399449394
Energy: 0.4341917342322089
Energy: 0.42934446399449394
Energy: 0.4341917342317837
Energy: 0.42934446399406867
Energy: 0.4341917342322089
Energy: 0.39333574244612346
Energy: 0.371110289281799
Energy: 0.3933357424452729
Energy: 0.3711102892813738
Energy: 0.39333574244654873
Energy: 0.3711102892822244
Energy: 0.36589979491089586
Energy: 0.39174741201060687
Energy: 0.36589979491132113
Energy: 0.3917474120101816
Energy: 0.36589979491132113
Energy: 0.3917474120101816
Energy: 0.4673988347001164
Energy: 0.45988777884659854
Energy: 0.4673988347001164
Energy: 0.45988777884659854
Energy: 0.4673988346996911
Energy: 0.4598877788474491
Energy: 0.36548592051646206
Energy: 0.5235729551590185
Energy: 0.36548592051731266
Energy: 0.5235729551585931
Energy: 0.36548592051646206
Energy: 0.5235729551585931
Energy: 0.35636443132135476
Energy: 0.37124216223411494
Energy: 0.35636443132135476
Energy: 0.3712421622332644
Energy: 0.35636443132135476
Energy: 0.3712421622336897
Energy: 0.36784112353894655
Energy: 0.38623807420696293
Energy: 0.36784112353894655
Energy: 0.38623807420696293
Energy: 0.36784112353894655
Energy: 0.38623807420696293
Energy: 0.3936200772180201
Energy: 0.4033465918254906
Energy: 0.39362007721759484
Energy: 0.4033465918254906
Energy: 0.3936200772180201
Energy: 0.4033465918254906
Energy: 0.39045463211709286
Energy: 0.40332809028014577
Energy: 0.39045463211751813
Energy: 0.40332809028014577
Energy: 0.39045463211666753
Energy: 0.40332809028014577
Energy: 0.3523568883020031
Energy: 0.44440748946292336
Energy: 0.3523568883020031
Energy: 0.44440748946292336
Energy: 0.3523568883024284
Energy: 0.44440748946292336
Energy: 0.35693525006159754
Energy: 0.3678176954701565
Energy: 0.35693525006074706
Energy: 0.3678176954705818
Energy: 0.35693525006117227
Energy: 0.3678176954701565
Energy: 0.34431505973426574
Energy: 0.40299246254943766
Energy: 0.34431505973426574
Energy: 0.402992462546886
Energy: 0.34431505973426574
Energy: 0.40299246254943766
Energy: 0.4668339162702616
Energy: 0.4592868117556621
Energy: 0.4668339162698363
Energy: 0.4592868117552368
Energy: 0.4668339162702616
Energy: 0.4592868117552368
Energy: 0.34356212047568274
Energy: 0.45472037770417645
Energy: 0.3435621204748322
Energy: 0.45472037770417645
Energy: 0.34356212047525747
Energy: 0.45472037770417645
Energy: 0.35975342699691115
Energy: 0.36792898313026606
Energy: 0.35975342699733637
Energy: 0.3679289831306913
Energy: 0.3597534269964858
Energy: 0.36792898313026606
Energy: 0.37261710153614913
Energy: 0.4350436064730913
Energy: 0.37261710153487326
Energy: 0.4350436064730913
Energy: 0.37261710153827543
Energy: 0.4350436064730913
Energy: 0.40112104519850195
Energy: 0.45226138441959335
Energy: 0.4011210451980766
Energy: 0.45226138441959335
Energy: 0.40112104519850195
Energy: 0.45226138441959335
Energy: 0.39017601836105187
Energy: 0.369274676512267
Energy: 0.39017601836105187
Energy: 0.36927467651651974
Energy: 0.3901760183614771
Energy: 0.3692746765156692
Energy: 0.37517643661509764
Energy: 0.39556730971580123
Energy: 0.37517643661552286
Energy: 0.3955673097179276
Energy: 0.37517643661552286
Energy: 0.3955673097247321
Energy: 0.38145615992748844
Energy: 0.5036784954603254
Energy: 0.3814561598743671
Energy: 0.5036784954607506
Energy: 0.3814561598786006
Energy: 0.5036784954603254
Energy: 0.39314172095698985
Energy: 0.3676042973399674
Energy: 0.39314172095698985
Energy: 0.3676042973399674
Energy: 0.39314172095698985
Energy: 0.3676042973399674
Energy: 0.34377417088738565
Energy: 0.43471395194323176
Energy: 0.3437741708869604
Energy: 0.4347139519453388
Energy: 0.34377417088738565
Energy: 0.4511228745909145
Energy: 0.3479519800298871
Energy: 0.46576161634728713
Energy: 0.3479519800298871
Energy: 0.46576161634983876
Energy: 0.3479519800298871
Energy: 0.4657616163502641
Energy: 0.3657638239565955
Energy: 0.36567580071022265
Energy: 0.3657638239565955
Energy: 0.36567580070894673
Energy: 0.3657638239565955
Energy: 0.36567580071064787
Energy: 0.35926650706043217
Energy: 0.367667220133619
Energy: 0.35926650706043217
Energy: 0.367667220133619
Energy: 0.3592665070608574
Energy: 0.3676672201331937
Energy: 0.3652069059729866
Energy: 0.3940218775670996
Energy: 0.3652069059725613
Energy: 0.3940218775670996
Energy: 0.3652069059725613
Energy: 0.4107806629865526
Energy: 0.3901022134054695
Energy: 0.4573757387181871
Energy: 0.39010221340589474
Energy: 0.4573757387181871
Energy: 0.3901022134054695
Energy: 0.4573757387181871
Energy: 0.4281653707571748
Energy: 0.34379927323519327
Energy: 0.4281653707592819
Energy: 0.34379927323519327
Energy: 0.4281653707592819
Energy: 0.343799273234768
Energy: 0.3542236386434722
Energy: 0.4432211262664126
Energy: 0.3542236386443229
Energy: 0.4432211262664126
Energy: 0.35422363864389755
Energy: 0.4432211262664126
Energy: 0.3697625690570058
Energy: 0.3822889783792891
Energy: 0.36976256905658045
Energy: 0.3822889783792891
Energy: 0.3697625690570058
Energy: 0.3822889783792891
Energy: 0.34756312578633997
Energy: 0.3772338936100692
Energy: 0.3475631257867653
Energy: 0.3772338936104944
Energy: 0.34756312578633997
Energy: 0.3772338936100692

minimum gb energy = 0.3435621204748322 eV
minimum distance =  2.6560552688993 Angstroms
sigma value = 33


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

Energy: 0.42607176204494485
Energy: 0.3865754059149527
Energy: 0.4260717620446463
Energy: 0.3865754059149527
Energy: 0.42607176204494485
Energy: 0.3865754059155497
Energy: 0.43221852924366316
Energy: 0.36965925903273206
Energy: 0.4322185292430663
Energy: 0.36965925903273206
Energy: 0.43221852924276777
Energy: 0.3696592590324336
Energy: 0.3980275181039196
Energy: 0.44363180464012847
Energy: 0.3980275181039196
Energy: 0.4436318046365468
Energy: 0.3980275181039196
Energy: 0.4436318046368454
Energy: 0.3968349086902971
Energy: 0.37979810083101523
Energy: 0.39683490869089394
Energy: 0.37979810083131366
Energy: 0.3968349086902971
Energy: 0.37979810083101523
Energy: 0.40128033182372
Energy: 0.40268078375554733
Energy: 0.4012803318234216
Energy: 0.40268078382685357
Energy: 0.4012803318234216
Energy: 0.40268078382416733
Energy: 0.5287742563115895
Energy: 0.39007745647481235
Energy: 0.528774256311291
Energy: 0.39007745647511083
Energy: 0.5287742563106941
Energy: 0.39007745647511083
Energy: 0.38558062277433935
Energy: 0.42325731802436045
Energy: 0.38558062277433935
Energy: 0.42325731802406197
Energy: 0.3855806227737425
Energy: 0.42325731802436045
Energy: 0.4141599343756214
Energy: 0.42156187260166916
Energy: 0.41415993437621823
Energy: 0.42156187260166916
Energy: 0.41415993437621823
Energy: 0.42156187260166916
Energy: 0.44546491054014165
Energy: 0.40055740543577656
Energy: 0.4454649105413355
Energy: 0.40055740543547813
Energy: 0.4454649105398432
Energy: 0.40055740543577656
Energy: 0.555139014782636
Energy: 0.38141162475541285
Energy: 0.555139014782636
Energy: 0.38141162475571133
Energy: 0.5551390147823377
Energy: 0.38141162475541285
Energy: 0.407416070764953
Energy: 0.40662521561606446
Energy: 0.407416070764953
Energy: 0.4066252156166614
Energy: 0.407416070764953
Energy: 0.40662521561695986
Energy: 0.6410521136239455
Energy: 0.3799878812357594
Energy: 0.6410521136233486
Energy: 0.3799878812351624
Energy: 0.6410521136233486
Energy: 0.37998788123546084
Energy: 0.4008247118849388
Energy: 0.44602687992183615
Energy: 0.4008247118864311
Energy: 0.44602687992303003
Energy: 0.4008247118846403
Energy: 0.44602687992273155
Energy: 0.4172767229702942
Energy: 0.4111041810036317
Energy: 0.4172767229702942
Energy: 0.4111041810033333
Energy: 0.4172767229696973
Energy: 0.4111041810036317
Energy: 0.41133465062215424
Energy: 0.38468191447252503
Energy: 0.4113346506233481
Energy: 0.3846819144713311
Energy: 0.4113346506230497
Energy: 0.3846819144733933
Energy: 0.3933365278962351
Energy: 0.530878040491788
Energy: 0.39333652789593665
Energy: 0.530878040491788
Energy: 0.3933365278956381
Energy: 0.5308780404920864
Energy: 0.4213754147195574
Energy: 0.3748140897887262
Energy: 0.42137541470821577
Energy: 0.3748140897884278
Energy: 0.42137541471030504
Energy: 0.3748140897887262
Energy: 0.3777572964039731
Energy: 0.3948252135893395
Energy: 0.37775729640367467
Energy: 0.3948252135893395
Energy: 0.3777572964042716
Energy: 0.3948252135893395
Energy: 0.4452121857078087
Energy: 0.397458799575382
Energy: 0.44521218570900256
Energy: 0.39745879957627733
Energy: 0.4452121857078087
Energy: 0.3974587995735911
Energy: 0.4202367133007736
Energy: 0.40696516539240646
Energy: 0.4202367132945058
Energy: 0.4069651653927049
Energy: 0.42023671329898277
Energy: 0.4069651653927049
Energy: 0.3754246206537006
Energy: 0.41063192544906685
Energy: 0.37542462065668514
Energy: 0.4106319254487684
Energy: 0.3754246206537006
Energy: 0.4106319254487684
Energy: 0.3673218430730224
Energy: 0.43028164057849955
Energy: 0.36732184307242544
Energy: 0.43028164057760415
Energy: 0.36732184307272386
Energy: 0.43028164057849955
Energy: 0.411769846528058
Energy: 0.3642436889946008
Energy: 0.4117698465253718
Energy: 0.3642436889946008
Energy: 0.41176984652775955
Energy: 0.3642436889946008
Energy: 0.3832974998099104
Energy: 0.3927915427717744
Energy: 0.3832974998105073
Energy: 0.39279154277087897
Energy: 0.3832974998102089
Energy: 0.39279154277117756
Energy: 0.40228438918633797
Energy: 0.3749233504851518
Energy: 0.40228438918872567
Energy: 0.3749233504854503
Energy: 0.4022843891839502
Energy: 0.3749233504854503
Energy: 0.38827445260706633
Energy: 0.5273088383154014
Energy: 0.388274452606171
Energy: 0.5273088383148046
Energy: 0.388274452606171
Energy: 0.5273088383151031
Energy: 0.4288499595012864
Energy: 0.3872779750138029
Energy: 0.4288499595009879
Energy: 0.3872779750135044
Energy: 0.42884995950158483
Energy: 0.3872779750138029
Energy: 0.41963569644601934
Energy: 0.3837720395390394
Energy: 0.41963569644601934
Energy: 0.3837720395390394
Energy: 0.41963569644631776
Energy: 0.3837720395390394
Energy: 0.40145884907833457
Energy: 0.4460574802060803
Energy: 0.4014588490777376
Energy: 0.44605748020757263
Energy: 0.40145884907833457
Energy: 0.44605748020578184
Energy: 0.37980742526673855
Energy: 0.5531894359251014
Energy: 0.3798074252661416
Energy: 0.553189435924803
Energy: 0.3798074252655447
Energy: 0.5531894359251014
Energy: 0.39311518886925073
Energy: 0.3760763570828248
Energy: 0.393115188870146
Energy: 0.37607635708312326
Energy: 0.39311518886954916
Energy: 0.3760763570828248
Energy: 0.38359232183883585
Energy: 0.5419631767844761
Energy: 0.3835923218391343
Energy: 0.5419631767826854
Energy: 0.38359232183883585
Energy: 0.5419631767820885
Energy: 0.41970078133478644
Energy: 0.39804786495403677
Energy: 0.41970078133329414
Energy: 0.39804786495373834
Energy: 0.41970078133717414
Energy: 0.39804786495373834
Energy: 0.4086511978968085
Energy: 0.41397861881057857
Energy: 0.4086511978971069
Energy: 0.41397861881028014
Energy: 0.4086511978971069
Energy: 0.41397861881057857
Energy: 0.4087191497425073
Energy: 0.41419477947830996
Energy: 0.4087191497428057
Energy: 0.41419477947860855
Energy: 0.4087191497439996
Energy: 0.41419477947830996
Energy: 0.4204077920654039
Energy: 0.3980190637903191
Energy: 0.42040779206480694
Energy: 0.3980190637900206
Energy: 0.4204077920594345
Energy: 0.3980190637906175
Energy: 0.38352501460420885
Energy: 0.5425567288120295
Energy: 0.38352501460480576
Energy: 0.542556728807254
Energy: 0.38352501460361194
Energy: 0.5425567288081494
Energy: 0.39312623035479344
Energy: 0.37629764031494334
Energy: 0.39312623035479344
Energy: 0.37629764031524177
Energy: 0.3931262303559872
Energy: 0.37629764031494334
Energy: 0.37934950893181674
Energy: 0.5531356768621597
Energy: 0.37934950893181674
Energy: 0.5531356768627567
Energy: 0.37934950893181674
Energy: 0.5531356768627567
Energy: 0.4014402761517207
Energy: 0.44618738355488685
Energy: 0.4014402761517207
Energy: 0.44618738355220067
Energy: 0.4014402761523176
Energy: 0.44618738355488685
Energy: 0.41091954253731205
Energy: 0.3837031389926957
Energy: 0.4109195425370136
Energy: 0.3837031389926957
Energy: 0.41091954253731205
Energy: 0.3837031389926957
Energy: 0.4290056966441204
Energy: 0.38722302347642473
Energy: 0.42900569664501587
Energy: 0.38722302347672316
Energy: 0.4290056966444189
Energy: 0.38722302347642473
Energy: 0.3882173487977851
Energy: 0.5272202979349727
Energy: 0.38821734879748665
Energy: 0.5272202979349727
Energy: 0.3882173487977851
Energy: 0.5272202979352713
Energy: 0.40237768685012826
Energy: 0.3748479733698202
Energy: 0.40237768685099656
Energy: 0.3748479733698202
Energy: 0.40237768685012826
Energy: 0.3748479733701186
Energy: 0.38343585998602325
Energy: 0.3937369674447202
Energy: 0.3834358599869187
Energy: 0.39373696744442177
Energy: 0.3834358599854264
Energy: 0.39373696744979414
Energy: 0.41186231820277386
Energy: 0.36383212514028257
Energy: 0.4118623182030723
Energy: 0.36383212514237184
Energy: 0.41186231820277386
Energy: 0.3638321251429688
Energy: 0.36759446187392875
Energy: 0.43039398696567266
Energy: 0.36759446187303335
Energy: 0.43039398696358344
Energy: 0.3675944618733319
Energy: 0.43039398696388187

minimum gb energy = 0.36383212514028257 eV
minimum distance =  2.66003278171152 Angstroms
sigma value = 67


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

Energy: 0.44540868972365455
Energy: 0.4177689803596001
Energy: 0.4454086897238586
Energy: 0.4177689803596001
Energy: 0.4454086897238586
Energy: 0.4177689803596001
Energy: 0.4321963796696525
Energy: 0.37826349792770947
Energy: 0.4321963796692445
Energy: 0.37826349792791353
Energy: 0.43219637966944846
Energy: 0.37826349792770947
Energy: 0.4200900110842622
Energy: 0.4844065737233764
Energy: 0.42009001108467026
Energy: 0.4844065737233764
Energy: 0.4200900110810661
Energy: 0.4844065737233764
Energy: 0.43217680692907845
Energy: 0.3782776951444404
Energy: 0.43217680692907845
Energy: 0.3782776951444404
Energy: 0.43217680692907845
Energy: 0.3782776951444404
Energy: 0.445408689724652
Energy: 0.4177689803592146
Energy: 0.4454086897248559
Energy: 0.41776898035901067
Energy: 0.4454086897248559
Energy: 0.41776898035901067
Energy: 0.4321963796666604
Energy: 0.37826349792732417
Energy: 0.43219637966686447
Energy: 0.37826349792770947
Energy: 0.4321963796666604
Energy: 0.37826349792732417
Energy: 0.5381685354944653
Energy: 0.48440657372317236
Energy: 0.4200900110826755
Energy: 0.48440657372317236
Energy: 0.42009001108505556
Energy: 0.4844065737233764

minimum gb energy = 0.37826349792732417 eV
minimum distance =  2.66857306523504 Angstroms
sigma value = 3


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

Energy: 0.5809780551826148
Energy: 0.4725137131353535
Energy: 0.5809780551823681
Energy: 0.4725137131353535
Energy: 0.5809780551818251
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Energy: 0.4718319208022408
Energy: 0.448173098992701
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Energy: 0.4481730989919113
Energy: 0.4718319208027837
Energy: 0.4481730989929971
Energy: 0.5016959316978672
Energy: 0.5063704144887043
Energy: 0.5016959316970774
Energy: 0.506370414544327
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Energy: 0.4613938028558546
Energy: 0.4880828710676936
Energy: 0.4768938367705089
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Energy: 0.47747891653726515
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Energy: 0.47747891653647556
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Energy: 0.4573061883576811
Energy: 0.46209180636934244
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Energy: 0.46209180636879954
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Energy: 0.4499491747162787
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Energy: 0.4499491747141071
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Energy: 0.4499491747159826
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Energy: 0.46707853616802264
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Energy: 0.4789605224306612
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Energy: 0.48026335158459804
Energy: 0.519185488021429
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Energy: 0.45397107795737895
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Energy: 0.48607963597182796
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Energy: 0.4514964580748091
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Energy: 0.5104898340003483
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Energy: 0.4494761809503448
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Energy: 0.5052787818200276
Energy: 0.46498486106954834
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Energy: 0.4731730276079915
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Energy: 0.47317302760774477
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Energy: 0.47317302760774477
Energy: 0.4909322207205219
Energy: 0.4845790140572252
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Energy: 0.4845790140569784
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Energy: 0.4401336222398256
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Energy: 0.4798671826640832
Energy: 0.4551839067546738
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Energy: 0.47986718266817957
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Energy: 0.4537640599011348
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Energy: 0.47749883658500386
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Energy: 0.477498836583918
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Energy: 0.5351998835173077
Energy: 0.48683686976594887
Energy: 0.5351998835154322
Energy: 0.48683686976594887
Energy: 0.46146982790393876
Energy: 0.47169654974250724
Energy: 0.46146982790369195
Energy: 0.4716965497362886
Energy: 0.4614698279042349
Energy: 0.4716965497435931
Energy: 0.5057894819193391
Energy: 0.4649124825741349
Energy: 0.5057894819185002
Energy: 0.4649124825741349
Energy: 0.5057894819195858
Energy: 0.464912482572753
Energy: 0.4479233125053238
Energy: 0.5124637974865217
Energy: 0.4479233125050276
Energy: 0.5124637974862255
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Energy: 0.5128647677505196
Energy: 0.4721103100292912
Energy: 0.5128647677521484
Energy: 0.4721103100290444
Energy: 0.5128647677508158
Energy: 0.4721103100292912
Energy: 0.4384114307938924
Energy: 0.5023264064405035
Energy: 0.43841143079443523
Energy: 0.5023264064412933
Energy: 0.43841143079251044
Energy: 0.5023264064402074
Energy: 0.498424172367478
Energy: 0.46504661866618097
Energy: 0.49842417238406106
Energy: 0.4650466186656381
Energy: 0.4984241723639738
Energy: 0.46504661866588487
Energy: 0.45035365808924366
Energy: 0.5217022399591268
Energy: 0.45035365808924366
Energy: 0.5217022399599659
Energy: 0.4503536580897866
Energy: 0.5217022399610516
Energy: 0.5466654823531506
Energy: 0.4436712586129096
Energy: 0.546665482350436
Energy: 0.4436712586118238
Energy: 0.5466654823531506
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Energy: 0.4616331431859256
Energy: 0.47273616520017125
Energy: 0.4616331431862217
Energy: 0.4727361652010103
Energy: 0.4616331431859256
Energy: 0.47273616520234285
Energy: 0.5036257366995195
Energy: 0.43924574374131614
Energy: 0.5036257366954231
Energy: 0.4392457437416123
Energy: 0.5036257366951764
Energy: 0.4392457437416123
Energy: 0.4820118413045191
Energy: 0.47629268456350987
Energy: 0.482011841300472
Energy: 0.4762926845632137
Energy: 0.482011841301015
Energy: 0.4762926845632137
Energy: 0.5035978244424963
Energy: 0.44395193564006286
Energy: 0.5035978244430391
Energy: 0.44395193564090185
Energy: 0.503597824440078
Energy: 0.44395193564035895
Energy: 0.4835276998403043
Energy: 0.4771771390994164
Energy: 0.4835276998416369
Energy: 0.4771771390969487
Energy: 0.4835276998405511
Energy: 0.4771771390863868
Energy: 0.4922790571208572
Energy: 0.46426917021819397
Energy: 0.4922790571208572
Energy: 0.4642691702184407
Energy: 0.4922790571214
Energy: 0.46426917021819397
Energy: 0.4505564787909469
Energy: 0.486418585235917
Energy: 0.450556478791786
Energy: 0.4864185852364599
Energy: 0.4505564787909469
Energy: 0.4864185852367561
Energy: 0.4723381126740363
Energy: 0.4732221009295748
Energy: 0.47233811267349335
Energy: 0.473222100928489
Energy: 0.472338112671075
Energy: 0.4732221009295748
Energy: 0.47640045357330424
Energy: 0.46208297213195504
Energy: 0.4764004535719223
Energy: 0.46208297213170824
Energy: 0.4764004535738472
Energy: 0.4620829721324979

minimum gb energy = 0.43841143079251044 eV
minimum distance =  2.63339199954603 Angstroms
sigma value = 81


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

Energy: 0.5305117962065852
Energy: 0.4905367214931373
Energy: 0.5031694653314602
Energy: 0.4905367214968629
Energy: 0.5305117962065852
Energy: 0.4905367214964903
Energy: 0.46716467166648873
Energy: 0.4658615705663736
Energy: 0.4671646716679791
Energy: 0.46586157056525584
Energy: 0.46716467166835157
Energy: 0.46586157056525584
Energy: 0.5121228803046346
Energy: 0.42491876673221934
Energy: 0.512671388487517
Energy: 0.4249187667311016
Energy: 0.512122880300164
Energy: 0.4249187667311016
Energy: 0.4643870402212811
Energy: 0.4916112202309409
Energy: 0.4643870402190457
Energy: 0.491611220234294
Energy: 0.4643870402156927
Energy: 0.4916112202350391
Energy: 0.48138914480973655
Energy: 0.43006734892367515
Energy: 0.4813891448048933
Energy: 0.43006734892814585
Energy: 0.4813891448045207
Energy: 0.43006734892814585
Energy: 0.46543274037405347
Energy: 0.45294743513160746
Energy: 0.46543274037628884
Energy: 0.4529474351278818
Energy: 0.465432740373681
Energy: 0.4529474351282543
Energy: 0.4239337791859152
Energy: 0.4583458059057501
Energy: 0.4239337791833073
Energy: 0.45834580590798546
Energy: 0.42393377918293473
Energy: 0.45834580590798546
Energy: 0.4777519505088276
Energy: 0.5025295558194888
Energy: 0.47770919068889195
Energy: 0.5025295558172533
Energy: 0.4777519505065922
Energy: 0.5025295558172533
Energy: 0.5327049099983964
Energy: 0.48955172809978886
Energy: 0.5327049099980239
Energy: 0.48955172809941633
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Energy: 0.48955172809941633
Energy: 0.500266683297648
Energy: 0.5046041156600082
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Energy: 0.5046041156626161
Energy: 0.5002666832980205
Energy: 0.5046041156614984
Energy: 0.4902266663959787
Energy: 0.46888091415960365
Energy: 0.4902266664000769
Energy: 0.4688809141648194
Energy: 0.49022666639784157
Energy: 0.4688809141644469
Energy: 0.4255765188524334
Energy: 0.46244572385996047
Energy: 0.42557651885280595
Energy: 0.4624457238607056
Energy: 0.42557651885429615
Energy: 0.46244572386033306
Energy: 0.46739592872237307
Energy: 0.4832350137225773
Energy: 0.4673959287238634
Energy: 0.48323501372593036
Energy: 0.4673959287242359
Energy: 0.48323501372593036
Energy: 0.48817507870292215
Energy: 0.42490028421419246
Energy: 0.4881750787036673
Energy: 0.42490028421531023
Energy: 0.48817507870553006
Energy: 0.4249002842160553
Energy: 0.5094803069163865
Energy: 0.43621709227240163
Energy: 0.509480306916759
Energy: 0.4362170922750095
Energy: 0.5094803069186219
Energy: 0.436217092274637
Energy: 0.4777139031816697
Energy: 0.4266735712206564
Energy: 0.4777139031816697
Energy: 0.4266735712195388
Energy: 0.47771390318241475
Energy: 0.4266735712195388
Energy: 0.5106862802743155
Energy: 0.4533329729618616
Energy: 0.5107835432759213
Energy: 0.45333297296446956
Energy: 0.510686280271335
Energy: 0.45333297296446956
Energy: 0.4510405853742452
Energy: 0.5353119778454194
Energy: 0.45155892739480596
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Energy: 0.45104058537685315
Energy: 0.5353119778439291
Energy: 0.4277726812276123
Energy: 0.4377412669540228
Energy: 0.42777268122574946
Energy: 0.43774126695216004
Energy: 0.4277726812253769
Energy: 0.43774126694992466
Energy: 0.49098516156532385
Energy: 0.5291895961805355
Energy: 0.49098516156495126
Energy: 0.5291895961794515
Energy: 0.4909851615679317
Energy: 0.5291895961790791
Energy: 0.4298572213611062
Energy: 0.48289126699554363
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Energy: 0.482891266997779
Energy: 0.42985722136185134
Energy: 0.482891266997779
Energy: 0.49356974849897833
Energy: 0.47015830920667
Energy: 0.4540663539306878
Energy: 0.4701583092077877
Energy: 0.4935697485015862
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Energy: 0.48180831309195193
Energy: 0.4162156436073198
Energy: 0.4541348921665191
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Energy: 0.48180831309530503
Energy: 0.41621564360620206
Energy: 0.470377163324813
Energy: 0.47839701270223856
Energy: 0.47037716332295026
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Energy: 0.47037716332406787
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Energy: 0.4883085621849746
Energy: 0.530664729577519
Energy: 0.48830856218199414
Energy: 0.5306647295760287
Energy: 0.48830856218348434
Energy: 0.5306647295726756
Energy: 0.4277964330059712
Energy: 0.5884779080230192
Energy: 0.42779643300634373
Energy: 0.5884779080233917
Energy: 0.42779643300410836
Energy: 0.5884779080237643
Energy: 0.4520511260385169
Energy: 0.4640425601283489
Energy: 0.4520511260403797
Energy: 0.46404256012797634
Energy: 0.4520511260388894
Energy: 0.46404256012946654
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Energy: 0.4532073249461444
Energy: 0.4609779514247092
Energy: 0.4532073249461444
Energy: 0.46097795142284637
Energy: 0.4532073249461444
Energy: 0.46778061809262816
Energy: 0.4933194837139606
Energy: 0.4677533197724488
Energy: 0.4933194837147057
Energy: 0.4677806180892751
Energy: 0.4933194837150783
Energy: 0.4249544573060002
Energy: 0.4363371363232447
Energy: 0.4249544573056276
Energy: 0.43633713632734283
Energy: 0.42495445730413733
Energy: 0.4363371363277154
Energy: 0.4909853936371947
Energy: 0.5095854690982661
Energy: 0.49098539363495936
Energy: 0.5095854691005016
Energy: 0.49098539363384164
Energy: 0.5095854690986388
Energy: 0.4285901396301534
Energy: 0.47836833794326344
Energy: 0.4285901396323888
Energy: 0.4783683379425183
Energy: 0.4285901396327613
Energy: 0.47836833794289085
Energy: 0.4257215478031207
Energy: 0.46512244004900494
Energy: 0.4257215478023755
Energy: 0.46512244004676956
Energy: 0.4257215478027481
Energy: 0.4651224400329848
Energy: 0.42746525202365154
Energy: 0.42329576713293815
Energy: 0.42746525202588687
Energy: 0.423295767134767
Energy: 0.42746525202402413
Energy: 0.42329576713402195
Energy: 0.4868273864756531
Energy: 0.629734424512062
Energy: 0.48686109906247227
Energy: 0.6297344245124344
Energy: 0.4868273864760257
Energy: 0.629734424512807
Energy: 0.5310836348130854
Energy: 0.4909663769269977
Energy: 0.531083634813458
Energy: 0.49096637692588
Energy: 0.5310836348130854
Energy: 0.4909663769269977
Energy: 0.4677814851687351
Energy: 0.4308178578343391
Energy: 0.4677814851661271
Energy: 0.43081785783545684
Energy: 0.4677814851672448
Energy: 0.4308178578369471
Energy: 0.4692616422135082
Energy: 0.4581870013095915
Energy: 0.46926164221313554
Energy: 0.4581870013133172
Energy: 0.4692616422109002
Energy: 0.4581870013133172

minimum gb energy = 0.41621564360545693 eV
minimum distance =  2.68261643471483 Angstroms
sigma value = 43


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

Energy: 0.557800207576759
Energy: 0.4412887790926402
Energy: 0.557800207576759
Energy: 0.44128877909309777
Energy: 0.557800207576759
Energy: 0.44128877909309777
Energy: 0.48478531232526983
Energy: 0.43896232423513143
Energy: 0.48478531232481215
Energy: 0.43896232423558906
Energy: 0.48478531232435457
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Energy: 0.5137471296987494
Energy: 0.5395988763415094
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Energy: 0.5395988763410517
Energy: 0.5137471296987494
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Energy: 0.44562944743755545
Energy: 0.4588561601655521
Energy: 0.44562944743755545
Energy: 0.4588561601641792
Energy: 0.44562944743709787
Energy: 0.4588561601673825
Energy: 0.4797088902730898
Energy: 0.480528158784177
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Energy: 0.45899841845845124
Energy: 0.47265210651824446
Energy: 0.45899841845799366
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Energy: 0.45899841845753603
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Energy: 0.47518429895727027
Energy: 0.5282596977137837
Energy: 0.475184298956355
Energy: 0.5282596977142412
Energy: 0.4751842989554398
Energy: 0.5282596977137837
Energy: 0.4598492541205388
Energy: 0.47936106749935414
Energy: 0.4598492541205388
Energy: 0.47936106749798135
Energy: 0.4598492541200812
Energy: 0.47936106749798135
Energy: 0.5205547362460133
Energy: 0.4336141745495878
Energy: 0.5205547362460133
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Energy: 0.5205547362455557
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Energy: 0.4542753544500292
Energy: 0.4756714426217809
Energy: 0.4542753544500292
Energy: 0.47567144263228545
Energy: 0.4542753544500292
Energy: 0.4756714426341159
Energy: 0.4789554107652347
Energy: 0.44272962922797643
Energy: 0.4789554107643194
Energy: 0.4427296292270611
Energy: 0.47895541076477705
Energy: 0.4427296292266035
Energy: 0.4598980455355385
Energy: 0.4630630227246881
Energy: 0.4598980455350809
Energy: 0.4630630227246881
Energy: 0.4598980455350809
Energy: 0.4630630227242305
Energy: 0.5037275866808286
Energy: 0.4728525896734247
Energy: 0.5037275866808286
Energy: 0.47285258967388233
Energy: 0.5037275866808286
Energy: 0.47285258967388233
Energy: 0.4254609122235515
Energy: 0.5287853713553585
Energy: 0.4254609122235515
Energy: 0.5287853713553585
Energy: 0.4254609122235515
Energy: 0.5287853713553585
Energy: 0.4859950156506671
Energy: 0.48111052841811497
Energy: 0.4859950156515824
Energy: 0.48111052841765733
Energy: 0.48599501565204006
Energy: 0.48111052841811497
Energy: 0.46873319995403967
Energy: 0.489799483204061
Energy: 0.46873319995403967
Energy: 0.489799483204061
Energy: 0.46873319995358204
Energy: 0.48979948320360345
Energy: 0.5120195918470847
Energy: 0.43896845662412093
Energy: 0.512019591848
Energy: 0.43896845662412093
Energy: 0.5120195918475423
Energy: 0.43896845662412093
Energy: 0.5068357351264577
Energy: 0.46377603089197134
Energy: 0.506835735126
Energy: 0.46377603089197134
Energy: 0.506835735126
Energy: 0.46377603089197134
Energy: 0.5142810002946401
Energy: 0.4555372910809669
Energy: 0.5142810002946401
Energy: 0.45553729108142454
Energy: 0.5142810002946401
Energy: 0.4555372910809669
Energy: 0.5091887863745705
Energy: 0.5020897840879697
Energy: 0.5091887863741129
Energy: 0.502089784087512
Energy: 0.5091887863745705
Energy: 0.5020897840879697
Energy: 0.46862765309192367
Energy: 0.4712747488942605
Energy: 0.4686276530914661
Energy: 0.4712747488942605
Energy: 0.4686276530914661
Energy: 0.4712747488942605
Energy: 0.5136001731230931
Energy: 0.48181402610383356
Energy: 0.51360017312353
Energy: 0.48181402610383356
Energy: 0.51360017312353
Energy: 0.48181402610383356
Energy: 0.42575823240800237
Energy: 0.4952320273498115
Energy: 0.4257582324075448
Energy: 0.4952320273498115
Energy: 0.4257582324075448
Energy: 0.4952320273498115
Energy: 0.5027222635054931
Energy: 0.4726759953216723
Energy: 0.5027222635059507
Energy: 0.4726759953212147
Energy: 0.5027222635059507
Energy: 0.4726759953212147
Energy: 0.46021823130748607
Energy: 0.45617041845950507
Energy: 0.46021823130748607
Energy: 0.45617041845950507
Energy: 0.46021823130748607
Energy: 0.45617041845950507
Energy: 0.5192969112901522
Energy: 0.4749833241759452
Energy: 0.5192969112901522
Energy: 0.4749833241759452
Energy: 0.5192969112896946
Energy: 0.4749833241759452
Energy: 0.4545489505750888
Energy: 0.5160891654599071
Energy: 0.45454895057463124
Energy: 0.5160891654599071
Energy: 0.45454895057554645
Energy: 0.5160891654599071
Energy: 0.5072965428900655
Energy: 0.4448780011732126
Energy: 0.5072965428900655
Energy: 0.4448780011732126
Energy: 0.5072965428891504
Energy: 0.4448780011736702
Energy: 0.46049421217294867
Energy: 0.47860536842190926
Energy: 0.46049421217294867
Energy: 0.47860536842236684
Energy: 0.46049421217249104
Energy: 0.4786053684228245
Energy: 0.48213650638693606
Energy: 0.48790200403370165
Energy: 0.4821365063873937
Energy: 0.4879020040355322
Energy: 0.4821365063864785
Energy: 0.48790200403415923
Energy: 0.4595095433621379
Energy: 0.4728620911410922
Energy: 0.4595095433621379
Energy: 0.47286209114154976
Energy: 0.4595095433616802
Energy: 0.47286209114154976

minimum gb energy = 0.4254609122235515 eV
minimum distance =  2.65028940080955 Angstroms
sigma value = 57


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

Energy: 0.4998515918023557
Energy: 0.43166416141998704
Energy: 0.49985159180292127
Energy: 0.43166416141998704
Energy: 0.49985159180292127
Energy: 0.43166416141939457
Energy: 0.4628643490623632
Energy: 0.41641427262622416
Energy: 0.46286434906177076
Energy: 0.41641427262681663
Energy: 0.46286434906177076
Energy: 0.41641427262740915
Energy: 0.47028129923791545
Energy: 0.5191395536426808
Energy: 0.47028129924087814
Energy: 0.5191395536426808
Energy: 0.47028129923791545
Energy: 0.5191395536426808
Energy: 0.46580665575730834
Energy: 0.47976692501728657
Energy: 0.4658066557567159
Energy: 0.47976692501669405
Energy: 0.4658066557567159
Energy: 0.47976692501728657
Energy: 0.44493963104294454
Energy: 0.48144658290521253
Energy: 0.4449396310441296
Energy: 0.48144658290521253
Energy: 0.4449396310441296
Energy: 0.48144658290521253
Energy: 0.47209382059581967
Energy: 0.4620004118546927
Energy: 0.4720938205970047
Energy: 0.4620004118546927
Energy: 0.47209382059641214
Energy: 0.46200041185528523
Energy: 0.4715020905590734
Energy: 0.5111511243945203
Energy: 0.47150209055966585
Energy: 0.5111511243945203
Energy: 0.4715020905590734
Energy: 0.5111511243945203
Energy: 0.48650442029174606
Energy: 0.42535138293487196
Energy: 0.4865044202929312
Energy: 0.42535138293487196
Energy: 0.4865044202929312
Energy: 0.42535138293487196
Energy: 0.44984662498910466
Energy: 0.4217433262750797
Energy: 0.44984662498910466
Energy: 0.4217433262744872
Energy: 0.4498466249902897
Energy: 0.4217433262744872
Energy: 0.410730206440611
Energy: 0.46179254075495135
Energy: 0.410730206440611
Energy: 0.46179254075495135
Energy: 0.4107302064400184
Energy: 0.46179254075495135
Energy: 0.47138537997198954
Energy: 0.4793896315012835
Energy: 0.471385379972582
Energy: 0.4793896315012835
Energy: 0.471385379972582
Energy: 0.4793896315012835
Energy: 0.44761582090410706
Energy: 0.4891029507248188
Energy: 0.44761582090173696
Energy: 0.4891029507254113
Energy: 0.44761582090410706
Energy: 0.4891029507242262
Energy: 0.4764386614044436
Energy: 0.4216604056009501
Energy: 0.4764386614044436
Energy: 0.4216604056009501
Energy: 0.476438661405036
Energy: 0.4216604056003575
Energy: 0.47747735837706556
Energy: 0.41885062518282734
Energy: 0.477477358375288
Energy: 0.41885062518341987
Energy: 0.477477358375288
Energy: 0.41885062518341987
Energy: 0.4518530511260789
Energy: 0.4193170401897146
Energy: 0.4518530511302265
Energy: 0.4193170401897146
Energy: 0.4518530511254863
Energy: 0.4193170401897146
Energy: 0.44743382826197353
Energy: 0.4234340658684118
Energy: 0.44743382826197353
Energy: 0.42343406586781934
Energy: 0.44743382826197353
Energy: 0.4234340658684118
Energy: 0.40877611807906894
Energy: 0.46268241716867037
Energy: 0.4087761180796615
Energy: 0.46268241716867037
Energy: 0.4087761180802541
Energy: 0.46268241716867037
Energy: 0.4700173025137743
Energy: 0.47107613008780186
Energy: 0.47001730251318186
Energy: 0.47107613008839444
Energy: 0.4700173025137743
Energy: 0.47107613008898697
Energy: 0.4087573821440711
Energy: 0.46259096902405517
Energy: 0.40875738214347856
Energy: 0.46259096902405517
Energy: 0.4087573821440711
Energy: 0.4625909690234626
Energy: 0.44745256934610395
Energy: 0.4232736859101113
Energy: 0.4474525693443264
Energy: 0.42327368591070386
Energy: 0.44745256934610395
Energy: 0.4232736859101113
Energy: 0.45141932179447264
Energy: 0.4191628465293941
Energy: 0.45141932179565775
Energy: 0.4191628465293941
Energy: 0.45141932179328764
Energy: 0.4191628465293941
Energy: 0.47834995905124317
Energy: 0.4720099451906837
Energy: 0.4783499590429478
Energy: 0.4720099451894986
Energy: 0.47834995904709543
Energy: 0.4720099451900911
Energy: 0.47643150592665473
Energy: 0.4216896913802707
Energy: 0.47643150592724726
Energy: 0.42168969137967816
Energy: 0.47643150592724726
Energy: 0.42168969137967816
Energy: 0.44785833361352856
Energy: 0.48901166051601164
Energy: 0.44785833361412114
Energy: 0.48901166051601164
Energy: 0.44785833361352856
Energy: 0.4890116605166042

minimum gb energy = 0.40875738214347856 eV
minimum distance =  2.68115034374698 Angstroms
sigma value = 17


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

Energy: 0.47625557935610885
Energy: 0.4259567620933592
Energy: 0.47625557935610885
Energy: 0.4259567620933592
Energy: 0.47625557935610885
Energy: 0.4259567620933592
Energy: 0.41074399983856197
Energy: 0.40912087844098455
Energy: 0.41074399983939996
Energy: 0.40912087844098455
Energy: 0.41074399983856197
Energy: 0.40912087844098455
Energy: 0.4518339092452838
Energy: 0.48702730891242435
Energy: 0.45183390924444583
Energy: 0.48702730891242435
Energy: 0.4518339092452838
Energy: 0.48702730891242435
Energy: 0.38476226861835205
Energy: 0.4691724757709701
Energy: 0.38476226861919
Energy: 0.4691724757709701
Energy: 0.38476226861919
Energy: 0.4691724757709701
Energy: 0.46294815574294973
Energy: 0.4508717779634723
Energy: 0.46294815574378767
Energy: 0.4508717779634723
Energy: 0.46294815574294973
Energy: 0.4508717779626343
Energy: 0.4304551412775437
Energy: 0.4696600603513508
Energy: 0.4304551412775437
Energy: 0.4696600603513508
Energy: 0.4304551412775437
Energy: 0.4696600603513508
Energy: 0.4667079494156659
Energy: 0.4073101836940114
Energy: 0.4667079494156659
Energy: 0.4073101836931734
Energy: 0.4667079494156659
Energy: 0.4073101836931734
Energy: 0.38465319277769633
Energy: 0.4686804592068766
Energy: 0.38465319277769633
Energy: 0.4686804592068766
Energy: 0.38465319277769633
Energy: 0.4686804592068766
Energy: 0.4510756538198367
Energy: 0.40894828630414964
Energy: 0.4510756538189988
Energy: 0.4089482863024737
Energy: 0.4510756538189988
Energy: 0.40894828630414964
Energy: 0.4389021384140601
Energy: 0.4110507174771763
Energy: 0.4389021384140601
Energy: 0.4110507174771763
Energy: 0.4389021384132221
Energy: 0.4110507174788522
Energy: 0.4322969067063905
Energy: 0.46263593939406117
Energy: 0.4322969067072285
Energy: 0.46263593939406117
Energy: 0.4322969067063905
Energy: 0.46263593939406117
Energy: 0.42278520958242805
Energy: 0.40881302414236953
Energy: 0.42278520958159005
Energy: 0.4088130241415316
Energy: 0.42278520958159005
Energy: 0.40881302414236953
Energy: 0.38497860229997055
Energy: 0.47166426688010604
Energy: 0.38497860229997055
Energy: 0.47166426688010604
Energy: 0.38497860229997055
Energy: 0.47166426688010604
Energy: 0.43882357655434096
Energy: 0.4559960095435092
Energy: 0.43882357655434096
Energy: 0.4559960095435092
Energy: 0.43882357655434096
Energy: 0.4559960095435092
Energy: 0.43040605478155325
Energy: 0.5166683037901771
Energy: 0.4304060547807153
Energy: 0.5166683037901771
Energy: 0.43040605477903937
Energy: 0.5166683037901771
Energy: 0.430547721962303
Energy: 0.4703997002340834
Energy: 0.430547721962303
Energy: 0.4703997002349214
Energy: 0.430547721962303
Energy: 0.4703997002349214
Energy: 0.43778275901534897
Energy: 0.45565626684584193
Energy: 0.43778275901534897
Energy: 0.45565626684584193
Energy: 0.437782759014511
Energy: 0.45565626684584193

minimum gb energy = 0.38465319277769633 eV
minimum distance =  2.62792829519093 Angstroms
sigma value = 17


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

Energy: 0.43325894739675497
Energy: 0.3883638146862766
Energy: 0.4332589473954606
Energy: 0.3883638146862766
Energy: 0.4332589473964314
Energy: 0.3883638146862766
Energy: 0.3968472327460032
Energy: 0.3798332133321142
Energy: 0.3968472327469739
Energy: 0.3798332133321142
Energy: 0.39684723274567957
Energy: 0.3798332133321142
Energy: 0.43103318922907863
Energy: 0.41189685914910074
Energy: 0.43103318922907863
Energy: 0.41189685914910074
Energy: 0.431033189230373
Energy: 0.41189685914910074
Energy: 0.3638817165329512
Energy: 0.42242027956687594
Energy: 0.3638817165329512
Energy: 0.4224202795671996
Energy: 0.36388171653392193
Energy: 0.42242027956687594
Energy: 0.4433714761715515
Energy: 0.3778193580132072
Energy: 0.44337147617252226
Energy: 0.3778193580125601
Energy: 0.44337147616993355
Energy: 0.3778193580125601
Energy: 0.4110688428480934
Energy: 0.4092761117603425
Energy: 0.4110688428480934
Energy: 0.4092761117603425
Energy: 0.41106884284744627
Energy: 0.4092761117603425
Energy: 0.39597630797000877
Energy: 0.39313110134502627
Energy: 0.3959763079664492
Energy: 0.39313110134470264
Energy: 0.3959763079706559
Energy: 0.39313110134502627
Energy: 0.5031817437133148
Energy: 0.48363089596027886
Energy: 0.5031817437139621
Energy: 0.4836308959606025
Energy: 0.5031817437129913
Energy: 0.48363089596027886
Energy: 0.4039181754304846
Energy: 0.417137419128728
Energy: 0.40391817543113184
Energy: 0.4171374191293752
Energy: 0.4039181754304846
Energy: 0.41713741912905156
Energy: 0.3948318702946971
Energy: 0.3566886577421567
Energy: 0.3948318702959915
Energy: 0.3566886577418331
Energy: 0.3948318702950207
Energy: 0.3566886577421567
Energy: 0.3640724290824674
Energy: 0.4816116666213848
Energy: 0.3640724290840853
Energy: 0.4816116666213848
Energy: 0.3640724290831146
Energy: 0.4816116666213848
Energy: 0.43398551354355386
Energy: 0.38688603595495735
Energy: 0.43398551354387743
Energy: 0.3868860359497799
Energy: 0.43398551354420106
Energy: 0.3868860359526922
Energy: 0.3992127203716141
Energy: 0.3867578285963883
Energy: 0.39921272037129046
Energy: 0.3867578285970355
Energy: 0.3992127203716141
Energy: 0.38675782859671193
Energy: 0.4032339949244529
Energy: 0.43161417620441067
Energy: 0.4032339949251
Energy: 0.43161417620441067
Energy: 0.40323399492348205
Energy: 0.43161417620441067
Energy: 0.4144183316131553
Energy: 0.424940190324416
Energy: 0.4144183316134789
Energy: 0.42494019032376884
Energy: 0.414418331614126
Energy: 0.42494019032376884
Energy: 0.3642426401708682
Energy: 0.411814471730678
Energy: 0.3642426401689266
Energy: 0.4118144717310016
Energy: 0.36424264017151536
Energy: 0.4118144717313252
Energy: 0.4029494064570708
Energy: 0.40564349332069416
Energy: 0.4029494064567472
Energy: 0.40564349332069416
Energy: 0.4029494064567472
Energy: 0.40564349332069416
Energy: 0.41383297888570625
Energy: 0.41049217177143466
Energy: 0.41383297888602977
Energy: 0.4104921717717582
Energy: 0.4138329788873242
Energy: 0.410492171771111
Energy: 0.39905951668057504
Energy: 0.4112962913894172
Energy: 0.39905951668057504
Energy: 0.4112962913900644
Energy: 0.39905951668057504
Energy: 0.41129629138974083
Energy: 0.40263913223779657
Energy: 0.3543517300109826
Energy: 0.4026391322397381
Energy: 0.3543517300109826
Energy: 0.40263913223779657
Energy: 0.354351730010659
Energy: 0.3990379919036158
Energy: 0.41142257704596313
Energy: 0.39903799190491024
Energy: 0.41142257704596313
Energy: 0.39903799190523376
Energy: 0.41142257704628676
Energy: 0.4138178935442862
Energy: 0.4105464252523082
Energy: 0.4138178935436684
Energy: 0.41054642525360263
Energy: 0.4138178935442862
Energy: 0.4105464252529555
Energy: 0.4030195826216079
Energy: 0.4053757844164106
Energy: 0.4030195826229023
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Energy: 0.40301958262225507
Energy: 0.4053757844164106
Energy: 0.3645670798711855
Energy: 0.4456624293343645
Energy: 0.36456707987053827
Energy: 0.44566242933501166
Energy: 0.3645670798715091
Energy: 0.4456624293346881
Energy: 0.4143947803767876
Energy: 0.4243733075882132
Energy: 0.4143947803767876
Energy: 0.4243733075888604
Energy: 0.414394780378082
Energy: 0.4243733075882132
Energy: 0.3988679516925974
Energy: 0.43166211448495706
Energy: 0.3988679516932446
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Energy: 0.3988679516922738
Energy: 0.43166211448495706
Energy: 0.399186600787223
Energy: 0.3869180894765372
Energy: 0.39918660078592866
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Energy: 0.3991866007875465
Energy: 0.3869180894765372
Energy: 0.43338484502661107
Energy: 0.3872547069718439
Energy: 0.4333848450259638
Energy: 0.38725470697087316
Energy: 0.4333848450275818
Energy: 0.3872547069715203
Energy: 0.3641897459345495
Energy: 0.48139948529081855
Energy: 0.36418974593487313
Energy: 0.4813994852911421
Energy: 0.36418974593487313
Energy: 0.4813994852911421
Energy: 0.3949313577935047
Energy: 0.3565319334944981
Energy: 0.39493135779123967
Energy: 0.3565319334944981
Energy: 0.3949313577905924
Energy: 0.35653193349482165
Energy: 0.40383469245487724
Energy: 0.41739846966177396
Energy: 0.4038346924545536
Energy: 0.4173984696640391
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Energy: 0.41739846966371547
Energy: 0.5031512714808897
Energy: 0.4837847055994293
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Energy: 0.39316480395259923
Energy: 0.39581353244740797
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Energy: 0.3958135324480552
Energy: 0.3931648039522756
Energy: 0.41090579664008625
Energy: 0.38070923387242905
Energy: 0.4109057966391155
Energy: 0.38070923387242905
Energy: 0.41090579664073346
Energy: 0.38070923387242905
Energy: 0.44347516856763336
Energy: 0.3752495885338027
Energy: 0.44347516856342667
Energy: 0.3752495885334791
Energy: 0.44347516856666264
Energy: 0.3752495885338027
Energy: 0.3640807881125203
Energy: 0.41855658441969223
Energy: 0.3640807881131675
Energy: 0.41855658442163374
Energy: 0.36408078811090233
Energy: 0.41855658442163374
Energy: 0.43103819866829307
Energy: 0.4118450807053459
Energy: 0.4310381986679695
Energy: 0.4118450807053459
Energy: 0.43103819866829307
Energy: 0.4118450807053459
Energy: 0.39540794398807194
Energy: 0.37992178963647166
Energy: 0.3954079439877483
Energy: 0.37992178963647166
Energy: 0.3954079439883955
Energy: 0.37992178963647166
Energy: 0.43325894739675497
Energy: 0.3883638146869238
Energy: 0.43325894739610776
Energy: 0.38836381468660025
Energy: 0.43325894739675497
Energy: 0.3883638146869238
Energy: 0.3968472327489155
Energy: 0.3798332133334086
Energy: 0.39684723274923905
Energy: 0.379833213333085
Energy: 0.3968472327482683
Energy: 0.379833213333085
Energy: 0.43103318922713707
Energy: 0.41189685915039503
Energy: 0.4310331892277843
Energy: 0.41189685915039503
Energy: 0.4310331892281078
Energy: 0.41189685915039503
Energy: 0.36388171653071544
Energy: 0.4110928237726308
Energy: 0.3638817165303919
Energy: 0.4110928237723072
Energy: 0.3638817165300683
Energy: 0.4110928237723072
Energy: 0.44337147616993355
Energy: 0.3778193580125601
Energy: 0.4433714761705807
Energy: 0.3778193580128837
Energy: 0.4433714761705807
Energy: 0.3778193580125601

minimum gb energy = 0.354351730010659 eV
minimum distance =  2.66376746094868 Angstroms
sigma value = 57


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

Energy: 0.4002477150223727
Energy: 0.36127191307724177
Energy: 0.4002477150218458
Energy: 0.36127191307724177
Energy: 0.4002477150218458
Energy: 0.3612719130777686
Energy: 0.4099201576547669
Energy: 0.35716887663532915
Energy: 0.4099201576547669
Energy: 0.35716887663532915
Energy: 0.40992015765529377
Energy: 0.35716887663532915
Energy: 0.4193363926537861
Energy: 0.3839603625685583
Energy: 0.41933639265325917
Energy: 0.38396036256908517
Energy: 0.41933639265431294
Energy: 0.3839603625685583
Energy: 0.3784705365242913
Energy: 0.3931964729113146
Energy: 0.3784705365242913
Energy: 0.3931964729113146
Energy: 0.3784705365248182
Energy: 0.3931964729113146
Energy: 0.4086039648666361
Energy: 0.3535508736868674
Energy: 0.4086039648666361
Energy: 0.35355087368634047
Energy: 0.40860396486716294
Energy: 0.3535508736868674
Energy: 0.3891233386504981
Energy: 0.3562839493243971
Energy: 0.3891233386499713
Energy: 0.3562839493243971
Energy: 0.3891233386499713
Energy: 0.3562839493249241
Energy: 0.34319678255199443
Energy: 0.3789079957869584
Energy: 0.34319678256986047
Energy: 0.37890799578748524
Energy: 0.3431967825688067
Energy: 0.37890799578748524
Energy: 0.4493634713081685
Energy: 0.3719559146736472
Energy: 0.44936347130764165
Energy: 0.3719559146736472
Energy: 0.44936347130764165
Energy: 0.3719559146731203
Energy: 0.357618423669169
Energy: 0.3571287626597268
Energy: 0.3576184236696959
Energy: 0.3571287626591999
Energy: 0.3576184236696959
Energy: 0.3571287626597268
Energy: 0.3648122578662961
Energy: 0.36441305501849963
Energy: 0.3648122578662961
Energy: 0.3644130550179728
Energy: 0.36481225786576915
Energy: 0.36441305501849963
Energy: 0.44269482427393547
Energy: 0.45133218222095406
Energy: 0.4426948242734086
Energy: 0.45133218222095406
Energy: 0.44269482427393547
Energy: 0.4513321822204272
Energy: 0.3725119165368925
Energy: 0.34359142864159814
Energy: 0.3725119165368925
Energy: 0.3435914286426519
Energy: 0.3725119165368925
Energy: 0.34359142864159814
Energy: 0.36423935576760386
Energy: 0.38808329515973783
Energy: 0.36423935576760386
Energy: 0.38808329516026474
Energy: 0.36423935576813077
Energy: 0.38808329515973783
Energy: 0.3642544168486745
Energy: 0.4242112243206312
Energy: 0.3642544168486745
Energy: 0.4242112243206312
Energy: 0.3642544168476208
Energy: 0.4242112243206312
Energy: 0.4011133862154704
Energy: 0.3625187365995252
Energy: 0.40111338621441667
Energy: 0.3625187366032134
Energy: 0.40111338621494347
Energy: 0.36251873660374023
Energy: 0.37310593106232876
Energy: 0.40371435174367565
Energy: 0.37310593106285567
Energy: 0.4037143517442025
Energy: 0.37310593106285567
Energy: 0.4037143517442025
Energy: 0.37669987103306957
Energy: 0.40885197356758474
Energy: 0.37669987103359637
Energy: 0.40885197356758474
Energy: 0.37669987103359637
Energy: 0.40885197356758474
Energy: 0.3848486705253658
Energy: 0.3952544704792805
Energy: 0.3848486705264196
Energy: 0.3952544704792805
Energy: 0.3848486705264196
Energy: 0.3952544704792805
Energy: 0.350955145658482
Energy: 0.42979361946832606
Energy: 0.350955145658482
Energy: 0.42979361946832606
Energy: 0.3509551456590089
Energy: 0.42979361946832606
Energy: 0.36253168258143365
Energy: 0.388804336693144
Energy: 0.36253168258143365
Energy: 0.388804336693144
Energy: 0.36253168258143365
Energy: 0.388804336693144
Energy: 0.39049161595251614
Energy: 0.3809056190951269
Energy: 0.3904916159509355
Energy: 0.38090561909565374
Energy: 0.39049161595251614
Energy: 0.38090561909670756
Energy: 0.34652773190945446
Energy: 0.43143254137029474
Energy: 0.3465277319105082
Energy: 0.4314325413708216
Energy: 0.3465277319105082
Energy: 0.43143254137029474
Energy: 0.37456201660428184
Energy: 0.3719051168048563
Energy: 0.37456201660428184
Energy: 0.3719051168048563
Energy: 0.37456201660480865
Energy: 0.3719051168048563
Energy: 0.3755584147782595
Energy: 0.43184899449506453
Energy: 0.37555841477773266
Energy: 0.43184899449506453
Energy: 0.37555841477878643
Energy: 0.43184899449506453
Energy: 0.37077816104393385
Energy: 0.4582022580369747
Energy: 0.3707781610428801
Energy: 0.4582022580375016
Energy: 0.37077816104182637
Energy: 0.4582022580369747
Energy: 0.36347418526566483
Energy: 0.3714722365718419
Energy: 0.36347418526566483
Energy: 0.3714722365718419
Energy: 0.36347418526619174
Energy: 0.3714722365723688
Energy: 0.3441606641818987
Energy: 0.4294934096542009
Energy: 0.3441606641824256
Energy: 0.4294934096542009
Energy: 0.3441606641818987
Energy: 0.4294934096542009

minimum gb energy = 0.34319678255199443 eV
minimum distance =  2.61937892945179 Angstroms
sigma value = 43


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

Energy: 0.3482410427760009
Energy: 0.3259693483288954
Energy: 0.3482410427767687
Energy: 0.3259693483288954
Energy: 0.3482410427760009
Energy: 0.3259693483288954
Energy: 0.35612074166170943
Energy: 0.33120108620649574
Energy: 0.35612074166170943
Energy: 0.33120108620649574
Energy: 0.35612074166170943
Energy: 0.33120108620649574
Energy: 0.366373148174306
Energy: 0.3521947414322378
Energy: 0.3663731481754577
Energy: 0.3521947414322378
Energy: 0.366373148174306
Energy: 0.3521947414322378
Energy: 0.33281763427997413
Energy: 0.33991609305648496
Energy: 0.332817634280358
Energy: 0.33991609305648496
Energy: 0.33281763428074185
Energy: 0.33991609305648496
Energy: 0.35575724023026906
Energy: 0.31532098057929747
Energy: 0.35575724023026906
Energy: 0.31532098057929747
Energy: 0.35575724022988514
Energy: 0.3153209805796814
Energy: 0.335565250040247
Energy: 0.3205066262211266
Energy: 0.33556525004063087
Energy: 0.32050662622151044
Energy: 0.335565250040247
Energy: 0.3205066262211266
Energy: 0.3929745220751057
Energy: 0.32944671099078593
Energy: 0.3929745220751057
Energy: 0.32944671099078593
Energy: 0.392974522074338
Energy: 0.32944671099040207
Energy: 0.42985874194875523
Energy: 0.3099128098708336
Energy: 0.42985874194837137
Energy: 0.3099128098708336
Energy: 0.42985874194837137
Energy: 0.30991280987044967
Energy: 0.31935940055357787
Energy: 0.31608039525704035
Energy: 0.3193594005539618
Energy: 0.31608039525704035
Energy: 0.3193594005539618
Energy: 0.31608039525704035
Energy: 0.35811847545283354
Energy: 0.31349953966963195
Energy: 0.35811847545244957
Energy: 0.31349953966924804
Energy: 0.35811847545321734
Energy: 0.31349953966963195
Energy: 0.38560774515514346
Energy: 0.3457304910646172
Energy: 0.38560774515552737
Energy: 0.34573049106423326
Energy: 0.38560774515514346
Energy: 0.34573049106423326
Energy: 0.3035723225608954
Energy: 0.3171252511428047
Energy: 0.3035723225612793
Energy: 0.3171252511428047
Energy: 0.30357232256051153
Energy: 0.31712525114242085
Energy: 0.35756025845512507
Energy: 0.3024656250020202
Energy: 0.35756025845512507
Energy: 0.30246562500125235
Energy: 0.35756025845512507
Energy: 0.3024656250016362
Energy: 0.3853251889130614
Energy: 0.3455673379577074
Energy: 0.3853251889130614
Energy: 0.3455673379577074
Energy: 0.3853251889130614
Energy: 0.3455673379577074
Energy: 0.3135974148560402
Energy: 0.3175830554800376
Energy: 0.3135974148564241
Energy: 0.3175830554792699
Energy: 0.3135974148564241
Energy: 0.3175830554800376
Energy: 0.3359882221828754
Energy: 0.33233103616234866
Energy: 0.3359882221824915
Energy: 0.33233103616234866
Energy: 0.3359882221828754
Energy: 0.33233103616234866
Energy: 0.35747961095341885
Energy: 0.38082867700076
Energy: 0.357479610953035
Energy: 0.38082867700076
Energy: 0.35747961095341885
Energy: 0.38082867700076
Energy: 0.3250666807547056
Energy: 0.31724370617160347
Energy: 0.3250666807547056
Energy: 0.31724370617160347
Energy: 0.32506668075432166
Energy: 0.31724370617160347
Energy: 0.30625559430817856
Energy: 0.3520175110040102
Energy: 0.3062555943085624
Energy: 0.3520175110040102
Energy: 0.3062555943085624
Energy: 0.3520175110040102
Energy: 0.3348214508301558
Energy: 0.34679850278287067
Energy: 0.33482145083130743
Energy: 0.34679850278287067
Energy: 0.3348214508309235
Energy: 0.3467985027824867
Energy: 0.35096215402335285
Energy: 0.3315522557813682
Energy: 0.35096215402373676
Energy: 0.3315522557813682
Energy: 0.35096215402373676
Energy: 0.33155225578098435
Energy: 0.33269252956950307
Energy: 0.3527030263285816
Energy: 0.3326925295706547
Energy: 0.3527030263285816
Energy: 0.3326925295706547
Energy: 0.3527030263285816
Energy: 0.3340420529826233
Energy: 0.3523633449764129
Energy: 0.3340420529830072
Energy: 0.3523633449764129
Energy: 0.3340420529818555
Energy: 0.35236334497679683
Energy: 0.37176544692865393
Energy: 0.3235555357710878
Energy: 0.37176544692942176
Energy: 0.32355553577262336
Energy: 0.3717654469290378
Energy: 0.32355553577185553
Energy: 0.30487584210180557
Energy: 0.3463401034108074
Energy: 0.30487584210142166
Energy: 0.34634010341119126
Energy: 0.30487584210142166
Energy: 0.3463401034108074
Energy: 0.3126740385536692
Energy: 0.3392573795667808
Energy: 0.31267403855328524
Energy: 0.3392573795667808
Energy: 0.31267403855443693
Energy: 0.3392573795667808
Energy: 0.3329617599142927
Energy: 0.3126402233666158
Energy: 0.3329617599146766
Energy: 0.31264022336623193
Energy: 0.33296175991506044
Energy: 0.31264022336623193
Energy: 0.30124932868136517
Energy: 0.3435396268468122
Energy: 0.3012493286805974
Energy: 0.34353962684642836
Energy: 0.30124932868098125
Energy: 0.34353962684642836
Energy: 0.31258953928144745
Energy: 0.3182122195038191
Energy: 0.31258953928183136
Energy: 0.3182122195038191
Energy: 0.31258953928183136
Energy: 0.3182122195038191
Energy: 0.310943706941091
Energy: 0.385877314931695
Energy: 0.31094370694147494
Energy: 0.385877314931695
Energy: 0.31094370694185874
Energy: 0.385877314931695
Energy: 0.30873010916720794
Energy: 0.34432554550219663
Energy: 0.3087301091668241
Energy: 0.34432554550219663
Energy: 0.30873010916720794
Energy: 0.34432554550258054
Energy: 0.31275718616999565
Energy: 0.30768237956268674
Energy: 0.31275718616999565
Energy: 0.30768237956268674
Energy: 0.3127571861707634
Energy: 0.30768237956268674
Energy: 0.30165721202698426
Energy: 0.3456031440735413
Energy: 0.3016572120281359
Energy: 0.34560314407392523
Energy: 0.3016572120273681
Energy: 0.34560314407277354
Energy: 0.35811245807693476
Energy: 0.38642108261240443
Energy: 0.35811245807655095
Energy: 0.38642108261240443
Energy: 0.35811245807616704
Energy: 0.38642108261240443
Energy: 0.32550317910139986
Energy: 0.29917850582255706
Energy: 0.32550317910178383
Energy: 0.29917850582332484
Energy: 0.32550317910178383
Energy: 0.299178505822941
Energy: 0.2807093569051965
Energy: 0.3448832121688207
Energy: 0.2807093569044287
Energy: 0.3448832121692046
Energy: 0.2807093569048126
Energy: 0.3448832121692046

minimum gb energy = 0.2807093569044287 eV
minimum distance =  2.61255161501947 Angstroms
sigma value = 81


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

Energy: 0.1472099576542897
Energy: 0.16469492326979956
Energy: 0.021512714701501612
Energy: 0.16469492326979956
Energy: 0.1472099576545782
Energy: 0.16469492326938281
Energy: 0.37908371463353613
Energy: 0.022517480321295864
Energy: 0.37908371463353613
Energy: 0.022517480321151615
Energy: 0.37908371463353613
Energy: 0.022517480319885375
Energy: 0.35162792271230064
Energy: 0.02196123630094736
Energy: 0.3516279227125732
Energy: 0.02196123630094736
Energy: 0.35162792271230064
Energy: 0.021961236300514594
Energy: 0.021512714701501612
Energy: 0.16469492327008808
Energy: 0.021512714701501612
Energy: 0.16469492327008808
Energy: 0.021512714701501612
Energy: 0.16469492326923857
Energy: 0.37908371463353613
Energy: 0.02251748032297884
Energy: 0.3790837146334079
Energy: 0.02251748032285062
Energy: 0.37908371463353613
Energy: 0.022517480322417852
Energy: 0.3516279227127175
Energy: 0.021961236301796864
Energy: 0.351627922713006
Energy: 0.021961236301796864
Energy: 0.3516279227125732
Energy: 0.021961236301364095
Energy: 0.1472099576542897
Energy: 0.16469492327021631
Energy: 0.021512714701501612
Energy: 0.16469492327021631
Energy: 0.14720995765443395
Energy: 0.16469492326979956
Energy: 0.3790837146331194
Energy: 0.022517480327082104
Energy: 0.3790837146332636
Energy: 0.022517480326937844
Energy: 0.37908371463297513
Energy: 0.02251748032735458
Energy: 0.35162792271186794
Energy: 0.021961236301796864
Energy: 0.3516279227121564
Energy: 0.021961236301796864
Energy: 0.35162792271201215
Energy: 0.021961236301364095
Energy: 0.021512714701501612
Energy: 0.16469492326923857
Energy: 0.02151271470164587
Energy: 0.16469492326923857
Energy: 0.021512714701501612
Energy: 0.16469492326909432

minimum gb energy = 0.021512714701501612 eV
minimum distance =  2.8050167212376 Angstroms
sigma value = 3


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

Energy: 0.33367467372400306
Energy: 0.30197257073123596
Energy: 0.33367467372400306
Energy: 0.301972570731658
Energy: 0.33367467372400306
Energy: 0.301972570731658
Energy: 0.29834370901827656
Energy: 0.30494095264554316
Energy: 0.29834370901827656
Energy: 0.304940952645121
Energy: 0.29834370901827656
Energy: 0.30494095264554316
Energy: 0.3046109372239509
Energy: 0.3015449551341183
Energy: 0.3046109372239509
Energy: 0.3015449551345404
Energy: 0.3046109372239509
Energy: 0.3015449551345404
Energy: 0.33009792913160485
Energy: 0.29149483744641846
Energy: 0.330097929132027
Energy: 0.29149483744684057
Energy: 0.330097929132027
Energy: 0.29149483744641846
Energy: 0.2596044064567239
Energy: 0.3050937478485145
Energy: 0.259604406457568
Energy: 0.3050937478480924
Energy: 0.25960440645714594
Energy: 0.3050937478485145
Energy: 0.3063516335277185
Energy: 0.3069468144034804
Energy: 0.3063516335277185
Energy: 0.3069468144039024
Energy: 0.3063516335277185
Energy: 0.3069468144034804
Energy: 0.3064656530553111
Energy: 0.2950553794933216
Energy: 0.3064656530553111
Energy: 0.2950553794933216
Energy: 0.3064656530553111
Energy: 0.2950553794933216
Energy: 0.2578118715196519
Energy: 0.30478711736600206
Energy: 0.2578118715196519
Energy: 0.30478711736557995
Energy: 0.2578118715196519
Energy: 0.30478711736557995
Energy: 0.31164628693877955
Energy: 0.3086804114386016
Energy: 0.31164628693877955
Energy: 0.3086804114386016
Energy: 0.31164628693877955
Energy: 0.3086804114386016
Energy: 0.294345737038639
Energy: 0.27853517336860706
Energy: 0.29434573703906103
Energy: 0.27853517336860706
Energy: 0.294345737038639
Energy: 0.27853517336860706
Energy: 0.27437242988480576
Energy: 0.30409567273748717
Energy: 0.2743724298852279
Energy: 0.3040956727379093
Energy: 0.27437242988564997
Energy: 0.3040956727379093
Energy: 0.31954221545382194
Energy: 0.3224123733998456
Energy: 0.319542215454244
Energy: 0.3224123733998456
Energy: 0.31954221545382194
Energy: 0.3224123733998456
Energy: 0.3049095618137222
Energy: 0.2625945523264508
Energy: 0.3049095618137222
Energy: 0.2625945523264508
Energy: 0.30490956181330015
Energy: 0.2625945523264508
Energy: 0.28669669949448845
Energy: 0.31591576825394446
Energy: 0.2866966994949105
Energy: 0.31591576825436657
Energy: 0.28669669949448845
Energy: 0.31591576825436657
Energy: 0.3057002961926166
Energy: 0.31335712661247994
Energy: 0.30570029619219447
Energy: 0.3133571266120578
Energy: 0.3057002961930387
Energy: 0.31335712661247994
Energy: 0.30314072565210265
Energy: 0.25914261435935787
Energy: 0.3031407256516806
Energy: 0.25914261435935787
Energy: 0.30314072565210265
Energy: 0.25914261435935787
Energy: 0.30233001754119215
Energy: 0.324908025750497
Energy: 0.3023300175416142
Energy: 0.324908025750497
Energy: 0.30233001754119215
Energy: 0.324908025750497
Energy: 0.30603710433332737
Energy: 0.3007037744254168
Energy: 0.3060371043337495
Energy: 0.3007037744254168
Energy: 0.30603710433332737
Energy: 0.3007037744249947
Energy: 0.30690859872897414
Energy: 0.28967578247255316
Energy: 0.30690859872897414
Energy: 0.2896757824729753
Energy: 0.3069085987293962
Energy: 0.28967578247255316
Energy: 0.29573452010701834
Energy: 0.34766612310685857
Energy: 0.29573452010659623
Energy: 0.34766612310685857
Energy: 0.29573452010701834
Energy: 0.3476661231064365
Energy: 0.3189754551199589
Energy: 0.29733602077652316
Energy: 0.31897545511953673
Energy: 0.29733602077652316
Energy: 0.31897545511953673
Energy: 0.29733602077652316
Energy: 0.30049780984526425
Energy: 0.2931587187068249
Energy: 0.30049780984484215
Energy: 0.2931587187059807
Energy: 0.30049780984442004
Energy: 0.2931587187059807
Energy: 0.3015847730584712
Energy: 0.2967885597898054
Energy: 0.3015847730580491
Energy: 0.2967885597898054
Energy: 0.3015847730584712
Energy: 0.2967885597898054
Energy: 0.30609657360810066
Energy: 0.2964282691330458
Energy: 0.30609657360810066
Energy: 0.2964282691330458
Energy: 0.30609657360767856
Energy: 0.2964282691330458
Energy: 0.3078418749168891
Energy: 0.3055754466702853
Energy: 0.307841874916467
Energy: 0.3055754466702853
Energy: 0.30784187491731113
Energy: 0.3055754466702853
Energy: 0.29612352029943745
Energy: 0.3079977900090544
Energy: 0.29612352029943745
Energy: 0.3079977900086323
Energy: 0.29612352029943745
Energy: 0.30799779000821026
Energy: 0.3502469735729538
Energy: 0.25792561930329017
Energy: 0.350246973573376
Energy: 0.25792561930329017
Energy: 0.3502469735729538
Energy: 0.25792561930329017
Energy: 0.3057839374481864
Energy: 0.3140775869206836
Energy: 0.30578393744860854
Energy: 0.3140775869206836
Energy: 0.3057839374481864
Energy: 0.3140775869206836
Energy: 0.28844465063167185
Energy: 0.30449729679404197
Energy: 0.2884446506312498
Energy: 0.3044972967944641
Energy: 0.2884446506312498
Energy: 0.30449729679404197
Energy: 0.3459156422920849
Energy: 0.27548752630987416
Energy: 0.3459156422920849
Energy: 0.27548752630987416
Energy: 0.345915642292507
Energy: 0.27548752630987416
Energy: 0.32210740205039784
Energy: 0.3120770759191026
Energy: 0.32210740205039784
Energy: 0.3120770759191026
Energy: 0.32210740205039784
Energy: 0.3120770759191026
Energy: 0.27582310449784886
Energy: 0.29789903763971165
Energy: 0.27582310449784886
Energy: 0.29789903763971165
Energy: 0.275823104498271
Energy: 0.29789903763971165
Energy: 0.3123768866914435
Energy: 0.3026488418347356
Energy: 0.3123768866914435
Energy: 0.3026488418347356
Energy: 0.3123768866914435
Energy: 0.3026488418347356

minimum gb energy = 0.2578118715196519 eV
minimum distance =  2.67931325386505 Angstroms
sigma value = 67


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

Energy: 0.41264579557257236
Energy: 0.375135868709596
Energy: 0.41264579557257236
Energy: 0.3751358687101974
Energy: 0.412645795571971
Energy: 0.3751358687101974
Energy: 0.3721009310752681
Energy: 0.38157494262319125
Energy: 0.3721009310752681
Energy: 0.38157494262379277
Energy: 0.3721009310752681
Energy: 0.38157494262319125
Energy: 0.39228707317790507
Energy: 0.3899580185730023
Energy: 0.39228707317730366
Energy: 0.3899580185730023
Energy: 0.39228707317730366
Energy: 0.3899580185730023
Energy: 0.39905569092495197
Energy: 0.3829863222022018
Energy: 0.39905569092495197
Energy: 0.3829863222022018
Energy: 0.39905569092555343
Energy: 0.3829863222022018
Energy: 0.33560924981626666
Energy: 0.3663611758342422
Energy: 0.33560924981626666
Energy: 0.36636117583364075
Energy: 0.3356092498156652
Energy: 0.3663611758342422
Energy: 0.39204614069971916
Energy: 0.38701164060362236
Energy: 0.3920461406991177
Energy: 0.38701164060362236
Energy: 0.3920461406991177
Energy: 0.38701164060362236
Energy: 0.36925878043757704
Energy: 0.36270963211508633
Energy: 0.36925878043757704
Energy: 0.36270963211568774
Energy: 0.3692587804369756
Energy: 0.36270963211568774
Energy: 0.36614754674298217
Energy: 0.36616155458201577
Energy: 0.36614754674298217
Energy: 0.36616155458081295
Energy: 0.36614754674298217
Energy: 0.36616155458201577
Energy: 0.40234974901403653
Energy: 0.4080185518788719
Energy: 0.402349749014638
Energy: 0.4080185518788719
Energy: 0.40234974901403653
Energy: 0.40801855187947333
Energy: 0.3823626441098174
Energy: 0.3431488984684418
Energy: 0.3823626441098174
Energy: 0.3431488984684418
Energy: 0.38236264410921594
Energy: 0.34314889847084756
Energy: 0.37905769681283896
Energy: 0.39162691312521514
Energy: 0.37905769681283896
Energy: 0.39162691312521514
Energy: 0.37905769681344037
Energy: 0.39162691312521514
Energy: 0.37128491605145625
Energy: 0.38845291985916686
Energy: 0.37128491605085484
Energy: 0.38845291985916686
Energy: 0.37128491605085484
Energy: 0.38845291985916686
Energy: 0.3820302165649726
Energy: 0.36860841403257
Energy: 0.3820302165649726
Energy: 0.36860841403257
Energy: 0.3820302165643712
Energy: 0.36860841403196865
Energy: 0.3725988596451084
Energy: 0.3915846315589692
Energy: 0.3725988596457098
Energy: 0.39158463155957063
Energy: 0.3725988596451084
Energy: 0.39158463155957063
Energy: 0.37659023908703165
Energy: 0.3713951519429758
Energy: 0.37659023908703165
Energy: 0.3713951519429758
Energy: 0.3765902390864303
Energy: 0.3713951519429758
Energy: 0.39656102554615996
Energy: 0.3770949879978396
Energy: 0.39656102554676137
Energy: 0.3770949879978396
Energy: 0.39656102554615996
Energy: 0.3770949879978396
Energy: 0.3844259101760724
Energy: 0.39300659012419537
Energy: 0.3844259101760724
Energy: 0.39300659012419537
Energy: 0.3844259101760724
Energy: 0.39300659012419537
Energy: 0.38558797088746644
Energy: 0.36536762339716167
Energy: 0.38558797088746644
Energy: 0.36536762339716167
Energy: 0.38558797088746644
Energy: 0.36536762339716167
Energy: 0.3847567751268883
Energy: 0.3948407745236738
Energy: 0.3847567751268883
Energy: 0.3948407745236738
Energy: 0.3847567751268883
Energy: 0.3948407745236738
Energy: 0.3367926565323761
Energy: 0.3904040531059124
Energy: 0.33679265653478185
Energy: 0.3904040531059124
Energy: 0.336792656533579
Energy: 0.3904040531059124
Energy: 0.40362678169465405
Energy: 0.3680270128017746
Energy: 0.4036267816952554
Energy: 0.3680270128017746
Energy: 0.4036267816958569
Energy: 0.3680270128017746
Energy: 0.40074166132820677
Energy: 0.4094892815936574
Energy: 0.4007416613294095
Energy: 0.4094892815936574
Energy: 0.4007416613288081
Energy: 0.4094892815936574
Energy: 0.33727453179166034
Energy: 0.389815894886599
Energy: 0.33727453179166034
Energy: 0.389815894886599
Energy: 0.3372745317910589
Energy: 0.389815894886599

minimum gb energy = 0.3356092498156652 eV
minimum distance =  2.66870279859707 Angstroms
sigma value = 33


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

Energy: 0.4621308786161101
Energy: 0.41596720180506486
Energy: 0.4621308786157286
Energy: 0.4159672018054464
Energy: 0.4621308786157286
Energy: 0.41596720180506486
Energy: 0.4163620432349061
Energy: 0.42727664503200796
Energy: 0.4163620432349061
Energy: 0.42727664503200796
Energy: 0.41636204323452464
Energy: 0.42727664503200796
Energy: 0.4424225152008188
Energy: 0.43315736690700796
Energy: 0.44242251520120035
Energy: 0.4331573669066265
Energy: 0.4424225152008188
Energy: 0.4331573669066265
Energy: 0.44233735178928685
Energy: 0.42402265511269344
Energy: 0.44233735178852374
Energy: 0.424022655113075
Energy: 0.44233735178890526
Energy: 0.424022655113075
Energy: 0.42130183856254205
Energy: 0.42673720565124623
Energy: 0.4213018385621605
Energy: 0.42673720565124623
Energy: 0.42130183856254205
Energy: 0.42673720565124623
Energy: 0.4685273941368683
Energy: 0.46145571822128506
Energy: 0.4685273941364868
Energy: 0.46145571822128506
Energy: 0.4685273941364868
Energy: 0.46145571822128506
Energy: 0.4188944820774035
Energy: 0.4041681505713243
Energy: 0.4188944820774035
Energy: 0.4041681505709428
Energy: 0.4188944820781666
Energy: 0.4041681505709428
Energy: 0.4453434150723123
Energy: 0.4398566977003572
Energy: 0.4453434150719307
Energy: 0.4398566977003572
Energy: 0.4453434150723123
Energy: 0.4398566977003572
Energy: 0.421098771493461
Energy: 0.4451509371331728
Energy: 0.421098771492698
Energy: 0.4451509371335543
Energy: 0.4210987714930795
Energy: 0.4451509371335543
Energy: 0.4541935154856803
Energy: 0.42060559891068466
Energy: 0.4541935154852988
Energy: 0.4206055989103031
Energy: 0.4541935154860618
Energy: 0.42060559891068466
Energy: 0.433875642061749
Energy: 0.4341428119476968
Energy: 0.433875642062512
Energy: 0.4341428119476968
Energy: 0.4338756420621305
Energy: 0.4341428119476968
Energy: 0.41969113466500807
Energy: 0.41998608533931187
Energy: 0.4196911346653896
Energy: 0.41998608533931187
Energy: 0.4196911346653896
Energy: 0.41998608533931187
Energy: 0.45819847609010433
Energy: 0.4203783090981646
Energy: 0.45819847609010433
Energy: 0.4203783090985462
Energy: 0.4581984760893413
Energy: 0.4203783090981646
Energy: 0.4216071919292382
Energy: 0.43611356532369555
Energy: 0.4216071919292382
Energy: 0.4361135653240771
Energy: 0.42160719192961976
Energy: 0.4361135653240771
Energy: 0.43419557230725
Energy: 0.42699396386470434
Energy: 0.43419557230648687
Energy: 0.42699396386470434
Energy: 0.43419557230686845
Energy: 0.42699396386470434
Energy: 0.44194846852367065
Energy: 0.44397078661721123
Energy: 0.44194846852328906
Energy: 0.44397078661721123
Energy: 0.44194846852252606
Energy: 0.44397078661721123
Energy: 0.38907667484723124
Energy: 0.43362416442037105
Energy: 0.3890766748464681
Energy: 0.43362416442075263
Energy: 0.389076674845705
Energy: 0.43362416442075263
Energy: 0.4551384055280034
Energy: 0.4659328796667027
Energy: 0.45513840552724033
Energy: 0.4659328796667027
Energy: 0.4551384055276218
Energy: 0.4659328796663212
Energy: 0.41892288628297897
Energy: 0.4503858973157488
Energy: 0.41892288628297897
Energy: 0.4503858973157488
Energy: 0.41892288628259744
Energy: 0.4503858973157488
Energy: 0.41877360975990424
Energy: 0.44356352033100704
Energy: 0.41877360975990424
Energy: 0.4435635203313886
Energy: 0.4187736097595227
Energy: 0.44356352033100704
Energy: 0.4424873082759159
Energy: 0.44329218826945455
Energy: 0.4424873082759159
Energy: 0.44329218826983613
Energy: 0.44248730827629745
Energy: 0.44329218826983613
Energy: 0.4313024023561671
Energy: 0.41115404878969025
Energy: 0.43130240235540407
Energy: 0.41115404878969025
Energy: 0.4313024023561671
Energy: 0.41115404878969025
Energy: 0.4375459655824612
Energy: 0.4344412099222792
Energy: 0.4375459655820797
Energy: 0.4344412099222792
Energy: 0.4375459655820797
Energy: 0.4344412099222792
Energy: 0.4524755491108416
Energy: 0.41898831410859255
Energy: 0.4524755491104601
Energy: 0.41898831410859255
Energy: 0.4524755491112231
Energy: 0.41898831410859255
Energy: 0.417186363538245
Energy: 0.42944183929871954
Energy: 0.41718636353862654
Energy: 0.42944183929871954
Energy: 0.4171863635378635
Energy: 0.4294418392991011
Energy: 0.4433162342140838
Energy: 0.44193541405811126
Energy: 0.4433162342140838
Energy: 0.44193541405849274
Energy: 0.4433162342140838
Energy: 0.44193541405811126
Energy: 0.4186704741640603
Energy: 0.4110989469243819
Energy: 0.4186704741644418
Energy: 0.4110989469240004
Energy: 0.41867047416367864
Energy: 0.4110989469240004
Energy: 0.44457702080928835
Energy: 0.46016595652777326
Energy: 0.44457702081005135
Energy: 0.46016595652739173
Energy: 0.4445770208096698
Energy: 0.46016595652739173
Energy: 0.4148023490842602
Energy: 0.4265134713907306
Energy: 0.4148023490823525
Energy: 0.4265134713907306
Energy: 0.41480234908311564
Energy: 0.4265134713907306
Energy: 0.41606474364221985
Energy: 0.40219268726336305
Energy: 0.41606474364221985
Energy: 0.40219268726336305
Energy: 0.41606474364221985
Energy: 0.4021926872637445
Energy: 0.4676050215955861
Energy: 0.45946007219859936
Energy: 0.4676050215955861
Energy: 0.45946007219859936
Energy: 0.4676050215959676
Energy: 0.45946007219859936
Energy: 0.39802550935141323
Energy: 0.4269280631339319
Energy: 0.39802550935141323
Energy: 0.4269280631335504
Energy: 0.3980255093517948
Energy: 0.4269280631335504
Energy: 0.44329099071252903
Energy: 0.4663953175083236
Energy: 0.4432909907121475
Energy: 0.46639531750870517
Energy: 0.44329099071252903
Energy: 0.4663953175083236
Energy: 0.4320702069296548
Energy: 0.4278284087448393
Energy: 0.4320702069296548
Energy: 0.4278284087448393
Energy: 0.4320702069296548
Energy: 0.4278284087448393
Energy: 0.4185503523227197
Energy: 0.43346193770712277
Energy: 0.4185503523231012
Energy: 0.43346193770712277
Energy: 0.4185503523227197
Energy: 0.4334619377075043
Energy: 0.48820002505068716
Energy: 0.4160345345681329
Energy: 0.4882000250514502
Energy: 0.4160345345677513
Energy: 0.4882000250514502
Energy: 0.4160345345681329
Energy: 0.41824307401026795
Energy: 0.427807697132097
Energy: 0.41824307401026795
Energy: 0.427807697132097
Energy: 0.41824307401026795
Energy: 0.427807697132097

minimum gb energy = 0.389076674845705 eV
minimum distance =  2.64906526294402 Angstroms
sigma value = 41


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

Energy: 0.5187857243751763
Energy: 0.49096161855969467
Energy: 0.5187857243751763
Energy: 0.49096161855969467
Energy: 0.5187857243751763
Energy: 0.49096161855969467
Energy: 0.48335499546631283
Energy: 0.5038605855144103
Energy: 0.4833549954652711
Energy: 0.5038605855144103
Energy: 0.48335499546631283
Energy: 0.5038605855144103
Energy: 0.5432070097988877
Energy: 0.4975173601934031
Energy: 0.5432070097999294
Energy: 0.4975173601934031
Energy: 0.5432070097988877
Energy: 0.4975173601934031
Energy: 0.5224278302489547
Energy: 0.5204478058414536
Energy: 0.5224278302499964
Energy: 0.5204478058414536
Energy: 0.5224278302489547
Energy: 0.5204478058414536
Energy: 0.47653198585533474
Energy: 0.4928130581304077
Energy: 0.47653198585533474
Energy: 0.4928130581314494
Energy: 0.47653198585533474
Energy: 0.4928130581304077
Energy: 0.5539139202123708
Energy: 0.5338046615232583
Energy: 0.5539139202123708
Energy: 0.5338046615232583
Energy: 0.5539139202123708
Energy: 0.5338046615232583
Energy: 0.5136744461607964
Energy: 0.4714088627036133
Energy: 0.5136744461607964
Energy: 0.4714088627036133
Energy: 0.5136744461607964
Energy: 0.4714088627036133
Energy: 0.5133512511590448
Energy: 0.5001160059477794
Energy: 0.5133512511580031
Energy: 0.5001160059477794
Energy: 0.5133512511590448
Energy: 0.5001160059477794
Energy: 0.484264204885835
Energy: 0.48410981354745536
Energy: 0.48426420488479327
Energy: 0.48410981354745536
Energy: 0.484264204885835
Energy: 0.48410981354745536
Energy: 0.515404504343646
Energy: 0.49662100754189586
Energy: 0.515404504343646
Energy: 0.49662100754189586
Energy: 0.515404504343646
Energy: 0.49662100754189586
Energy: 0.4852589479032296
Energy: 0.4975501934249777
Energy: 0.4852589479032296
Energy: 0.4975501934249777
Energy: 0.4852589479032296
Energy: 0.4975501934249777
Energy: 0.5109931374975898
Energy: 0.5032388503910176
Energy: 0.5109931374975898
Energy: 0.5032388503910176
Energy: 0.5109931374975898
Energy: 0.5032388503910176
Energy: 0.5195810880021847
Energy: 0.5207652328048086
Energy: 0.5195810880021847
Energy: 0.5207652328048086
Energy: 0.5195810880021847
Energy: 0.5207652328048086
Energy: 0.48016000249968854
Energy: 0.5040677532214389
Energy: 0.48016000249968854
Energy: 0.5040677532214389
Energy: 0.48016000249968854
Energy: 0.5040677532214389

minimum gb energy = 0.4714088627036133 eV
minimum distance =  2.62389235417438 Angstroms
sigma value = 11


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

Energy: 0.60043359652729
Energy: 0.5775432675273344
Energy: 0.60043359652729
Energy: 0.5775432675273344
Energy: 0.60043359652729
Energy: 0.5775432675273344
Energy: 0.5286393558510132
Energy: 0.5566468469231786
Energy: 0.5286393558510132
Energy: 0.5566468469231786
Energy: 0.5286393558510132
Energy: 0.5566468469231786
Energy: 0.5615319472146001
Energy: 0.5583107778596121
Energy: 0.5615319472150577
Energy: 0.5583107778591544
Energy: 0.5615319472150577
Energy: 0.5583107778596121
Energy: 0.5598077206120938
Energy: 0.5286897340469078
Energy: 0.5598077206125515
Energy: 0.5286897340469078
Energy: 0.5598077206116362
Energy: 0.5286897340469078
Energy: 0.5682557566658492
Energy: 0.5543499430799617
Energy: 0.5682557566653915
Energy: 0.5543499430799617
Energy: 0.5682557566653915
Energy: 0.5543499430799617
Energy: 0.5477239444737179
Energy: 0.5722013361619546
Energy: 0.5477239444732601
Energy: 0.5722013361619546
Energy: 0.5477239444732601
Energy: 0.5722013361619546
Energy: 0.5635659839419799
Energy: 0.5549672347800919
Energy: 0.5635659839419799
Energy: 0.5549672347800919
Energy: 0.5635659839419799
Energy: 0.5549672347800919
Energy: 0.5512358878840491
Energy: 0.5613461577385905
Energy: 0.5512358878840491
Energy: 0.5613461577385905
Energy: 0.5512358878840491
Energy: 0.5613461577385905
Energy: 0.561559733441475
Energy: 0.5550633642943317
Energy: 0.561559733441475
Energy: 0.5550633642943317
Energy: 0.5615597334410175
Energy: 0.5550633642943317
Energy: 0.5535330083946134
Energy: 0.5582697598348966
Energy: 0.5535330083946134
Energy: 0.5582697598348966
Energy: 0.5535330083946134
Energy: 0.5582697598348966
Energy: 0.5334557327835281
Energy: 0.5541748108748785
Energy: 0.5334557327835281
Energy: 0.5541748108748785
Energy: 0.5334557327839858
Energy: 0.5541748108748785
Energy: 0.5612310624819266
Energy: 0.5780996386568228
Energy: 0.5612310624823841
Energy: 0.5780996386568228
Energy: 0.5612310624823841
Energy: 0.5780996386568228
Energy: 0.5607674924509338
Energy: 0.5428408494110405
Energy: 0.5607674924509338
Energy: 0.5428408494110405
Energy: 0.5607674924513913
Energy: 0.5428408494110405
Energy: 0.5527973253503097
Energy: 0.5659054780831875
Energy: 0.5527973253493945
Energy: 0.5659054780827298
Energy: 0.5527973253498522
Energy: 0.5659054780831875
Energy: 0.5457498021121976
Energy: 0.5526422472179677
Energy: 0.5457498021121976
Energy: 0.5526422472179677
Energy: 0.54574980211174
Energy: 0.5526422472179677
Energy: 0.5591723458559612
Energy: 0.5449576920641352
Energy: 0.5591723458568765
Energy: 0.5449576920636775
Energy: 0.5591723458564188
Energy: 0.5449576920641352
Energy: 0.5353252586152255
Energy: 0.5574909421737132
Energy: 0.5353252586152255
Energy: 0.5574909421737132
Energy: 0.535325258615683
Energy: 0.5574909421737132
Energy: 0.579064281035053
Energy: 0.5714338931231021
Energy: 0.579064281035053
Energy: 0.5714338931231021
Energy: 0.579064281035053
Energy: 0.5714338931235599
Energy: 0.5432131068508695
Energy: 0.519121342920423
Energy: 0.5432131068517848
Energy: 0.519121342920423
Energy: 0.5432131068508695
Energy: 0.519121342920423
Energy: 0.5485668627959324
Energy: 0.5540920147270446
Energy: 0.5485668627959324
Energy: 0.5540920147270446
Energy: 0.5485668627950172
Energy: 0.5540920147270446
Energy: 0.5331020715666802
Energy: 0.545994441854139
Energy: 0.5331020715671378
Energy: 0.545994441854139
Energy: 0.5331020715666802
Energy: 0.545994441854139
Energy: 0.5803673779351227
Energy: 0.5822234903539825
Energy: 0.5803673779351227
Energy: 0.5822234903539825
Energy: 0.5803673779351227
Energy: 0.5822234903539825
Energy: 0.5498447215003796
Energy: 0.5585287293295927
Energy: 0.5498447214999218
Energy: 0.5585287293295927
Energy: 0.5498447215003796
Energy: 0.5585287293295927
Energy: 0.5781234808247108
Energy: 0.5565522574297782
Energy: 0.5781234808251683
Energy: 0.5565522574297782
Energy: 0.5781234808242531
Energy: 0.5565522574297782
Energy: 0.5528634166007528
Energy: 0.5506179287088903
Energy: 0.5528634166012104
Energy: 0.5506179287093479
Energy: 0.5528634166007528
Energy: 0.5506179287093479
Energy: 0.5412050214279818
Energy: 0.5547588566529046
Energy: 0.5412050214279818
Energy: 0.5547588566529046
Energy: 0.5412050214279818
Energy: 0.5547588566529046
Energy: 0.5469389815503735
Energy: 0.5718375949398048
Energy: 0.5469389815503735
Energy: 0.5718375949393473
Energy: 0.5469389815503735
Energy: 0.5718375949398048
Energy: 0.5654849528484022
Energy: 0.5447315517470563
Energy: 0.5654849528479444
Energy: 0.5447315517470563
Energy: 0.5654849528484022
Energy: 0.5447315517470563
Energy: 0.5532766411223229
Energy: 0.5626930209318948
Energy: 0.5532766411223229
Energy: 0.5626930209318948
Energy: 0.5532766411223229
Energy: 0.5626930209318948
Energy: 0.5478555257382828
Energy: 0.5232100285110107
Energy: 0.5478555257387403
Energy: 0.5232100285110107
Energy: 0.5478555257387403
Energy: 0.5232100285110107
Energy: 0.5545626845913352
Energy: 0.5780610730191625
Energy: 0.5545626845917929
Energy: 0.5780610730191625
Energy: 0.5545626845917929
Energy: 0.5780610730191625

minimum gb energy = 0.519121342920423 eV
minimum distance =  2.5819202370291 Angstroms
sigma value = 57


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

Energy: 0.5357077227205226
Energy: 0.5223192639841666
Energy: 0.5357077227205226
Energy: 0.5223192639841666
Energy: 0.5357077227205226
Energy: 0.5223192639841666
Energy: 0.5628313904765376
Energy: 0.518022373361357
Energy: 0.5628313904757233
Energy: 0.518022373361357
Energy: 0.5628313904765376
Energy: 0.5180223733605426
Energy: 0.5699722771979181
Energy: 0.5493886994468727
Energy: 0.5699722771987324
Energy: 0.5493886994468727
Energy: 0.5699722771979181
Energy: 0.5493886994468727
Energy: 0.5343936174131121
Energy: 0.5307507846771856
Energy: 0.5343936174131121
Energy: 0.5307507846771856
Energy: 0.5343936174131121
Energy: 0.5307507846771856
Energy: 0.5700505424966062
Energy: 0.5494002547684916
Energy: 0.5700505424966062
Energy: 0.5494002547684916
Energy: 0.5700505424966062
Energy: 0.5494002547684916
Energy: 0.5625616863874985
Energy: 0.5246932536102564
Energy: 0.5625616863866842
Energy: 0.5246932536102564
Energy: 0.5625616863874985
Energy: 0.5246932536102564
Energy: 0.5357077227197082
Energy: 0.5223192639849811
Energy: 0.5357077227197082
Energy: 0.5223192639849811
Energy: 0.5357077227197082
Energy: 0.5223192639849811
Energy: 0.5628313904765376
Energy: 0.518022373361357
Energy: 0.5628313904765376
Energy: 0.5180223733605426
Energy: 0.5628313904765376
Energy: 0.5180223733605426
Energy: 0.5699722771987324
Energy: 0.5493886994460584
Energy: 0.5699722771995468
Energy: 0.5493886994460584
Energy: 0.5699722771979181
Energy: 0.5493886994460584
Energy: 0.5343936174122978
Energy: 0.5648201906684085
Energy: 0.5343936174131121
Energy: 0.5648201906684085
Energy: 0.5343936174122978
Energy: 0.5648201906684085
Energy: 0.570050542498235
Energy: 0.5494002547676958
Energy: 0.5700505424974206
Energy: 0.5494002547676958
Energy: 0.5700505424974206
Energy: 0.5494002547676958
Energy: 0.5625616863874985
Energy: 0.5246932536110707
Energy: 0.5625616863874985
Energy: 0.524693253611885
Energy: 0.5625616863874985
Energy: 0.5246932536110707
Energy: 0.5357077227205226
Energy: 0.5223192639841666
Energy: 0.5357077227205226
Energy: 0.5223192639841666
Energy: 0.5357077227205226
Energy: 0.5223192639841666
Energy: 0.5628313904765376
Energy: 0.518022373361357
Energy: 0.5628313904765376
Energy: 0.518022373361357
Energy: 0.5628313904765376
Energy: 0.5180223733605426
Energy: 0.5699722771987324
Energy: 0.5493886994468727
Energy: 0.5699722771979181
Energy: 0.5493886994468727
Energy: 0.5699722771979181
Energy: 0.5493886994468727
Energy: 0.5343936174131121
Energy: 0.564820190669223
Energy: 0.5343936174131121
Energy: 0.564820190669223
Energy: 0.5343936174122978
Energy: 0.564820190669223
Energy: 0.5700505424966062
Energy: 0.5494002547684916
Energy: 0.5700505424966062
Energy: 0.5494002547684916
Energy: 0.5700505424966062
Energy: 0.5494002547684916

minimum gb energy = 0.5180223733605426 eV
minimum distance =  2.63117133373667 Angstroms
sigma value = 9


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

Energy: 0.5848822181243516
Energy: 0.5947542889187232
Energy: 0.5848822181243516
Energy: 0.5947542889187232
Energy: 0.5848822181243516
Energy: 0.5947542889187232
Energy: 0.5678103275737694
Energy: 0.5688611401533223
Energy: 0.5678103275737694
Energy: 0.5688611401533223
Energy: 0.5678103275737694
Energy: 0.5688611401533223
Energy: 0.5647138942318869
Energy: 0.5663378957650699
Energy: 0.564713894231222
Energy: 0.5663378957650699
Energy: 0.5647138942318869
Energy: 0.5663378957650699
Energy: 0.5581293533619621
Energy: 0.5947012366209705
Energy: 0.5581293533612972
Energy: 0.5947012366209705
Energy: 0.5581293533619621
Energy: 0.5947012366209705
Energy: 0.5673752837546252
Energy: 0.5733754420246311
Energy: 0.5673752837546252
Energy: 0.5733754420246311
Energy: 0.5673752837539603
Energy: 0.5733754420246311
Energy: 0.5698634456434967
Energy: 0.5706518096662512
Energy: 0.5698634456428316
Energy: 0.5706518096655863
Energy: 0.5698634456428316
Energy: 0.5706518096662512
Energy: 0.5614027010603535
Energy: 0.5695079924908345
Energy: 0.5614027010596887
Energy: 0.5695079924908345
Energy: 0.5614027010603535
Energy: 0.5695079924908345
Energy: 0.5605863977748761
Energy: 0.5789431439009777
Energy: 0.560586397775541
Energy: 0.5789431439009777
Energy: 0.560586397775541
Energy: 0.5789431439016426
Energy: 0.5987110140369197
Energy: 0.5878973713012987
Energy: 0.5987110140382497
Energy: 0.5878973713012987
Energy: 0.5987110140362548
Energy: 0.5878973713012987
Energy: 0.5625422911560938
Energy: 0.5709943072134861
Energy: 0.5625422911560938
Energy: 0.5709943072134861
Energy: 0.5625422911560938
Energy: 0.5709943072134861
Energy: 0.5579382045650219
Energy: 0.5663683920669493
Energy: 0.5579382045643569
Energy: 0.5663683920669493
Energy: 0.5579382045643569
Energy: 0.5663683920669493
Energy: 0.590033378467499
Energy: 0.5713595041751995
Energy: 0.590033378468164
Energy: 0.5713595041751995
Energy: 0.590033378468164
Energy: 0.5713595041751995
Energy: 0.560230743657625
Energy: 0.580176035689647
Energy: 0.560230743657625
Energy: 0.5801760356903121
Energy: 0.560230743657625
Energy: 0.580176035689647
Energy: 0.5643225027756169
Energy: 0.5638214415903368
Energy: 0.564322502774952
Energy: 0.5638214415903368
Energy: 0.564322502774952
Energy: 0.5638214415903368
Energy: 0.5702855405971078
Energy: 0.5665109833805169
Energy: 0.5702855405964429
Energy: 0.5665109833805169
Energy: 0.5702855405971078
Energy: 0.5665109833805169
Energy: 0.5892905204042984
Energy: 0.5701822957654394
Energy: 0.5892905204042984
Energy: 0.5701822957654394
Energy: 0.5892905204042984
Energy: 0.5701822957654394
Energy: 0.5829440892616593
Energy: 0.5655274078797016
Energy: 0.5829440892623242
Energy: 0.5655274078797016
Energy: 0.5829440892616593
Energy: 0.5655274078797016
Energy: 0.6245644933172741
Energy: 0.5671605518508512
Energy: 0.6245644933166093
Energy: 0.5671605518515161
Energy: 0.6245644933172741
Energy: 0.5671605518515161
Energy: 0.5591741252923682
Energy: 0.5644095638915613
Energy: 0.5591741252930332
Energy: 0.5644095638922261
Energy: 0.5591741252930332
Energy: 0.5644095638922261
Energy: 0.5654713375787995
Energy: 0.5725029603693411
Energy: 0.5654713375781345
Energy: 0.572502960370006
Energy: 0.5654713375781345
Energy: 0.572502960370006
Energy: 0.5912106499488841
Energy: 0.5774676331144593
Energy: 0.591210649949549
Energy: 0.5774676331144593
Energy: 0.5912106499488841
Energy: 0.5774676331144593

minimum gb energy = 0.5579382045643569 eV
minimum distance =  2.59829852511064 Angstroms
sigma value = 27


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

Energy: 0.5903570862167213
Energy: 0.5556426401652302
Energy: 0.5903570862161609
Energy: 0.5556426401652302
Energy: 0.5903570862167213
Energy: 0.5556426401652302
Energy: 0.5731106254969389
Energy: 0.5609517354978999
Energy: 0.5731106254974994
Energy: 0.5609517354978999
Energy: 0.5731106254969389
Energy: 0.5609517354978999
Energy: 0.5428163307568966
Energy: 0.5579964406571382
Energy: 0.542816330757457
Energy: 0.5579964406571382
Energy: 0.5428163307568966
Energy: 0.5579964406565776
Energy: 0.5408476655883518
Energy: 0.5414039796128336
Energy: 0.5408476655883518
Energy: 0.5414039796122732
Energy: 0.5408476655883518
Energy: 0.5414039796128336
Energy: 0.5404444221736866
Energy: 0.5433550094924056
Energy: 0.5404444221736866
Energy: 0.543355009492966
Energy: 0.5404444221742469
Energy: 0.5433550094924056
Energy: 0.5292081246657901
Energy: 0.5768736882962868
Energy: 0.5292081246646692
Energy: 0.5768736882962868
Energy: 0.5292081246663506
Energy: 0.5768736882962868
Energy: 0.5590237249534412
Energy: 0.5613595576954304
Energy: 0.5590237249528808
Energy: 0.5613595576948699
Energy: 0.5590237249534412
Energy: 0.5613595576948699
Energy: 0.5589651299110829
Energy: 0.5432273102151407
Energy: 0.5589651299116434
Energy: 0.5432273102151407
Energy: 0.5589651299105224
Energy: 0.5432273102151407
Energy: 0.545417854026892
Energy: 0.5526609324167324
Energy: 0.5454178540274525
Energy: 0.5526609324167324
Energy: 0.545417854026892
Energy: 0.5526609324167324
Energy: 0.5406428361367447
Energy: 0.5459570575864093
Energy: 0.5406428361361841
Energy: 0.5459570575864093
Energy: 0.5406428361367447
Energy: 0.5459570575864093
Energy: 0.5406933559497108
Energy: 0.5555848042917313
Energy: 0.5406933559502713
Energy: 0.5555848042917313
Energy: 0.5406933559497108
Energy: 0.5555848042917313
Energy: 0.560078572371626
Energy: 0.5574679854767474
Energy: 0.560078572371626
Energy: 0.5574679854767474
Energy: 0.5600785723710654
Energy: 0.5574679854767474
Energy: 0.5658821560306727
Energy: 0.5586265098403643
Energy: 0.5658821560306727
Energy: 0.5586265098403643
Energy: 0.5658821560301123
Energy: 0.5586265098403643
Energy: 0.5502139155263506
Energy: 0.5448532540282316
Energy: 0.5502139155263506
Energy: 0.5448532540282316
Energy: 0.5502139155263506
Energy: 0.5448532540282316
Energy: 0.5328426355338575
Energy: 0.5766542755271553
Energy: 0.5328426355338575
Energy: 0.5766542755271553
Energy: 0.5328426355344178
Energy: 0.5766542755271553
Energy: 0.5542806723862324
Energy: 0.543515030178509
Energy: 0.5542806723862324
Energy: 0.543515030178509
Energy: 0.5542806723856718
Energy: 0.543515030178509
Energy: 0.5516742763998373
Energy: 0.5439519190225526
Energy: 0.5516742763998373
Energy: 0.5439519190225526
Energy: 0.5516742763998373
Energy: 0.5439519190225526
Energy: 0.54160658685686
Energy: 0.5483676306625861
Energy: 0.5416065868574205
Energy: 0.5483676306625861
Energy: 0.5416065868574205
Energy: 0.5483676306625861
Energy: 0.517347729973935
Energy: 0.5400070336157675
Energy: 0.517347729973935
Energy: 0.5400070336157675
Energy: 0.5173477299744955
Energy: 0.5400070336157675
Energy: 0.5903570862161609
Energy: 0.5556426401663512
Energy: 0.5903570862161609
Energy: 0.5556426401652302
Energy: 0.5903570862161609
Energy: 0.5556426401657908
Energy: 0.5731106254986204
Energy: 0.5609517354962185
Energy: 0.5731106254986204
Energy: 0.5609517354962185
Energy: 0.5731106254986204
Energy: 0.5609517354962185
Energy: 0.542816330757457
Energy: 0.5579964406565776
Energy: 0.5428163307580176
Energy: 0.5579964406565776
Energy: 0.5428163307580176
Energy: 0.5579964406565776
Energy: 0.5408476655877914
Energy: 0.5414039796111522
Energy: 0.5408476655883518
Energy: 0.5414039796111522
Energy: 0.5408476655883518
Energy: 0.5414039796111522
Energy: 0.5404444221742469
Energy: 0.543355009490724
Energy: 0.5404444221736866
Energy: 0.543355009490724
Energy: 0.5404444221742469
Energy: 0.543355009490724
Energy: 0.5292081246674717
Energy: 0.5768736882985287
Energy: 0.5292081246674717
Energy: 0.5768736882985287
Energy: 0.5292081246663506
Energy: 0.5768736882979681

minimum gb energy = 0.517347729973935 eV
minimum distance =  2.60882607269341 Angstroms
sigma value = 19


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

Energy: 0.5493283423323407
Energy: 0.5501804949609893
Energy: 0.5493283423323407
Energy: 0.5501804949609893
Energy: 0.5493283423333084
Energy: 0.5501804949609893
Energy: 0.5510356460352315
Energy: 0.542146638301279
Energy: 0.5510356460347697
Energy: 0.542146638301279
Energy: 0.5510356460352315
Energy: 0.542146638301279
Energy: 0.5515255317594633
Energy: 0.5238766569058236
Energy: 0.5515255317594633
Energy: 0.5238766569058236
Energy: 0.5515255317594633
Energy: 0.5238766569058236
Energy: 0.5305870552118142
Energy: 0.5515065368119175
Energy: 0.5305870552118142
Energy: 0.5515065368119175
Energy: 0.5305870552118142
Energy: 0.5515065368119175
Energy: 0.5468070101923181
Energy: 0.5594740982780133
Energy: 0.5468070101918343
Energy: 0.5594740982780133
Energy: 0.5468070101923181
Energy: 0.5594740982784971
Energy: 0.5562440913829318
Energy: 0.5341041195118511
Energy: 0.5562440913829318
Energy: 0.5341041195113673
Energy: 0.5562440913829318
Energy: 0.5341041195113673
Energy: 0.5245700584661575
Energy: 0.5869029666602231
Energy: 0.5245700584661575
Energy: 0.5869029666602231
Energy: 0.5245700584661575
Energy: 0.5869029666602231
Energy: 0.5468352639970973
Energy: 0.5897773805955253
Energy: 0.5468352639970973
Energy: 0.5897773805955253
Energy: 0.546835263997581
Energy: 0.5897773805955253
Energy: 0.5724490472990851
Energy: 0.5226723968193602
Energy: 0.5724490472986012
Energy: 0.5226723968193602
Energy: 0.5724490472990851
Energy: 0.5226723968193602
Energy: 0.5576761134823517
Energy: 0.5477760840331684
Energy: 0.5576761134823517
Energy: 0.5477760840331684
Energy: 0.5576761134828354
Energy: 0.5477760840331684
Energy: 0.5267064666476675
Energy: 0.5902607542779731
Energy: 0.5267064666476675
Energy: 0.5902607542779731
Energy: 0.5267064666471838
Energy: 0.5902607542779731
Energy: 0.5522691437772719
Energy: 0.5227522541548794
Energy: 0.552269143776788
Energy: 0.5227522541548794
Energy: 0.5522691437777557
Energy: 0.5227522541548794
Energy: 0.5461647874067482
Energy: 0.5421969023322469
Energy: 0.5461647874057806
Energy: 0.5421969023322469
Energy: 0.5461647874067482
Energy: 0.5421969023322469
Energy: 0.5326639382700533
Energy: 0.5460349063842473
Energy: 0.5326639382700533
Energy: 0.5460349063842473
Energy: 0.5326639382700533
Energy: 0.5460349063842473
Energy: 0.5581520471683913
Energy: 0.5289526855744189
Energy: 0.5581520471683913
Energy: 0.5289526855744189
Energy: 0.5581520471683913
Energy: 0.5289526855739352
Energy: 0.547845221013119
Energy: 0.5253910895865889
Energy: 0.547845221013119
Energy: 0.5253910895865889
Energy: 0.5478452210126352
Energy: 0.5253910895865889
Energy: 0.530395992225567
Energy: 0.5490634377641355
Energy: 0.530395992225567
Energy: 0.5490634377641355
Energy: 0.530395992225567
Energy: 0.5490634377641355
Energy: 0.5519658867433165
Energy: 0.5647878291742914
Energy: 0.5519658867428328
Energy: 0.5647878291742914
Energy: 0.5519658867428328
Energy: 0.5647878291742914
Energy: 0.5415119885093758
Energy: 0.5324091484721324
Energy: 0.5415119885093758
Energy: 0.5324091484721324
Energy: 0.5415119885088919
Energy: 0.5324091484721324
Energy: 0.5360041998442707
Energy: 0.5492250492708628
Energy: 0.5360041998442707
Energy: 0.5492250492708628
Energy: 0.5360041998442707
Energy: 0.5492250492708628
Energy: 0.5260123580208147
Energy: 0.5549584989091484
Energy: 0.5260123580208147
Energy: 0.5549584989091484
Energy: 0.5260123580208147
Energy: 0.5549584989091484
Energy: 0.5742572359179987
Energy: 0.5294527199066055
Energy: 0.5742572359175149
Energy: 0.5294527199066055
Energy: 0.5742572359179987
Energy: 0.5294527199066055
Energy: 0.5738712705010444
Energy: 0.5529180453403107
Energy: 0.5738712705015281
Energy: 0.5529180453403107
Energy: 0.5738712705015281
Energy: 0.5529180453403107
Energy: 0.5470017894485971
Energy: 0.5524113446084099
Energy: 0.5470017894485971
Energy: 0.5524113446084099
Energy: 0.5470017894485971
Energy: 0.5524113446088936
Energy: 0.5416410165201697
Energy: 0.528753240989949
Energy: 0.5416410165201697
Energy: 0.528753240989949
Energy: 0.5416410165201697
Energy: 0.528753240989949
Energy: 0.5501668664485183
Energy: 0.53621581211588
Energy: 0.5501668664480345
Energy: 0.53621581211588
Energy: 0.5501668664475506
Energy: 0.53621581211588
Energy: 0.5247590373925763
Energy: 0.5483495908037204
Energy: 0.5247590373925763
Energy: 0.5483495908037204
Energy: 0.5247590373925763
Energy: 0.5483495908037204
Energy: 0.5539474165596708
Energy: 0.5378292761878715
Energy: 0.5539474165601547
Energy: 0.5378292761878715
Energy: 0.5539474165601547
Energy: 0.5378292761878715
Energy: 0.5484306569469068
Energy: 0.532275875646721
Energy: 0.5484306569469068
Energy: 0.532275875646721
Energy: 0.5484306569469068
Energy: 0.532275875646721

minimum gb energy = 0.5226723968193602 eV
minimum distance =  2.59606759410001 Angstroms
sigma value = 101


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

Energy: 0.5181296404623649
Energy: 0.5566592514375576
Energy: 0.5181296404623649
Energy: 0.5566592514379828
Energy: 0.5181296404623649
Energy: 0.5566592514375576
Energy: 0.5481511026144713
Energy: 0.5170997936868409
Energy: 0.5481511026131954
Energy: 0.5170997936868409
Energy: 0.5481511026144713
Energy: 0.5170997936868409
Energy: 0.5435647104410434
Energy: 0.501237517458016
Energy: 0.5435647104410434
Energy: 0.501237517458016
Energy: 0.5435647104410434
Energy: 0.501237517458016
Energy: 0.49562233711704085
Energy: 0.5352753429673794
Energy: 0.49562233711704085
Energy: 0.5352753429673794
Energy: 0.49562233711704085
Energy: 0.5352753429673794
Energy: 0.5184371947201233
Energy: 0.5232887854364363
Energy: 0.5184371947205486
Energy: 0.5232887854364363
Energy: 0.5184371947205486
Energy: 0.5232887854364363
Energy: 0.5441562258899143
Energy: 0.5011398864679806
Energy: 0.5441562258899143
Energy: 0.5011398864679806
Energy: 0.5441562258890639
Energy: 0.5011398864679806
Energy: 0.516029958833638
Energy: 0.5338307400911586
Energy: 0.5160299588340633
Energy: 0.5338307400911586
Energy: 0.5160299588332127
Energy: 0.5338307400911586
Energy: 0.4959601322444622
Energy: 0.5404518685617278
Energy: 0.49596013224488744
Energy: 0.5404518685621531
Energy: 0.4959601322444622
Energy: 0.5404518685621531
Energy: 0.5431560610010395
Energy: 0.5018039768221789
Energy: 0.543156061001465
Energy: 0.5018039768221789
Energy: 0.543156061001465
Energy: 0.5018039768221789
Energy: 0.5183039673239626
Energy: 0.5473656684171957
Energy: 0.5183039673239626
Energy: 0.547365668416345
Energy: 0.5183039673239626
Energy: 0.5473656684167703
Energy: 0.49469746000640474
Energy: 0.5881128361562626
Energy: 0.49469746000597936
Energy: 0.5881128361562626
Energy: 0.49469746000640474
Energy: 0.5881128361562626
Energy: 0.5551765215286234
Energy: 0.5160082636950625
Energy: 0.5551765215286234
Energy: 0.5160082636950625
Energy: 0.5551765215286234
Energy: 0.5160082636954877
Energy: 0.5354665066593877
Energy: 0.5013303784215397
Energy: 0.5354665066593877
Energy: 0.5013303784215397
Energy: 0.535466506659813
Energy: 0.501330378421965
Energy: 0.5209833673889567
Energy: 0.5476224646700628
Energy: 0.5209833673889567
Energy: 0.5476224646700628
Energy: 0.5209833673889567
Energy: 0.5476224646700628
Energy: 0.5474289723909597
Energy: 0.5221893550912509
Energy: 0.5474289723909597
Energy: 0.5221893550912509
Energy: 0.547428972391385
Energy: 0.5221893550916762
Energy: 0.5396164421940916
Energy: 0.5098911386318264
Energy: 0.5396164421945168
Energy: 0.5098911386318264
Energy: 0.5396164421945168
Energy: 0.5098911386322517
Energy: 0.493088415167422
Energy: 0.5405693926331404
Energy: 0.493088415167422
Energy: 0.540569392632715
Energy: 0.4930884151669968
Energy: 0.5405693926331404
Energy: 0.49243265022804267
Energy: 0.5486365246507452
Energy: 0.4924326502276174
Energy: 0.5486365246507452
Energy: 0.4924326502276174
Energy: 0.5486365246507452
Energy: 0.5431885661078871
Energy: 0.5019303440745813
Energy: 0.5431885661087378
Energy: 0.5019303440745813
Energy: 0.5431885661078871
Energy: 0.5019303440745813
Energy: 0.514882942118271
Energy: 0.539537944620285
Energy: 0.514882942118271
Energy: 0.539537944620285
Energy: 0.514882942118271
Energy: 0.539537944620285
Energy: 0.4946066800559653
Energy: 0.588652852818029
Energy: 0.4946066800559653
Energy: 0.588652852818029
Energy: 0.49460668005639064
Energy: 0.5886528528184543
Energy: 0.5512736582768435
Energy: 0.49833426368073763
Energy: 0.5512736582768435
Energy: 0.4983342636803123
Energy: 0.5512736582772495
Energy: 0.4983342636803123
Energy: 0.5463221138654092
Energy: 0.49864967121089326
Energy: 0.5463221138654092
Energy: 0.49864967121089326
Energy: 0.5463221138658345
Energy: 0.49864967121089326
Energy: 0.49559365664874305
Energy: 0.5456380579629326
Energy: 0.4955936566483178
Energy: 0.5456380579629326
Energy: 0.4955936566483178
Energy: 0.5456380579629326
Energy: 0.5548313734857714
Energy: 0.5227113854415715
Energy: 0.5548313734849208
Energy: 0.522711385442422
Energy: 0.5548313734857714
Energy: 0.5227113854419968
Energy: 0.5351238938094128
Energy: 0.501065648172737
Energy: 0.5351238938094128
Energy: 0.501065648172737
Energy: 0.5351238938094128
Energy: 0.501065648172737
Energy: 0.5179932246527098
Energy: 0.5353198995808817
Energy: 0.5179932246522845
Energy: 0.5353198995808817
Energy: 0.5179932246522845
Energy: 0.5353198995808817
Energy: 0.5180983364217606
Energy: 0.5451800318636458
Energy: 0.5180983364213354
Energy: 0.5451800318636458
Energy: 0.5180983364226113
Energy: 0.5451800318636458
Energy: 0.5457912840947542
Energy: 0.5072484124579734
Energy: 0.5457912840951795
Energy: 0.5072484124579734
Energy: 0.5457912840951795
Energy: 0.5072484124579734
Energy: 0.49247096479352254
Energy: 0.5407289102736095
Energy: 0.49247096479352254
Energy: 0.5407289102736095
Energy: 0.49247096479352254
Energy: 0.5407289102736095
Energy: 0.49311396273361885
Energy: 0.5271072433360663
Energy: 0.49311396273361885
Energy: 0.5271072433360663
Energy: 0.4931139627340441
Energy: 0.5271072433360663
Energy: 0.547059213580879
Energy: 0.4991873761974234
Energy: 0.5470592135817295
Energy: 0.4991873761974234
Energy: 0.547059213580879
Energy: 0.4991873761974234
Energy: 0.5552389409836898
Energy: 0.4986059815717421
Energy: 0.5552389409841151
Energy: 0.4986059815717421
Energy: 0.5552389409845403
Energy: 0.4986059815717421

minimum gb energy = 0.4924326502276174 eV
minimum distance =  2.61667480871847 Angstroms
sigma value = 33


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

Energy: 0.011809174407296535
Energy: 0.3894946631293774
Energy: 0.011809174407296535
Energy: 0.3894946631293774
Energy: 0.011809174407296535
Energy: 0.3894946631293774
Energy: 0.013122668673344785
Energy: 0.15224939702379706
Energy: 0.013122668672991434
Energy: 0.15224939702379706
Energy: 0.013122668673344785
Energy: 0.1522493970241308
Energy: 0.38988363745443255
Energy: 0.15215998940635306
Energy: 0.38988363745443255
Energy: 0.15215998940808056
Energy: 0.38988363745511956
Energy: 0.15215998941014178
Energy: 0.013122668672304362
Energy: 0.15224939702448415
Energy: 0.013122668672304362
Energy: 0.1522493970241308
Energy: 0.013122668672304362
Energy: 0.15224939702448415

minimum gb energy = 0.011809174407296535 eV
minimum distance =  2.84851172281659 Angstroms
sigma value = 1