Model name: model_name=EAM_Dynamo_TehranchiCurtin_2010_NiH__MO_535504325462_003
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5240105092525478
cohesive_energy=4.528250525522021
mass=58.6934
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: 0.018436134963939813
Energy: 0.9956655657088487
Energy: 0.018436134963939813
Energy: 0.9956655657091418
Energy: 0.018436134963939813
Energy: 0.9956655657091418
Energy: 0.9956655657091418
Energy: 0.5881103289643109
Energy: 0.9956655657091418
Energy: 0.5881103289643109
Energy: 0.9956655657091418
Energy: 1.0983287752589335
Energy: 0.018436134963939813
Energy: 0.9956655657091418
Energy: 0.018436134963939813
Energy: 0.995665565709472
Energy: 0.018436134963609803
Energy: 0.9956655657091418
Energy: 0.9956655657091418
Energy: 0.5881103289643109
Energy: 0.9956655657091418
Energy: 1.0789466184834338
Energy: 0.9956655657091418
Energy: 1.3594721970503714
Energy: 0.018436134963939813
Energy: 0.9956655657091418
Energy: 0.018436134963939813
Energy: 0.9956655657091418
Energy: 0.018436134963939813
Energy: 0.9956655657091418
Energy: 0.9956655657091418
Energy: 1.0983287752599233
Energy: 0.9956655657091418
Energy: 1.3594721970503714
Energy: 0.9956655657091418
Energy: 1.3922426978781193

minimum gb energy = 0.018436134963609803 eV
minimum distance =  2.2541091343057 Angstroms
sigma value = 1


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

Energy: 1.280583427228363
Energy: 1.2425276398926832
Energy: 1.280583427228363
Energy: 1.242527639891889
Energy: 1.280583427228363
Energy: 1.242527639891889
Energy: 1.3824785295593982
Energy: 1.16941972567327
Energy: 1.3824785295625759
Energy: 1.16941972567327
Energy: 1.382478529558604
Energy: 1.16941972567327
Energy: 1.2519933616623322
Energy: 1.284314342755584
Energy: 1.251993361661538
Energy: 1.2843143427547898
Energy: 1.2519933616623322
Energy: 1.2843143427563786
Energy: 1.305950202199033
Energy: 1.2105206193366105
Energy: 1.3059502022006217
Energy: 1.210520619337405
Energy: 1.3059502021974445
Energy: 1.2105206193366105
Energy: 1.2376682612829473
Energy: 1.3337500343246893
Energy: 1.2376682612829473
Energy: 1.3337500343192008
Energy: 1.2376682612829473
Energy: 1.3337500343207898
Energy: 1.3014686966584375
Energy: 1.1679169188817506
Energy: 1.3014686966600264
Energy: 1.167916918882545
Energy: 1.3014686966600264
Energy: 1.1679169188817506
Energy: 1.2201261781770119
Energy: 1.2554698569240585
Energy: 1.2201261781801893
Energy: 1.2554698569248528
Energy: 1.2201261781801893
Energy: 1.2554698569248528
Energy: 1.2025830166345706
Energy: 1.343572358143253
Energy: 1.2025830166361593
Energy: 1.3435723581416643
Energy: 1.2025830166393368
Energy: 1.3435723581416643
Energy: 1.3315943469456835
Energy: 1.2653368532487572
Energy: 1.3315943469456835
Energy: 1.2653368532487572
Energy: 1.3315943469456835
Energy: 1.2653368532487572
Energy: 1.1511630116667808
Energy: 1.3289294218440422
Energy: 1.1511630116659863
Energy: 1.3289294218337155
Energy: 1.151163011665192
Energy: 1.3289294218408647
Energy: 1.3452042553791075
Energy: 1.1672828246140765
Energy: 1.345204255382285
Energy: 1.1672828246148708
Energy: 1.3452042553799017
Energy: 1.1672828246140765
Energy: 1.1449199462844808
Energy: 1.2650029126353899
Energy: 1.1449199462844808
Energy: 1.2650029126345954
Energy: 1.1449199462844808
Energy: 1.2650029126361841
Energy: 1.4058946882932526
Energy: 1.1319016738184033
Energy: 1.4058946882924583
Energy: 1.1319016738191978
Energy: 1.4058946882932526
Energy: 1.131901673817609
Energy: 1.187569450041602
Energy: 1.2293129198109938
Energy: 1.187569450041602
Energy: 1.229312919811788
Energy: 1.1875694500423966
Energy: 1.2293129198109938
Energy: 1.4127606758111086
Energy: 1.162800710777682
Energy: 1.412760675814286
Energy: 1.1628007107792708
Energy: 1.412760675807931
Energy: 1.1628007107792708
Energy: 1.4146228175161324
Energy: 1.289457005483441
Energy: 1.4146228175161324
Energy: 1.2894570054882073
Energy: 1.4146228175161324
Energy: 1.289457005487413
Energy: 1.2436637282654959
Energy: 1.2566987236257376
Energy: 1.2436637282647012
Energy: 1.2566987236217657
Energy: 1.2436637282639071
Energy: 1.25669872362256
Energy: 1.2434674738259832
Energy: 1.2215243075959987
Energy: 1.2434674738259832
Energy: 1.2215243075975875
Energy: 1.243467473825189
Energy: 1.2215243075952043
Energy: 1.1506359103251986
Energy: 1.2107163961826957
Energy: 1.1506359103251986
Energy: 1.2107163961850789
Energy: 1.1506359103244042
Energy: 1.2107163961834901
Energy: 1.2990519298307515
Energy: 1.167579419002546
Energy: 1.2990519298323402
Energy: 1.1675794190033402
Energy: 1.299051929831546
Energy: 1.1675794190017514
Energy: 1.179894600617303
Energy: 1.3718264556895838
Energy: 1.1798946006180975
Energy: 1.371826455685612
Energy: 1.179894600617303
Energy: 1.371826455687995
Energy: 1.2979430434213841
Energy: 1.2580799279043846
Energy: 1.2979430434213841
Energy: 1.2580799279043846
Energy: 1.2979430434197952
Energy: 1.2580799279043846
Energy: 1.1455227008523263
Energy: 1.3770381877306825
Energy: 1.1455227008515316
Energy: 1.3770381877306825
Energy: 1.1455227008515316
Energy: 1.3770381877306825

minimum gb energy = 1.131901673817609 eV
minimum distance =  2.21202669920345 Angstroms
sigma value = 33


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

Energy: 1.3912409342658867
Energy: 1.3427438111966985
Energy: 1.3396495061707339
Energy: 1.3427438111953431
Energy: 1.3912409342640792
Energy: 1.3427438111953431
Energy: 1.3951998181461136
Energy: 1.2075182050285251
Energy: 1.395199818148373
Energy: 1.2075182050312363
Energy: 1.3951998181488248
Energy: 1.2075182050307844
Energy: 1.1890542528248664
Energy: 1.2066958546937783
Energy: 1.189054252823963
Energy: 1.2066958546973932
Energy: 1.1890542528244148
Energy: 1.206695854695586
Energy: 1.3885146645304824
Energy: 1.2929425775469414
Energy: 1.3885146645291266
Energy: 1.2929425775433268
Energy: 1.388514664528675
Energy: 1.2929425775433268
Energy: 1.278084537346952
Energy: 1.274612009608212
Energy: 1.278084537347404
Energy: 1.2746120096077604
Energy: 1.2780845373451446
Energy: 1.274612009609116
Energy: 1.2097453924761508
Energy: 1.1433327666724598
Energy: 1.2097453924797654
Energy: 1.1433327666715563
Energy: 1.2097453924761508
Energy: 1.1433327666706525
Energy: 1.335629404914486
Energy: 1.3214211383575287
Energy: 1.3356294049099677
Energy: 1.3214211383606915
Energy: 1.3356294049090638
Energy: 1.3214211383593362
Energy: 1.1410745135095353
Energy: 1.3924208494329804
Energy: 1.1410745135117946
Energy: 1.3924208494338841
Energy: 1.1410745135154092
Energy: 1.3924208494370467
Energy: 1.2066187217569293
Energy: 1.1930660747908934
Energy: 1.2066187217564772
Energy: 1.1930660747931527
Energy: 1.2066187217564772
Energy: 1.1930660747927007
Energy: 1.1690511989752008
Energy: 1.4265352908152384
Energy: 1.169054289732934
Energy: 1.4265352908143345
Energy: 1.1690511989783225
Energy: 1.4265352908170457
Energy: 1.4254286888955656
Energy: 1.1729894470137432
Energy: 1.4254286888928547
Energy: 1.1729894470150986
Energy: 1.425428688894662
Energy: 1.1729894470155504
Energy: 1.1892157207746124
Energy: 1.2549876086146836
Energy: 1.189215712346112
Energy: 1.2549876086151353
Energy: 1.1892157207750642
Energy: 1.2549876086146836
Energy: 1.2697432630632868
Energy: 1.18422665052746
Energy: 1.2697432630637386
Energy: 1.1842266505265564
Energy: 1.269743263065998
Energy: 1.1842266505270083
Energy: 1.267973665831444
Energy: 1.340218050394441
Energy: 1.2679736658323066
Energy: 1.340218050394441
Energy: 1.2679736658305405
Energy: 1.340218050394441
Energy: 1.288294903238738
Energy: 1.2062197770285263
Energy: 1.2882949032382862
Energy: 1.2062197770312373
Energy: 1.2882949032364788
Energy: 1.2062197770325929
Energy: 1.1890575437022572
Energy: 1.2071461481256678
Energy: 1.1890575437049684
Energy: 1.2071461481243122
Energy: 1.189057543704065
Energy: 1.2071461481238603
Energy: 1.3483008493228132
Energy: 1.295839856338027
Energy: 1.348300849323265
Energy: 1.295839856342545
Energy: 1.3483008493205537
Energy: 1.295839856342545
Energy: 1.2784603380863062
Energy: 1.1887985079359475
Energy: 1.2784603380881134
Energy: 1.1887985079332364
Energy: 1.2784603380867583
Energy: 1.188798507934592
Energy: 1.2141651400353088
Energy: 1.2103589232974856
Energy: 1.214165140037116
Energy: 1.2103589233006484
Energy: 1.2141651400406896
Energy: 1.210358923298841
Energy: 1.3638838854413309
Energy: 1.3237218965666782
Energy: 1.363758892350591
Energy: 1.3237218965684856
Energy: 1.3638838854422344
Energy: 1.3237218965689375
Energy: 1.17269294788762
Energy: 1.4224049192438808
Energy: 1.1726754536109016
Energy: 1.4224049192470438
Energy: 1.1726929478911936
Energy: 1.4224049192456882
Energy: 1.2069614230679024
Energy: 1.1929465850320902
Energy: 1.206961423065643
Energy: 1.1929465850289274
Energy: 1.2069614230665469
Energy: 1.192946585029379
Energy: 1.1695615428015935
Energy: 1.4266999838488816
Energy: 1.169563508177323
Energy: 1.4266999838511407
Energy: 1.1695615428002377
Energy: 1.4266999838484298
Energy: 1.4119504644371794
Energy: 1.279397634242918
Energy: 1.411950464436276
Energy: 1.279397634239755
Energy: 1.4119504644394387
Energy: 1.2793976342402071
Energy: 1.1888066535775175
Energy: 1.2097333821542917
Energy: 1.188917611247646
Energy: 1.209733382153388
Energy: 1.1888066535784212
Energy: 1.20973338215384
Energy: 1.3938249018120445
Energy: 1.3169697047298896
Energy: 1.342023156252802
Energy: 1.3169697047271784
Energy: 1.3938249018120445
Energy: 1.3169697047240156
Energy: 1.3929343841858077
Energy: 1.2968662888461917
Energy: 1.3417688776428343
Energy: 1.296866288851162
Energy: 1.3929343841862596
Energy: 1.2968662888525175
Energy: 1.1892398970415636
Energy: 1.2037832204714263
Energy: 1.189239897042919
Energy: 1.2037832204732337
Energy: 1.1892398970456304
Energy: 1.2037832204714263
Energy: 1.433012289832458
Energy: 1.2067852118263191
Energy: 1.43301228983291
Energy: 1.2067852118276743
Energy: 1.433012289835169
Energy: 1.2067852118272224
Energy: 1.1695919435602402
Energy: 1.4436838178540654
Energy: 1.1695919435593365
Energy: 1.4436838178549691
Energy: 1.1695919435602402
Energy: 1.4436838178536133
Energy: 1.2779003431809197
Energy: 1.1930761891847115
Energy: 1.2779003431800162
Energy: 1.1930761891847115
Energy: 1.2779003431795641
Energy: 1.1930761891847115
Energy: 1.1827870602921413
Energy: 1.3726575157674765
Energy: 1.1827870602907857
Energy: 1.3726575157670247
Energy: 1.1827870602894301
Energy: 1.3726575157647658
Energy: 1.3355615060006885
Energy: 1.3237655087063942
Energy: 1.335561505995718
Energy: 1.323765508704135
Energy: 1.335561505993459
Energy: 1.323765508704587
Energy: 1.2085959199885585
Energy: 1.288514294400635
Energy: 1.2085959199876548
Energy: 1.2885142943979238
Energy: 1.2085959199903658
Energy: 1.288514294397472
Energy: 1.2072215251656955
Energy: 1.1890402733871925
Energy: 1.2072215251643397
Energy: 1.1890402733862893
Energy: 1.2072215251643397
Energy: 1.1890402733858374
Energy: 1.29425202685347
Energy: 1.3352680771155985
Energy: 1.2942520268516626
Energy: 1.335268077116954
Energy: 1.2942520268548252
Energy: 1.3352680771165022
Energy: 1.1892673194009196
Energy: 1.2778069552067566
Energy: 1.1894340088537556
Energy: 1.2778069552063047
Energy: 1.1892673194013712
Energy: 1.2778069552040454
Energy: 1.2145114208090886
Energy: 1.2102437733242355
Energy: 1.2145114208086367
Energy: 1.2102437733201687
Energy: 1.2145114208072811
Energy: 1.2102437733201687
Energy: 1.267977322231885
Energy: 1.335259237013825
Energy: 1.2679773222287225
Energy: 1.3352592370160838
Energy: 1.26797732223053
Energy: 1.335259237013825
Energy: 1.3927476984086478
Energy: 1.1404256476045211
Energy: 1.3927476984086478
Energy: 1.1404256476045211
Energy: 1.3927476984059364
Energy: 1.140425647604069
Energy: 1.1892934277451677
Energy: 1.2027081225667433
Energy: 1.1892934277429086
Energy: 1.2027081225685505
Energy: 1.1892934277411011
Energy: 1.2027081225685505

minimum gb energy = 1.140425647604069 eV
minimum distance =  2.35208485929859 Angstroms
sigma value = 51


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

Energy: 1.264853811644257
Energy: 1.2885006580200788
Energy: 1.264853811644257
Energy: 1.2885006580200788
Energy: 1.264853811644257
Energy: 1.2885006580211258
Energy: 1.3717590198404197
Energy: 1.2227497723148684
Energy: 1.3717590198393728
Energy: 1.2227497723148684
Energy: 1.3717590198425138
Energy: 1.2227497723148684
Energy: 1.209141784310333
Energy: 1.2730213345883932
Energy: 1.209141784310333
Energy: 1.273021334590487
Energy: 1.209141784309286
Energy: 1.273021334591534
Energy: 1.263508862224456
Energy: 1.1382199096937966
Energy: 1.263508862224456
Energy: 1.1382199096948435
Energy: 1.263508862225503
Energy: 1.1382199096948435
Energy: 1.2858449822233928
Energy: 1.2221835868924398
Energy: 1.285844982222346
Energy: 1.2221835868913928
Energy: 1.2858449822233928
Energy: 1.2221835868924398
Energy: 1.2865751467175488
Energy: 1.2221194952401628
Energy: 1.2865751467133613
Energy: 1.2221194952391157
Energy: 1.2865751467133613
Energy: 1.2221194952401628
Energy: 1.2342135407184247
Energy: 1.2221402295216695
Energy: 1.2342135407194716
Energy: 1.2221402295216695
Energy: 1.2342135407184247
Energy: 1.2221402295206223
Energy: 1.1879823957953732
Energy: 1.2226041248453046
Energy: 1.1879823957964202
Energy: 1.2226041248442578
Energy: 1.1879823957964202
Energy: 1.2226041248442578
Energy: 1.4448176683308263
Energy: 1.1379332589942233
Energy: 1.4448176683297793
Energy: 1.1379332589942233
Energy: 1.4448176683297793
Energy: 1.1379332589942233
Energy: 1.166637898512849
Energy: 1.4489373160868109
Energy: 1.1666378985138957
Energy: 1.4489373160868109
Energy: 1.166637898512849
Energy: 1.4489373160868109
Energy: 1.371828854134202
Energy: 1.1528731011138127
Energy: 1.371828854135249
Energy: 1.1528731011138127
Energy: 1.371828854136296
Energy: 1.1528731011138127
Energy: 1.2628062106661433
Energy: 1.2914402685632027
Energy: 1.2628062106661433
Energy: 1.2914402685632027
Energy: 1.2628062106661433
Energy: 1.2914402685632027
Energy: 1.371247192081106
Energy: 1.2228849243553745
Energy: 1.371247192081106
Energy: 1.2228849243553745
Energy: 1.3712471920790124
Energy: 1.2228849243553745
Energy: 1.2092938579976118
Energy: 1.2077870457598423
Energy: 1.2092938579976118
Energy: 1.2077870457587954
Energy: 1.2092938579976118
Energy: 1.2077870457598423
Energy: 1.2638920935784435
Energy: 1.275441269999718
Energy: 1.2638920935784435
Energy: 1.275441269999718
Energy: 1.2638920935784435
Energy: 1.275441270000765
Energy: 1.2864636047043867
Energy: 1.2221832757789868
Energy: 1.2864636047022928
Energy: 1.2221832757779398
Energy: 1.286463604700199
Energy: 1.2221832757779398
Energy: 1.2865639752491054
Energy: 1.3158662035355786
Energy: 1.2865639752470115
Energy: 1.315866203537672
Energy: 1.2865639752491054
Energy: 1.3158662035324378
Energy: 1.2620789790395759
Energy: 1.227140376631377
Energy: 1.2620789790395759
Energy: 1.227140376631377
Energy: 1.2620789790395759
Energy: 1.227140376631377

minimum gb energy = 1.1379332589942233 eV
minimum distance =  2.211618671421 Angstroms
sigma value = 19


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

Energy: 1.0739151607918953
Energy: 1.111170323476858
Energy: 1.0739151607912745
Energy: 1.111170323477479
Energy: 1.0739151607912745
Energy: 1.111170323477479
Energy: 1.2169969938915515
Energy: 1.267360845925551
Energy: 1.2169969938915515
Energy: 1.267360845925551
Energy: 1.2169969938903091
Energy: 1.267360845925551
Energy: 1.0415175584781071
Energy: 1.2663585403790396
Energy: 1.041517558477486
Energy: 1.2663585403802817
Energy: 1.041517558477486
Energy: 1.2663585403796607
Energy: 1.136254375768171
Energy: 1.0414645362385582
Energy: 1.136254375768171
Energy: 1.041464536237937
Energy: 1.136254375765687
Energy: 1.041464536237937
Energy: 1.0640021096575516
Energy: 1.072628855118386
Energy: 1.0640021096587935
Energy: 1.072628855118386
Energy: 1.0640021096581727
Energy: 1.0726288551177652
Energy: 1.0640267468030675
Energy: 1.0727514660234532
Energy: 1.0640267468030675
Energy: 1.0727514660228323
Energy: 1.0640267468030675
Energy: 1.0727514660228323
Energy: 1.1362566644025731
Energy: 1.0414516788922847
Energy: 1.136256664403194
Energy: 1.0414516788922847
Energy: 1.136256664403194
Energy: 1.0414516788922847
Energy: 1.0414899349510434
Energy: 1.2663302015279423
Energy: 1.0414899349510434
Energy: 1.2663302015248372
Energy: 1.0414899349504227
Energy: 1.2663302015260796
Energy: 1.2172421371813642
Energy: 1.2673606112068532
Energy: 1.2172421371813642
Energy: 1.2673606112068532
Energy: 1.2172421371813642
Energy: 1.2673606112074742
Energy: 1.0739151607918953
Energy: 1.111170323477479
Energy: 1.0739151607918953
Energy: 1.111170323477479
Energy: 1.0739151607912745
Energy: 1.111170323476858
Energy: 1.2169969938903091
Energy: 1.267360845925551
Energy: 1.2169969938921725
Energy: 1.267360845925551
Energy: 1.2169969938903091
Energy: 1.267360845925551
Energy: 1.041517558477486
Energy: 1.2663585403784188
Energy: 1.041517558477486
Energy: 1.2663585403802817
Energy: 1.041517558477486
Energy: 1.2663585403802817
Energy: 1.136254375769413
Energy: 1.0414645362385582
Energy: 1.136254375768171
Energy: 1.041464536237937
Energy: 1.1362543757675503
Energy: 1.0414645362385582
Energy: 1.0640021096569305
Energy: 1.072628855118386
Energy: 1.0640021096563095
Energy: 1.072628855118386
Energy: 1.0640021096575516
Energy: 1.072628855118386
Energy: 1.0640267468030675
Energy: 1.0727514660234532
Energy: 1.0640267468036886
Energy: 1.0727514660215904
Energy: 1.0640267468024465
Energy: 1.0727514660228323
Energy: 1.136256664403194
Energy: 1.0414516788922847
Energy: 1.136256664403194
Energy: 1.0414516788922847
Energy: 1.136256664403194
Energy: 1.0414516788922847
Energy: 1.0414899349510434
Energy: 1.2663302015273215
Energy: 1.0414899349510434
Energy: 1.2663302015254585
Energy: 1.0414899349510434
Energy: 1.2663302015248372
Energy: 1.2172421371819853
Energy: 1.2673606112074742
Energy: 1.2172421371813642
Energy: 1.2673606112068532
Energy: 1.2172421371807434
Energy: 1.2673606112068532
Energy: 1.0739151607918953
Energy: 1.111170323476858
Energy: 1.0739151607918953
Energy: 1.111170323477479
Energy: 1.0739151607918953
Energy: 1.111170323476858
Energy: 1.2169969938909304
Energy: 1.26736084592493
Energy: 1.2169969938909304
Energy: 1.267360845925551
Energy: 1.2169969938896883
Energy: 1.267360845925551
Energy: 1.0415175584781071
Energy: 1.2663585403790396
Energy: 1.041517558477486
Energy: 1.2663585403790396
Energy: 1.041517558477486
Energy: 1.2663585403796607
Energy: 1.136254375768792
Energy: 1.0414645362385582
Energy: 1.1362543757669292
Energy: 1.041464536237937
Energy: 1.136254375768171
Energy: 1.0414645362385582
Energy: 1.0640021096575516
Energy: 1.072628855118386
Energy: 1.0640021096594146
Energy: 1.072628855118386
Energy: 1.0640021096587935
Energy: 1.0726288551177652
Energy: 1.0640267468024465
Energy: 1.0727514660234532
Energy: 1.0640267468030675
Energy: 1.0727514660228323
Energy: 1.0640267468018254
Energy: 1.0727514660222113
Energy: 1.1362566644025731
Energy: 1.0414516788922847
Energy: 1.1362566644025731
Energy: 1.0414516788922847
Energy: 1.136256664403194
Energy: 1.0414516788922847
Energy: 1.0414899349504227
Energy: 1.2663302015254585
Energy: 1.0414899349510434
Energy: 1.2663302015260796
Energy: 1.0414899349510434
Energy: 1.2663302015242166
Energy: 1.2172421371819853
Energy: 1.2673606112074742
Energy: 1.2172421371826063
Energy: 1.2673606112068532
Energy: 1.2172421371819853
Energy: 1.2673606112074742
Energy: 1.0739151607918953
Energy: 1.111170323477479
Energy: 1.0739151607918953
Energy: 1.111170323477479
Energy: 1.0739151607912745
Energy: 1.111170323477479
Energy: 1.2169969938896883
Energy: 1.267360845925551
Energy: 1.2169969938903091
Energy: 1.267360845925551
Energy: 1.2169969938909304
Energy: 1.26736084592493
Energy: 1.0415175584781071
Energy: 1.2663585403784188
Energy: 1.041517558477486
Energy: 1.2663585403802817
Energy: 1.041517558477486
Energy: 1.2663585403796607

minimum gb energy = 1.0414516788922847 eV
minimum distance =  2.235093823797 Angstroms
sigma value = 27


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

Energy: 1.052815405832361
Energy: 1.023568523056615
Energy: 1.052815405832361
Energy: 1.023568523056615
Energy: 1.052815405832361
Energy: 1.023568523055094
Energy: 1.2090413667505695
Energy: 1.070546919413415
Energy: 1.2090413667475273
Energy: 1.070546919414936
Energy: 1.2090413667475273
Energy: 1.070546919414936
Energy: 1.0741793574671317
Energy: 1.1939781986278684
Energy: 1.074179357468653
Energy: 1.1939781986278684
Energy: 1.0741793574671317
Energy: 1.1939781986263471
Energy: 1.1774821677535332
Energy: 0.9885978523528475
Energy: 1.1774821677535332
Energy: 0.9885978523528475
Energy: 1.1774821677504907
Energy: 0.9885978523543686
Energy: 1.2498438790113673
Energy: 0.9883760810504642
Energy: 1.249843879009846
Energy: 0.9883760810504642
Energy: 1.249843879009846
Energy: 0.9883760810504642
Energy: 1.193438481232524
Energy: 1.244725265680317
Energy: 1.1934384812310028
Energy: 1.244725265678796
Energy: 1.193438481232524
Energy: 1.244725265680317
Energy: 1.1020214734626217
Energy: 1.0731194040618626
Energy: 1.1020214734626217
Energy: 1.0731194040618626
Energy: 1.1020214734626217
Energy: 1.0731194040618626
Energy: 1.0494098484711503
Energy: 1.0240431749829937
Energy: 1.0494098484711503
Energy: 1.0240431749829937
Energy: 1.0494098484711503
Energy: 1.0240431749814725
Energy: 1.1204366860943542
Energy: 1.0739081568284767
Energy: 1.1204366860928332
Energy: 1.0739081572815978
Energy: 1.1204366860928332
Energy: 1.0739081494360747
Energy: 1.1767345723178
Energy: 1.19920371181416
Energy: 1.1767345723193208
Energy: 1.1992037118126389
Energy: 1.1767345723178
Energy: 1.1992037118111178
Energy: 1.1358322669324363
Energy: 0.9885569725539037
Energy: 1.1358322669324363
Energy: 0.9885569725539037
Energy: 1.1358322669324363
Energy: 0.9885569725539037
Energy: 1.2493671127818056
Energy: 1.1193947694029251
Energy: 1.2493671127818056
Energy: 1.1193947694029251
Energy: 1.2493671127818056
Energy: 1.1193947694044464

minimum gb energy = 0.9883760810504642 eV
minimum distance =  2.19782813545861 Angstroms
sigma value = 9


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

Energy: 1.0377040112179297
Energy: 1.036970055121483
Energy: 1.0377040112179297
Energy: 1.036970055121483
Energy: 1.0377040112179297
Energy: 1.036970055121483
Energy: 1.0038461505794043
Energy: 0.9361106501597237
Energy: 1.0038461505751302
Energy: 0.9361106501601124
Energy: 1.0038461505832508
Energy: 0.9361106501597237
Energy: 0.9369172564061393
Energy: 1.0418249930544452
Energy: 0.9369172564057119
Energy: 1.0418249930527355
Energy: 0.9369172564065668
Energy: 1.0418249930544452
Energy: 0.9621962567122833
Energy: 0.9187566907519435
Energy: 0.9621962567114286
Energy: 0.9187566907527983
Energy: 0.9621962567127107
Energy: 0.9187566907527983
Energy: 1.0416234993269513
Energy: 0.9961690946568095
Energy: 1.0416234993260962
Energy: 0.9961690946563819
Energy: 1.0416234993269513
Energy: 0.9961690946568095
Energy: 1.032341162907082
Energy: 1.0429169409718828
Energy: 1.0323411629079366
Energy: 1.0052760822936184
Energy: 1.032341162910501
Energy: 1.0429169409706005
Energy: 0.9626917156105085
Energy: 1.095310198222449
Energy: 0.9626917156096537
Energy: 1.095310198222876
Energy: 0.9626917156105085
Energy: 1.095310198222876
Energy: 0.8954984177584339
Energy: 1.0323768255870505
Energy: 0.8954984177584339
Energy: 1.0323768255870505
Energy: 0.8954984177588613
Energy: 1.0323768255870505
Energy: 1.0616329069594137
Energy: 0.9960042265715039
Energy: 1.0616329069594137
Energy: 0.9960042265719312
Energy: 1.0616329069594137
Energy: 0.9960042265719312
Energy: 1.0461087746391255
Energy: 0.9523737223985491
Energy: 1.0461087746382707
Energy: 0.9523737223959848
Energy: 1.0461087746370274
Energy: 0.9523737223921381
Energy: 0.9620789295648158
Energy: 0.9252689173582674
Energy: 0.9620789295635336
Energy: 0.9252689173582674
Energy: 0.9620789295643883
Energy: 0.9252689173578402
Energy: 0.9870149763983406
Energy: 0.9861410296823643
Energy: 0.9870149763988068
Energy: 0.986141029681937
Energy: 0.9870149763983406
Energy: 0.9861410296810822
Energy: 0.9974520956486415
Energy: 1.0038551913166114
Energy: 0.997452095649496
Energy: 1.0038551913217402
Energy: 0.9974520956524879
Energy: 1.0038551913191756
Energy: 1.034499333311304
Energy: 1.0206606146573634
Energy: 1.0344993333100216
Energy: 1.0206606146599277
Energy: 1.0344993333083123
Energy: 1.0206606146586457
Energy: 0.9367286035768648
Energy: 1.0264854298934802
Energy: 0.9367286035764374
Energy: 1.0264854298930528
Energy: 0.9367286035764374
Energy: 1.0264854298939077
Energy: 0.9511710404506586
Energy: 1.0133640272773314
Energy: 0.9511710404502313
Energy: 1.0133640272773314
Energy: 0.9511710404472393
Energy: 1.0133640272743398
Energy: 1.171303693292332
Energy: 0.9199613579982695
Energy: 1.171303693291477
Energy: 0.919961358002116
Energy: 1.171303693292332
Energy: 0.9199613580012613
Energy: 0.9527060808869895
Energy: 0.9981917259686444
Energy: 0.9527060808882717
Energy: 0.9981917259686444
Energy: 0.9527060808878443
Energy: 0.9981917259686444
Energy: 0.8920881683501612
Energy: 1.0212935702465993
Energy: 0.8920881683505497
Energy: 1.0212935702525827
Energy: 0.8920881683501612
Energy: 1.0212935702530102
Energy: 1.0992930992261853
Energy: 1.053517597123391
Energy: 1.0992930992266128
Energy: 1.0429194715064076
Energy: 1.0992930992253305
Energy: 1.0429194715072625
Energy: 0.8921000577588409
Energy: 1.0219325282440364
Energy: 0.8921000577571313
Energy: 1.0219325282483103
Energy: 0.8921000577584135
Energy: 1.0219325282457457
Energy: 0.9526956835193086
Energy: 0.998217502268076
Energy: 0.9526956835180265
Energy: 0.998217502268076
Energy: 0.9526956835180265
Energy: 0.998217502268076
Energy: 1.1713124416127736
Energy: 0.9199671174493911
Energy: 1.1713124416114913
Energy: 0.9199671174476816
Energy: 1.1713124416114913
Energy: 0.9199671174463993
Energy: 0.9510720553901798
Energy: 1.0214478495467045
Energy: 0.9510720553893249
Energy: 1.0214478495475594
Energy: 0.9510720553888976
Energy: 1.021447849547132
Energy: 0.93671572481438
Energy: 1.026232565117269
Energy: 0.93671572481438
Energy: 1.026232565117269
Energy: 0.93671572481438
Energy: 1.0262325651164144
Energy: 1.0345158207524336
Energy: 1.0206606242259857
Energy: 1.0345158207490146
Energy: 1.0206606242264131
Energy: 1.0345158207507243
Energy: 1.0206606242268406
Energy: 0.9976774422928235
Energy: 1.0038692270689156
Energy: 0.9976774422962427
Energy: 1.0038692270693426
Energy: 0.997677442293251
Energy: 1.0038692270680605
Energy: 0.9869788025099137
Energy: 0.9606550306050614
Energy: 0.9869788025095253
Energy: 0.9606550306037792
Energy: 0.9869788025086704
Energy: 0.9606550306029243
Energy: 0.9618137480547102
Energy: 0.9252335317512475
Energy: 0.9618137480551376
Energy: 0.9252335317512475
Energy: 0.961813748052146
Energy: 0.9252335317512475
Energy: 1.0464437831124136
Energy: 0.9065519022596763
Energy: 1.0464437831145892
Energy: 0.9065519022596763
Energy: 1.0464437831145892
Energy: 0.9065519022596763
Energy: 1.0617399133717944
Energy: 0.9959006094369558
Energy: 1.0617399133730767
Energy: 0.9959006094369558
Energy: 1.0617399133726493
Energy: 0.9959006094369558
Energy: 0.8955189235695311
Energy: 1.0324966018806376
Energy: 0.8955189235695311
Energy: 1.0324966018797828
Energy: 0.895518923570386
Energy: 1.0324966018785005
Energy: 0.9628354671347114
Energy: 1.0954224804432182
Energy: 0.9628354671359933
Energy: 1.0954224804432182
Energy: 0.9628354671351388
Energy: 1.0954224804432182
Energy: 1.0322827968188775
Energy: 0.9580576553555094
Energy: 1.0322827968188775
Energy: 0.9580576553563642
Energy: 1.0322827968167405
Energy: 0.9580576553563642
Energy: 1.0417027263764005
Energy: 0.9959723207925004
Energy: 1.0417027263764005
Energy: 0.9959723207937827
Energy: 1.0417027263772551
Energy: 0.9959723207954924
Energy: 0.9621708445368392
Energy: 0.918743616952734
Energy: 0.962170844537694
Energy: 0.9187436169540163
Energy: 0.9621708445368392
Energy: 0.9187436169518791
Energy: 0.9371320949562467
Energy: 1.0418198030717456
Energy: 0.9371320949571015
Energy: 1.041819803073028
Energy: 0.9371320949562467
Energy: 1.0418198030717456
Energy: 1.0038602274752422
Energy: 0.9956591120919386
Energy: 1.0038602274778066
Energy: 0.9956591120940754
Energy: 1.0038602274773791
Energy: 0.9956591120936481
Energy: 1.0377040112179297
Energy: 1.0369700551223378
Energy: 1.0377040112175022
Energy: 1.036970055122765
Energy: 1.0377040112175022
Energy: 1.036970055122765
Energy: 1.0038461505806862
Energy: 0.9361106501618219
Energy: 1.003846150575985
Energy: 0.9361106501614334
Energy: 1.003846150584533
Energy: 0.9361106501618219
Energy: 0.9369172564065668
Energy: 1.0418249930557273
Energy: 0.9369172564069942
Energy: 1.0418249930531631
Energy: 0.9369172564069942
Energy: 1.041824993057437
Energy: 0.9621962567114286
Energy: 0.9187566907536531
Energy: 0.9621962567110013
Energy: 0.9187566907545079
Energy: 0.9621962567114286
Energy: 0.91875669075579
Energy: 1.0416234993260962
Energy: 0.9961690946563819
Energy: 1.0416234993269513
Energy: 0.9961690946559545
Energy: 1.0416234993269513
Energy: 0.9961690946568095

minimum gb energy = 0.8920881683501612 eV
minimum distance =  2.25964631087754 Angstroms
sigma value = 57


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

Energy: 0.4547309592111973
Energy: 0.46811084908335493
Energy: 0.4547309592111973
Energy: 0.4681108490843278
Energy: 0.4547309592111973
Energy: 0.4681108490843278
Energy: 0.6028290842236979
Energy: 0.4558032566641882
Energy: 0.6028290842227251
Energy: 0.4558032566641882
Energy: 0.6028290842227251
Energy: 0.4558032566641882
Energy: 0.521015765011505
Energy: 0.5879562174926984
Energy: 0.521015765011505
Energy: 0.5879562174917256
Energy: 0.5210157650105322
Energy: 0.5879562174926984
Energy: 0.46817832993896197
Energy: 0.4541228814010058
Energy: 0.46817832993896197
Energy: 0.4541228814010058
Energy: 0.46817832993896197
Energy: 0.4541228814010058
Energy: 0.6033014245794207
Energy: 0.6088803841739198
Energy: 0.6033014245794207
Energy: 0.6088803841739198
Energy: 0.6033014245794207
Energy: 0.6088803841739198
Energy: 0.45435315453927044
Energy: 0.5210549051338347
Energy: 0.45435315453829744
Energy: 0.5210549051338347
Energy: 0.45435315453829744
Energy: 0.5210549051338347
Energy: 0.4543631951820128
Energy: 0.5210378267336488
Energy: 0.4543631951820128
Energy: 0.5210378267336488
Energy: 0.4543631951820128
Energy: 0.5210378267336488
Energy: 0.6032957696055921
Energy: 0.6088758600083232
Energy: 0.6032957696055921
Energy: 0.6088758600083232
Energy: 0.6032957696055921
Energy: 0.608875860009296
Energy: 0.469212474730544
Energy: 0.4541132122153884
Energy: 0.46921247472957117
Energy: 0.4541132122144155
Energy: 0.46921247472957117
Energy: 0.4541132122144155
Energy: 0.520964573439317
Energy: 0.5880515827960628
Energy: 0.520964573439317
Energy: 0.5880515827960628
Energy: 0.520964573439317
Energy: 0.5880515827960628
Energy: 0.6028250561735222
Energy: 0.4558470116163879
Energy: 0.6028250561735222
Energy: 0.45584701161736085
Energy: 0.6028250561735222
Energy: 0.45584701161736085
Energy: 0.4547309592111973
Energy: 0.4681108490853008
Energy: 0.4547309592111973
Energy: 0.4681108490843278
Energy: 0.4547309592111973
Energy: 0.46811084908335493
Energy: 0.6028290842217522
Energy: 0.4558032566651611
Energy: 0.6028290842217522
Energy: 0.4558032566641882
Energy: 0.6028290842217522
Energy: 0.4558032566641882
Energy: 0.521015765011505
Energy: 0.5879562174926984
Energy: 0.521015765011505
Energy: 0.5879562174917256
Energy: 0.521015765011505
Energy: 0.5879562174917256
Energy: 0.46817832993896197
Energy: 0.4541228814010058
Energy: 0.4681783299438265
Energy: 0.4541228814010058
Energy: 0.4681783299379891
Energy: 0.4541228814010058
Energy: 0.6033014245794207
Energy: 0.6088803841739198
Energy: 0.6033014245784478
Energy: 0.6088803841739198
Energy: 0.6033014245794207
Energy: 0.6088803841739198
Energy: 0.45435315453829744
Energy: 0.5210549051338347
Energy: 0.45435315453829744
Energy: 0.5210549051338347
Energy: 0.45435315453927044
Energy: 0.5210549051338347
Energy: 0.4543631951829858
Energy: 0.5210378267336488
Energy: 0.4543631951829858
Energy: 0.5210378267336488
Energy: 0.4543631951820128
Energy: 0.5210378267336488
Energy: 0.603295769606565
Energy: 0.608875860009296
Energy: 0.603295769606565
Energy: 0.608875860009296
Energy: 0.603295769606565
Energy: 0.608875860009296

minimum gb energy = 0.4541132122144155 eV
minimum distance =  2.42461203458749 Angstroms
sigma value = 11


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

Energy: 0.9105891476037449
Energy: 0.86957598633309
Energy: 0.9105891476030321
Energy: 0.8695759863316647
Energy: 0.9105891476030321
Energy: 0.86957598633309
Energy: 1.059802315051973
Energy: 0.907584122503939
Energy: 1.0598023150512605
Energy: 0.907584122503939
Energy: 1.0598023150512605
Energy: 0.9075841225032264
Energy: 0.9269776316791445
Energy: 1.1968141577568017
Energy: 0.9269776316798573
Energy: 1.1968141577575142
Energy: 0.9269776316791445
Energy: 1.1968141577560891
Energy: 1.0379484787546027
Energy: 0.849364255305255
Energy: 1.0379484787567408
Energy: 0.8493642553059677
Energy: 1.037948478756028
Energy: 0.849364255305255
Energy: 0.8341631132135812
Energy: 0.8033152211014812
Energy: 0.8341631132135812
Energy: 0.8033152211021938
Energy: 0.8341631132135812
Energy: 0.8033152211021938
Energy: 0.8899502506235798
Energy: 0.8405272910762479
Energy: 0.8899502506178784
Energy: 0.8405272910769607
Energy: 0.8899502506200164
Energy: 0.8405272910762479
Energy: 0.8321127075997814
Energy: 0.9076382913613761
Energy: 0.8321127075997814
Energy: 0.907638291359238
Energy: 0.8321127076004939
Energy: 0.9076382913599508
Energy: 0.9653359043375508
Energy: 0.7777657043528974
Energy: 0.9653359043382637
Energy: 0.77776570435361
Energy: 0.9653359043382637
Energy: 0.7777657043528974
Energy: 0.9629790893645642
Energy: 0.7780868352457878
Energy: 0.9629790893638517
Energy: 0.7780868352457878
Energy: 0.962979089365277
Energy: 0.7780868352457878
Energy: 0.8029405562541325
Energy: 1.1104612138413845
Energy: 0.8029405562527072
Energy: 1.1104612138420973
Energy: 0.8029405562534199
Energy: 1.11046121384281
Energy: 1.0229796550359525
Energy: 1.0280814901070305
Energy: 1.0229796550388033
Energy: 1.0280814901077433
Energy: 1.0229796550380905
Energy: 1.0280814901077433
Energy: 0.8346576332093754
Energy: 0.807407241848422
Energy: 0.8346576332050992
Energy: 0.8074072418491348
Energy: 0.8346576332086625
Energy: 0.807407241848422
Energy: 0.937586509380749
Energy: 0.8522229075732809
Energy: 0.9375865093821742
Energy: 0.8522229075732809
Energy: 0.937586509380749
Energy: 0.8522229075732809
Energy: 0.993458155107992
Energy: 1.1624965713620596
Energy: 0.993458155107992
Energy: 1.162496571361347
Energy: 0.9934581551072792
Energy: 1.1624965713606341
Energy: 1.0613477465704568
Energy: 0.828604272432264
Energy: 1.0613477465718824
Energy: 0.828604272432264
Energy: 1.061347746572595
Energy: 0.8286042724329766
Energy: 0.8883509198062702
Energy: 0.9401533978366143
Energy: 0.888350919806983
Energy: 0.9401533978373271
Energy: 0.8883509198055577
Energy: 0.9401533978373271
Energy: 0.8371213093705154
Energy: 0.9024066910872617
Energy: 0.8371213093719408
Energy: 0.9024066910879743
Energy: 0.8371213093726534
Energy: 0.9024066910879743
Energy: 1.2559596634820662
Energy: 0.9647457000698234
Energy: 1.2559596634813535
Energy: 0.9647457000669727
Energy: 1.2559596634820662
Energy: 0.96474570006626
Energy: 0.9817552246652486
Energy: 0.8475184511472019
Energy: 0.9817552246631106
Energy: 0.8475184511479146
Energy: 0.9817552246652486
Energy: 0.8475184511479146
Energy: 0.8360103074068803
Energy: 0.9410365563553601
Energy: 0.8360103074075929
Energy: 0.9410365563553601
Energy: 0.8360103074075929
Energy: 0.9410365563553601
Energy: 0.7994137890436281
Energy: 0.8407590638109883
Energy: 0.7994137890422027
Energy: 0.8407590638117011
Energy: 0.7994137890429155
Energy: 0.8407590638117011
Energy: 0.8737707522586617
Energy: 0.9057837764643728
Energy: 0.8737707522607997
Energy: 0.9057837764629475
Energy: 0.8737707522629378
Energy: 0.9057837764643728
Energy: 0.855852883348747
Energy: 0.932917610419037
Energy: 0.8558528833473216
Energy: 0.932917610419037
Energy: 0.855852883348747
Energy: 0.932917610419037
Energy: 0.9601439175567953
Energy: 0.8165220503426603
Energy: 0.9601439175575077
Energy: 0.8165220503419476
Energy: 0.9601439175560824
Energy: 0.8165220503412349
Energy: 0.7998243423089558
Energy: 1.1242249975650203
Energy: 0.7998243423089558
Energy: 1.1242249975650203
Energy: 0.7998243423089558
Energy: 1.1242249975685836
Energy: 1.3967498600814583
Energy: 1.0314434964578936
Energy: 1.3967498600821708
Energy: 1.0314434964578936
Energy: 1.3967498600814583
Energy: 1.0314434964578936

minimum gb energy = 0.7777657043528974 eV
minimum distance =  2.27288045433046 Angstroms
sigma value = 41


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

Energy: 1.1055043991167737
Energy: 0.946391472454206
Energy: 1.0064176303573427
Energy: 0.9463914724536442
Energy: 1.1055043991190205
Energy: 0.9463914724536442
Energy: 1.1001926670451392
Energy: 1.083737886455694
Energy: 1.1001926670468243
Energy: 1.0837378864545704
Energy: 1.1001926670468243
Energy: 1.083737886455132
Energy: 1.0479051860622643
Energy: 1.0922672511573333
Energy: 1.0479051860611412
Energy: 1.0922672511595801
Energy: 1.0479051860628263
Energy: 1.0922672511590186
Energy: 0.9654873999204422
Energy: 0.9535435453428202
Energy: 0.965487399921004
Energy: 0.9535435453388882
Energy: 0.965487399921004
Energy: 0.9535435453394498
Energy: 0.9061160976506039
Energy: 0.9924282997408003
Energy: 0.9061125078748707
Energy: 0.9924282997385534
Energy: 0.9061160976489187
Energy: 0.9924282997385534
Energy: 1.1371333583955612
Energy: 0.9407595008746142
Energy: 1.1371333583978078
Energy: 0.9407595008779843
Energy: 1.1371333583966847
Energy: 0.9407595008785462
Energy: 0.9743351225901291
Energy: 0.9898460198686128
Energy: 0.9743351225901291
Energy: 0.9898460198669276
Energy: 0.9743351225878822
Energy: 0.9898460198686128
Energy: 1.0134714252495116
Energy: 0.9533766932838359
Energy: 1.0135760135754643
Energy: 0.9533766932860828
Energy: 1.0134714252523203
Energy: 0.9533766932860828
Energy: 0.8488346715188823
Energy: 0.9697272917740632
Energy: 0.8488346715194438
Energy: 0.9697272917718165
Energy: 0.8488346715183205
Energy: 0.9697272917723782
Energy: 0.9581228123763723
Energy: 1.103714913512993
Energy: 0.9581228123774956
Energy: 1.1037149135141162
Energy: 0.9581228123774956
Energy: 1.1037149135135549
Energy: 0.9597738725976723
Energy: 1.0036481833212418
Energy: 0.9597738726004809
Energy: 1.0036481833173099
Energy: 0.9597738725987957
Energy: 1.0036481833184334
Energy: 0.9268778442902951
Energy: 0.9360557543360666
Energy: 0.9268778442897333
Energy: 0.9360557543360666
Energy: 0.9268778442891716
Energy: 0.9360557543355048
Energy: 0.935746576343506
Energy: 0.9487840432167225
Energy: 0.9357465763440677
Energy: 0.9487840432167225
Energy: 0.9357465763446294
Energy: 0.9487840432161609
Energy: 0.9158168316406675
Energy: 1.0775758419374608
Energy: 0.9158336786720764
Energy: 1.077575841940831
Energy: 0.9158168316401057
Energy: 1.077575841939146
Energy: 0.9597222437651394
Energy: 1.0710437699780506
Energy: 0.9597222437657013
Energy: 1.071043769975242
Energy: 0.9597222437668247
Energy: 1.0710437699769273
Energy: 0.9065311258842552
Energy: 1.1721795564881206
Energy: 0.9065311258836936
Energy: 1.172179556487559
Energy: 0.9065311258814468
Energy: 1.1721795564881206
Energy: 1.0210562764498918
Energy: 0.9489805034918878
Energy: 1.0210797503211368
Energy: 0.9489805034907642
Energy: 1.0210562764527005
Energy: 0.9489805034907642
Energy: 1.005562454288266
Energy: 1.1360318737066595
Energy: 1.0055739816979792
Energy: 1.1360318737105912
Energy: 1.0055624542871424
Energy: 1.1360318737100294
Energy: 0.9885928135528466
Energy: 1.0290969650572073
Energy: 0.98859281355397
Energy: 1.0290969650605775
Energy: 0.9885928135556552
Energy: 1.0290969650605775
Energy: 1.0579310464374907
Energy: 1.0561294698210484
Energy: 0.9587928215600731
Energy: 1.0561294698216102
Energy: 1.0579310464369291
Energy: 1.0561294698216102
Energy: 0.9271684468750215
Energy: 0.9780154758072266
Energy: 0.9271684468755833
Energy: 0.978015475806665
Energy: 0.927168446878392
Energy: 0.9780154758072266
Energy: 1.0462497799321098
Energy: 1.1542840367149507
Energy: 1.0462497799315482
Energy: 1.154284036718321
Energy: 1.0462497799304247
Energy: 1.1542840367177591
Energy: 0.9638972807367046
Energy: 0.9605964727129208
Energy: 0.9638972807395131
Energy: 0.9605964727140442
Energy: 0.9638972807389513
Energy: 0.9605964727140442
Energy: 0.9064402160801637
Energy: 1.1044328971691033
Energy: 0.9064339493684229
Energy: 1.1044328971702266
Energy: 0.9064402160767935
Energy: 1.1044328971707882
Energy: 0.9102570817703234
Energy: 0.9398892697698735
Energy: 0.9102570817720085
Energy: 0.9398892697726821
Energy: 0.910257081773132
Energy: 0.9398892697743673
Energy: 0.9743243880437081
Energy: 0.974021466024202
Energy: 0.9743243880425847
Energy: 0.9740214660208318
Energy: 0.9743243880470784
Energy: 0.9740214660208318
Energy: 1.0166514521217704
Energy: 0.9604727371944584
Energy: 1.0167538588628127
Energy: 0.9604727371933349
Energy: 1.0166514521234558
Energy: 0.9604727371933349
Energy: 0.8508564753076981
Energy: 1.028248456984214
Energy: 0.8508564753076981
Energy: 1.0282484569819672
Energy: 0.850856475306013
Energy: 1.0282484569825288
Energy: 0.9649922905541392
Energy: 1.0816113006557728
Energy: 0.9649922905518925
Energy: 1.0816113006563346
Energy: 0.9649922905518925
Energy: 1.0816113006557728
Energy: 1.1641274638552213
Energy: 0.8368618354312889
Energy: 1.1641274638540977
Energy: 0.8368618354307271
Energy: 1.1641274638546595
Energy: 0.8368618354296037
Energy: 0.9273570226108527
Energy: 0.9048075700764671
Energy: 0.9273570226119762
Energy: 0.9048075700753434
Energy: 0.9273570226130996
Energy: 0.9048075700764671
Energy: 0.9391487731735783
Energy: 0.9492414729860386
Energy: 0.9391487731730165
Energy: 0.9492414729871619
Energy: 0.9391487731769484
Energy: 0.9492414729871619
Energy: 0.9104793777689538
Energy: 1.0381401494965268
Energy: 0.9104815733409751
Energy: 1.0381401494954032
Energy: 0.9104793777695157
Energy: 1.0381401494954032

minimum gb energy = 0.8368618354296037 eV
minimum distance =  2.21150762608188 Angstroms
sigma value = 33


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

Energy: 0.977788693625038
Energy: 0.9010401390420456
Energy: 0.9777886936254678
Energy: 0.9010401390416871
Energy: 0.9777886936258264
Energy: 0.9010401390420456
Energy: 1.0488638259553291
Energy: 0.8990951042639648
Energy: 1.048863825956906
Energy: 0.8990951042639648
Energy: 1.0488638259482335
Energy: 0.8990951042639648
Energy: 0.9730727273011037
Energy: 1.0924633434268203
Energy: 0.9730727273007455
Energy: 1.0924633434271784
Energy: 0.9730727273015338
Energy: 1.0924633434271784
Energy: 1.035930340095068
Energy: 0.9004243593736989
Energy: 1.035930340094638
Energy: 0.9004243593736989
Energy: 1.0359303400954265
Energy: 0.9004243593740573
Energy: 0.9018829629831243
Energy: 1.0464049302852936
Energy: 0.9018829629827659
Energy: 1.0464049302797744
Energy: 0.9018829629831243
Energy: 1.0464049302821397
Energy: 1.0771244572900867
Energy: 0.9204828122202277
Energy: 1.0771244572896566
Energy: 0.9204828122197977
Energy: 1.0771244572861445
Energy: 0.9204828122202277
Energy: 0.9563170539629628
Energy: 1.0497939077463758
Energy: 0.9563170539621745
Energy: 1.0497939077475225
Energy: 0.9563170539641097
Energy: 1.0497939077463758
Energy: 0.9907256650641992
Energy: 1.0321791319250402
Energy: 0.9907256650634109
Energy: 1.0321791319246099
Energy: 0.9907256650638407
Energy: 1.0321791319246099
Energy: 1.081241069042908
Energy: 0.9271844233531286
Energy: 1.081241069043338
Energy: 0.9271844233531286
Energy: 1.081241069041331
Energy: 0.9271844233526986
Energy: 1.354941177240752
Energy: 0.9221371820200972
Energy: 1.354941177242329
Energy: 0.9221371820205272
Energy: 1.354941177242329
Energy: 0.9221371820205272
Energy: 0.9952869485020602
Energy: 0.9989148703935653
Energy: 0.9952869485012719
Energy: 0.9989148703935653
Energy: 0.9952869485012719
Energy: 0.998914870393207
Energy: 1.0470232575433176
Energy: 0.9003734058734162
Energy: 1.047023257545683
Energy: 0.9003734058729862
Energy: 1.047023257546113
Energy: 0.9003734058729862
Energy: 0.9257224985381927
Energy: 1.0830073115747985
Energy: 0.9257224985377627
Energy: 1.0830073115751568
Energy: 0.9257224985385512
Energy: 1.0830073115747985
Energy: 1.0268425417658524
Energy: 0.9891935374416747
Energy: 1.026842541765064
Energy: 0.9891935374413164
Energy: 1.026842541765494
Energy: 0.9891935374416747
Energy: 1.0198250246966476
Energy: 0.9592741795237026
Energy: 1.0198250246958591
Energy: 0.9592741795237026
Energy: 1.019825024695429
Energy: 0.9592741795232728
Energy: 0.9195384400521646
Energy: 1.0803654383318595
Energy: 0.9195384400533113
Energy: 1.0803654383373784
Energy: 0.9195384400529529
Energy: 1.0803654383358017
Energy: 1.047823732777687
Energy: 0.9004339133731815
Energy: 1.0478237327792637
Energy: 0.90043391337354
Energy: 1.0478237327784754
Energy: 0.9004339133731815
Energy: 0.9039572751995387
Energy: 0.9786452225386856
Energy: 0.9039572751999688
Energy: 0.9786452225390438
Energy: 0.9039572752007573
Energy: 0.9786452225390438
Energy: 1.0908022128006176
Energy: 0.9740461045950451
Energy: 1.090802212801406
Energy: 0.9740461045950451
Energy: 1.0908022128001875
Energy: 0.9740461045954035
Energy: 1.0854864271096283
Energy: 0.9299432474042049
Energy: 1.0854864271096283
Energy: 0.9299432474029863
Energy: 1.0854864271076932
Energy: 0.9299432474042049
Energy: 0.9006913682267195
Energy: 0.9762902051659562
Energy: 0.9006913682263611
Energy: 0.9762902051667445
Energy: 0.9006913682275078
Energy: 0.9762902051667445
Energy: 0.9013879735842715
Energy: 1.055175183995127
Energy: 0.9013879735842715
Energy: 1.0551751839946972
Energy: 0.9013879735839131
Energy: 1.055175183995127
Energy: 1.0205443987201277
Energy: 0.9005118562819602
Energy: 1.0205443987197695
Energy: 0.9005118562815301
Energy: 1.0205443987201277
Energy: 0.9005118562819602
Energy: 0.8989807987462889
Energy: 1.033615411697812
Energy: 0.8989807987467188
Energy: 1.0336154116981702
Energy: 0.8989807987462889
Energy: 1.0336154116973817
Energy: 1.047085597486937
Energy: 0.9004320578247855
Energy: 1.0470855974885136
Energy: 0.9004320578247855
Energy: 1.0470855974896605
Energy: 0.9004320578247855
Energy: 0.9239008070615908
Energy: 1.022294839857367
Energy: 0.9239008070619492
Energy: 1.022294839857367
Energy: 0.9239008070623793
Energy: 1.0222948398565785
Energy: 1.0504472077072573
Energy: 0.9549659117778592
Energy: 1.050447207707616
Energy: 0.954965911778289
Energy: 1.0504472077084044
Energy: 0.954965911778289
Energy: 0.9748090152742102
Energy: 0.8999650858603354
Energy: 0.9748090152742102
Energy: 0.8999650858599053
Energy: 0.9748090152746404
Energy: 0.8999650858603354
Energy: 0.9321833952483193
Energy: 1.0835252085229283
Energy: 0.932183395245954
Energy: 1.0835252085229283
Energy: 0.9321833952467424
Energy: 1.0835252085224982
Energy: 0.9251698236835463
Energy: 1.3615936781194846
Energy: 0.9251698236835463
Energy: 1.3615936781194846
Energy: 0.9251698236839048
Energy: 1.3615936781194846
Energy: 0.9747255391379337
Energy: 0.9084343684624686
Energy: 0.9747255391379337
Energy: 0.908434368462827
Energy: 0.9747255391382922
Energy: 0.9084343684624686
Energy: 0.899033523848751
Energy: 1.0483298620530186
Energy: 0.8990335238479626
Energy: 1.0483298620514416
Energy: 0.899033523849181
Energy: 1.0483298620534487
Energy: 1.0873747423957323
Energy: 0.9217978390560339
Energy: 1.0873747423929367
Energy: 0.9217978390563921
Energy: 1.0873747423925784
Energy: 0.9217978390560339
Energy: 0.9901322160186548
Energy: 1.0222427975564479
Energy: 0.9901322160198733
Energy: 1.0222427975564479
Energy: 0.9901322160178663
Energy: 1.0222427975564479
Energy: 0.9900618659495165
Energy: 1.022243589357889
Energy: 0.9900618659503048
Energy: 1.0222435893571005
Energy: 0.9900618659503048
Energy: 1.022243589356742
Energy: 1.0871187868163281
Energy: 0.9217995450605225
Energy: 1.0871187868245709
Energy: 0.921799545060164
Energy: 1.0871187868218473
Energy: 0.921799545060164
Energy: 0.8990363247793213
Energy: 1.0485068296594366
Energy: 0.8990363247788913
Energy: 1.0485068296724815
Energy: 0.8990363247796797
Energy: 1.0485068296653857
Energy: 0.9750200138787575
Energy: 0.9084860182301534
Energy: 0.9750200138787575
Energy: 0.9084860182309419
Energy: 0.9750200138803343
Energy: 0.9084860182297233
Energy: 0.9252027297041355
Energy: 1.361834363418351
Energy: 0.9252027297041355
Energy: 1.361834363418351
Energy: 0.9252027297033472
Energy: 1.361834363418351
Energy: 0.9321792815912727
Energy: 1.082947556491884
Energy: 0.9321792815920612
Energy: 1.0829475565064342
Energy: 0.9321792815912727
Energy: 1.0829475565060758
Energy: 0.9748020287472845
Energy: 0.8999947663135253
Energy: 0.9748020287476429
Energy: 0.8999947663135253
Energy: 0.9748020287476429
Energy: 0.8999947663131669
Energy: 1.0504482407092237
Energy: 0.9548559939279255
Energy: 1.0504482407080054
Energy: 0.954855993927137
Energy: 1.0504482407095823
Energy: 0.9548559939267788
Energy: 0.9238827233842796
Energy: 1.022165642690456
Energy: 0.9238827233842796
Energy: 1.0221656426928214
Energy: 0.9238827233834911
Energy: 1.022165642692033
Energy: 1.0467787386433411
Energy: 0.9004246124860191
Energy: 1.0467787386457064
Energy: 0.9004246124863774
Energy: 1.0467787386449179
Energy: 0.9004246124863774
Energy: 0.898974592701191
Energy: 1.0458886249556405
Energy: 0.898974592701621
Energy: 1.0458886249559989
Energy: 0.8989745927008325
Energy: 1.0458886249556405
Energy: 1.0202664188062396
Energy: 0.9004517330966342
Energy: 1.020266418801079
Energy: 0.9004517330966342
Energy: 1.0202664188136938
Energy: 0.9004517330969924
Energy: 0.9012757243516406
Energy: 1.0551563160350454
Energy: 0.9012757243512106
Energy: 1.0551563160354753
Energy: 0.9012757243512106
Energy: 1.0551563160354753

minimum gb energy = 0.8989745927008325 eV
minimum distance =  2.30402840271877 Angstroms
sigma value = 67


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

Energy: 0.9924574896667278
Energy: 0.9487877600470818
Energy: 0.9924574896667278
Energy: 0.9487877600470818
Energy: 0.9924574896667278
Energy: 0.9487877600470818
Energy: 0.9694699352025428
Energy: 0.9333993086548789
Energy: 0.9694699352025428
Energy: 0.9333993086548789
Energy: 0.9694699352025428
Energy: 0.9333993086548789
Energy: 1.2852737186880017
Energy: 1.17331084958711
Energy: 1.2852737186905763
Energy: 1.17331084958711
Energy: 1.2852737186880017
Energy: 1.17331084958711
Energy: 0.9694640077246912
Energy: 0.9334083911063193
Energy: 0.9694640077246912
Energy: 0.9334083911063193
Energy: 0.9694640077246912
Energy: 0.9334083911063193
Energy: 0.9924574896667278
Energy: 0.9487877600444471
Energy: 0.9924574896667278
Energy: 0.9487877600444471
Energy: 0.9924574896667278
Energy: 0.9487877600444471
Energy: 0.9694699352025428
Energy: 0.9333993086548789
Energy: 0.9694699352025428
Energy: 0.9333993086548789
Energy: 0.9694699352025428
Energy: 0.9333993086548789
Energy: 1.2852737186880017
Energy: 1.17331084958711
Energy: 1.2852737186880017
Energy: 1.17331084958711
Energy: 1.2852737186880017
Energy: 1.17331084958711

minimum gb energy = 0.9333993086548789 eV
minimum distance =  2.32120460492728 Angstroms
sigma value = 3


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

Energy: 1.3503476793274853
Energy: 1.1366493755594327
Energy: 1.3089961820698532
Energy: 1.1366493755630178
Energy: 1.3503476793239
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Energy: 1.1157944825578567
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Energy: 1.1157944825578567
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Energy: 1.1687366242674817
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Energy: 1.2219118684609325
Energy: 1.1886641985570712
Energy: 1.2219118684609325
Energy: 1.1886641985641766
Energy: 1.2219118684574124
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Energy: 1.0681058505327423
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Energy: 1.2004326245171613
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Energy: 1.1157795598463418
Energy: 1.1645331693501513
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Energy: 1.1645331693465661
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Energy: 1.20496654489445
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Energy: 1.104066511282512
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Energy: 1.1839802277064495
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Energy: 1.1839802277029292
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Energy: 1.1244758535803783
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Energy: 1.1238092080405635
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Energy: 1.1756290260536102
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Energy: 1.182153293465017
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Energy: 1.1413204278757976
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Energy: 1.1413204278650417
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Energy: 1.141320427868627
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Energy: 1.1240488892773426
Energy: 1.0997735371457629
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Energy: 1.0997735371493482
Energy: 1.1240488892773426
Energy: 1.0997735371493482
Energy: 1.2327071089282875
Energy: 1.1245659099732128
Energy: 1.1818438651647627
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Energy: 1.080392214469354
Energy: 1.1744709486240643
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Energy: 1.1717595948092865
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Energy: 1.1717595948057014
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Energy: 1.1852625809346768
Energy: 1.1857508558303615
Energy: 1.1852625809418473
Energy: 1.1857508558303615
Energy: 1.1852625809346768
Energy: 1.1857508558303615
Energy: 1.1774618677984798
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Energy: 1.2198164916308742
Energy: 1.1901064799841565
Energy: 1.2204607760875978
Energy: 1.1901064799877419
Energy: 1.2198164916308742
Energy: 1.1901064799877419
Energy: 1.0986727778189107
Energy: 1.2018735491365493
Energy: 1.0986749136496394
Energy: 1.2018735491400694
Energy: 1.0986727778081546
Energy: 1.2018735491365493
Energy: 1.2413667562442896
Energy: 1.110139774106386
Energy: 1.2413667562586308
Energy: 1.1101397741099714
Energy: 1.24136675625146
Energy: 1.1101397741099714
Energy: 1.0973164617096989
Energy: 1.2070945356391718
Energy: 1.0973164617061135
Energy: 1.207094535632001
Energy: 1.0973164617025282
Energy: 1.2070945356355864
Energy: 1.214205770909919
Energy: 1.1900028965606593
Energy: 1.2142057709135043
Energy: 1.1900028965534886
Energy: 1.2142057709135043
Energy: 1.190002896557074
Energy: 1.117355052566517
Energy: 1.2315349613344355
Energy: 1.1173481894469404
Energy: 1.2315349613344355
Energy: 1.117355052566517
Energy: 1.2315349613344355
Energy: 1.2811120172964596
Energy: 1.097916933520445
Energy: 1.281112017278533
Energy: 1.097916933520445
Energy: 1.281112017300045
Energy: 1.097916933520445
Energy: 1.1235245952782382
Energy: 1.188761614179247
Energy: 1.1235245952782382
Energy: 1.1887616141828323
Energy: 1.1235245952818236
Energy: 1.1887616141828323
Energy: 1.1707414209248512
Energy: 1.098855219300465
Energy: 1.1707414209248512
Energy: 1.0988552192968797
Energy: 1.1707414209248512
Energy: 1.0988552192968797
Energy: 1.1731387341421928
Energy: 1.1662862317308516
Energy: 1.1731387341386073
Energy: 1.1662862317380223
Energy: 1.1731387341421928
Energy: 1.1662862317380223
Energy: 1.2582327046687947
Energy: 1.100296446156206
Energy: 1.2582327046652093
Energy: 1.100296446159791
Energy: 1.2582327046687947
Energy: 1.100296446159791
Energy: 1.1808794885925085
Energy: 1.1477167419643517
Energy: 1.180879302382218
Energy: 1.1477167419643517
Energy: 1.1808794885925085
Energy: 1.147716741967937
Energy: 1.1462533644501782
Energy: 1.1257681104663204
Energy: 1.1462533644501782
Energy: 1.1257681104555644
Energy: 1.1462533644537631
Energy: 1.1257681104555644
Energy: 1.117496049633635
Energy: 1.196883029372328
Energy: 1.1174960496300497
Energy: 1.1968830293794983
Energy: 1.1174960496264643
Energy: 1.1968830293794983
Energy: 1.1950539698662193
Energy: 1.19595496057282
Energy: 1.1950539698590485
Energy: 1.1959549605656494
Energy: 1.195053969862634
Energy: 1.1959549605656494
Energy: 1.1520869063650494
Energy: 1.1997449642214264
Energy: 1.1520876326566418
Energy: 1.199744964217841
Energy: 1.1520869063650494
Energy: 1.199744964217841

minimum gb energy = 1.0591531989253122 eV
minimum distance =  2.25228789625071 Angstroms
sigma value = 81


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

Energy: 1.1679116443217987
Energy: 1.0845184413058453
Energy: 1.1679116443217987
Energy: 1.0845184413048612
Energy: 1.1679116443217987
Energy: 1.0845184413043691
Energy: 1.035196269105377
Energy: 1.0325685401242402
Energy: 1.035196269105377
Energy: 1.0325685401242402
Energy: 1.0351962691058691
Energy: 1.0325685401242402
Energy: 1.3232607533142462
Energy: 1.191395202216491
Energy: 1.3232607533152307
Energy: 1.191395202216491
Energy: 1.3232607533147387
Energy: 1.1913952022169831
Energy: 1.0928927809755076
Energy: 1.1638871521602392
Energy: 1.092892780974523
Energy: 1.1638871521592549
Energy: 1.092892780975015
Energy: 1.163887152158763
Energy: 1.118937778047811
Energy: 1.1101881766093236
Energy: 1.1189377780468266
Energy: 1.1101881766098156
Energy: 1.1189377780487948
Energy: 1.1101881766093236
Energy: 1.0349872815280516
Energy: 1.0322284609683943
Energy: 1.0349872815280516
Energy: 1.0322284609674102
Energy: 1.0349872815270673
Energy: 1.0322284609698706
Energy: 1.0141762426223924
Energy: 1.0337937794517928
Energy: 1.0141762426219003
Energy: 1.0337937794517928
Energy: 1.0141762426223924
Energy: 1.033793779452777
Energy: 1.0330995422523115
Energy: 1.0374771205303293
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Energy: 1.0374771205303293
Energy: 1.0330995422562481
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Energy: 1.1642619347490268
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Energy: 1.3284546035934321
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Energy: 1.3284546035939242
Energy: 1.0321372589090836
Energy: 1.0116715625803998
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Energy: 1.0116715625808472
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Energy: 1.0116715625808472
Energy: 1.0330384742069931
Energy: 1.037179769908539
Energy: 1.0330384742069931
Energy: 1.037179769909031
Energy: 1.033038474207485
Energy: 1.037179769909031
Energy: 1.0359112542481514
Energy: 1.0335640104259962
Energy: 1.035911254247659
Energy: 1.03356401042452
Energy: 1.035911254247167
Energy: 1.0335640104250121
Energy: 1.1642499163058253
Energy: 1.188090132669477
Energy: 1.1642499163063174
Energy: 1.188090132668985
Energy: 1.1642499163058253
Energy: 1.188090132668985
Energy: 1.1885550710517345
Energy: 1.0277692714907587
Energy: 1.1885550710522266
Energy: 1.0277692714902666
Energy: 1.1885550710517345
Energy: 1.027769271491251
Energy: 1.0335658844555833
Energy: 1.0348469408524708
Energy: 1.0335658844541071
Energy: 1.0348469408519785
Energy: 1.0335658844541071
Energy: 1.0348469408519785
Energy: 1.113174934035815
Energy: 1.0325941213564127
Energy: 1.113174934035815
Energy: 1.0325941213559207
Energy: 1.113174934035815
Energy: 1.0325941213559207
Energy: 1.0240832967234073
Energy: 1.0932062308173862
Energy: 1.0240832967234073
Energy: 1.0932062308173862
Energy: 1.0240832967238993
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Energy: 1.1883332808050289
Energy: 1.327507642546176
Energy: 1.1883332808045368
Energy: 1.327507642545684
Energy: 1.1883332808045368
Energy: 1.327507642546176
Energy: 1.1629827613124832
Energy: 1.215858439229853
Energy: 1.1629827613119912
Energy: 1.2158584392308371
Energy: 1.162982761311499
Energy: 1.2158584392308371
Energy: 1.0940924954006064
Energy: 1.0340622076134773
Energy: 1.0940924954006064
Energy: 1.0340622076139694
Energy: 1.0940924954010984
Energy: 1.0340622076139694
Energy: 1.0319428830667052
Energy: 1.013127183263205
Energy: 1.0319428830681816
Energy: 1.0131271832622208
Energy: 1.0319428830671973
Energy: 1.0131271832617288
Energy: 1.0320911232047754
Energy: 1.0151250891752976
Energy: 1.0320911232052226
Energy: 1.0151250891748056
Energy: 1.0320911232052226
Energy: 1.0151250891743135
Energy: 1.094165170171219
Energy: 1.0344457391451904
Energy: 1.0941651701697428
Energy: 1.0344457391442063
Energy: 1.0941651701697428
Energy: 1.0344457391451904
Energy: 1.1635734980596504
Energy: 1.2157971813801325
Energy: 1.1635734980586663
Energy: 1.2157971813786561
Energy: 1.1635734980581742
Energy: 1.2157971813786561
Energy: 1.1883672427633731
Energy: 1.3275347130868247
Energy: 1.1883672427569762
Energy: 1.3275347130858406
Energy: 1.188367242761897
Energy: 1.3275347130858406
Energy: 1.0241310471977574
Energy: 1.0931662742742212
Energy: 1.0241310471972653
Energy: 1.0931662742742212
Energy: 1.0241310471977574
Energy: 1.0931662742742212
Energy: 1.1132308692773132
Energy: 1.0327315776276598
Energy: 1.1132308692768211
Energy: 1.0327315776281518
Energy: 1.1132308692778052
Energy: 1.0327315776281518
Energy: 1.0335770643706137
Energy: 1.0348293685907675
Energy: 1.0335770643711057
Energy: 1.0348293685907675
Energy: 1.0335770643701214
Energy: 1.0348293685907675
Energy: 1.1885981915338542
Energy: 1.027745168595069
Energy: 1.1885981915333619
Energy: 1.027745168594577
Energy: 1.1885981915333619
Energy: 1.027745168595069
Energy: 1.1642945454949234
Energy: 1.188085348131974
Energy: 1.164294545493939
Energy: 1.188085348131974
Energy: 1.1642945454944313
Energy: 1.188085348131974
Energy: 1.0356774682359664
Energy: 1.033692823985046
Energy: 1.0356774682349825
Energy: 1.033692823985046
Energy: 1.0356774682349825
Energy: 1.033692823984062
Energy: 1.0330868323356828
Energy: 1.0369541013207688
Energy: 1.0330868323356828
Energy: 1.0369541013212606
Energy: 1.033086832335191
Energy: 1.0369541013212606
Energy: 1.032175244408901
Energy: 1.0116094109428386
Energy: 1.032175244408901
Energy: 1.0116094109428386
Energy: 1.0321752444093932
Energy: 1.0116094109433307
Energy: 1.167471916298534
Energy: 1.3283318440985015
Energy: 1.1674719162995182
Energy: 1.3283318440975174
Energy: 1.1674719162990264
Energy: 1.3283318440965333
Energy: 1.24196857229186
Energy: 1.1643891151414962
Energy: 1.2419685722928444
Energy: 1.1643891151429726
Energy: 1.2419685722928444
Energy: 1.1643891151429726
Energy: 1.0332075301495185
Energy: 1.0377542167989742
Energy: 1.0332075301500105
Energy: 1.0377542167994662
Energy: 1.0332075301500105
Energy: 1.0377542167994662
Energy: 1.0141428378962212
Energy: 1.0335444731039203
Energy: 1.0141428378962212
Energy: 1.0335444731039203
Energy: 1.0141428378962212
Energy: 1.0335444731039203

minimum gb energy = 1.0116094109428386 eV
minimum distance =  2.34605343918469 Angstroms
sigma value = 43


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

Energy: 1.3510615530432173
Energy: 1.1213238746446001
Energy: 1.3510615530432173
Energy: 1.1213238746446001
Energy: 1.3510615530432173
Energy: 1.1213238746446001
Energy: 1.137645424843679
Energy: 1.0460638714050599
Energy: 1.137645424843679
Energy: 1.0460638714056643
Energy: 1.137645424843679
Energy: 1.0460638714050599
Energy: 1.1532752310099734
Energy: 1.2245423231310397
Energy: 1.1532752310099734
Energy: 1.2245423231310397
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Energy: 1.2245423231310397
Energy: 1.042193997405638
Energy: 1.0768540896945962
Energy: 1.0421939974050336
Energy: 1.0768540896945962
Energy: 1.0421939974050336
Energy: 1.0768540896945962
Energy: 1.2004200414643338
Energy: 1.1189606992772378
Energy: 1.2004200414643338
Energy: 1.1189606992766332
Energy: 1.2004200414643338
Energy: 1.1189606992766332
Energy: 1.07803042034733
Energy: 1.1264587083471969
Energy: 1.0780304203467257
Energy: 1.1264587083471969
Energy: 1.0780304203467257
Energy: 1.1264587083478013
Energy: 1.0953499717239572
Energy: 1.176587547170298
Energy: 1.0953499717239572
Energy: 1.1765875471690894
Energy: 1.0953499717239572
Energy: 1.1765875471690894
Energy: 1.0799094336567805
Energy: 1.1260747234313762
Energy: 1.079909433656176
Energy: 1.1260747234313762
Energy: 1.0799094336567805
Energy: 1.1260747234307715
Energy: 1.2307418427098722
Energy: 1.0275322344030922
Energy: 1.2307418427104764
Energy: 1.0275322344030922
Energy: 1.2307418427110808
Energy: 1.0275322344030922
Energy: 1.0804137451262021
Energy: 1.1258415731653815
Energy: 1.0804137451262021
Energy: 1.1258415731647768
Energy: 1.0804137451262021
Energy: 1.1258415731647768
Energy: 1.1304027889843355
Energy: 1.0592510219652407
Energy: 1.1304027889837311
Energy: 1.0592510219658176
Energy: 1.1304027889837311
Energy: 1.059251021966422
Energy: 1.0797371959572655
Energy: 1.1304266381256967
Energy: 1.0797371959572655
Energy: 1.1304266381275099
Energy: 1.0797371959572655
Energy: 1.1304266381256967
Energy: 1.2065826953149907
Energy: 1.126598263595997
Energy: 1.2065826953137817
Energy: 1.126598263595997
Energy: 1.2065826953137817
Energy: 1.126598263595997
Energy: 1.0306788552088855
Energy: 1.1258103984077588
Energy: 1.0306788552088855
Energy: 1.1258103984077588
Energy: 1.0306788552088855
Energy: 1.1258103984071544
Energy: 1.1299357851777352
Energy: 1.121613526538208
Energy: 1.1299357851777352
Energy: 1.121613526538208
Energy: 1.1299357851777352
Energy: 1.121613526538208
Energy: 1.0903366163263695
Energy: 1.1608473462718152
Energy: 1.0903366163263695
Energy: 1.1608473462724198
Energy: 1.0903366163257648
Energy: 1.1608473462724198
Energy: 1.1416624879186872
Energy: 1.0463748878280785
Energy: 1.1416624879180828
Energy: 1.0463748878280785
Energy: 1.1416624879180828
Energy: 1.046374887828683
Energy: 1.1732866283685972
Energy: 1.0919209656915119
Energy: 1.1732866283692016
Energy: 1.0919209656915119
Energy: 1.1732866283685972
Energy: 1.0919209656915119
Energy: 1.1738360121656681
Energy: 1.0617702604444368
Energy: 1.1738360121656681
Energy: 1.0617702604444368
Energy: 1.1738360121656681
Energy: 1.0617702604444368
Energy: 1.1417389556755775
Energy: 1.0462895915801735
Energy: 1.141738955676786
Energy: 1.0462895915807777
Energy: 1.141738955676786
Energy: 1.0462895915807777
Energy: 1.0901736346958573
Energy: 1.112385636537403
Energy: 1.0901736346958573
Energy: 1.1123856365367983
Energy: 1.0901736346958573
Energy: 1.1123856365367983
Energy: 1.176048970042649
Energy: 1.1586304582690177
Energy: 1.1760489700420445
Energy: 1.1586304582690177
Energy: 1.176048970042649
Energy: 1.1586304582690177
Energy: 1.030569646208303
Energy: 1.1543580440250731
Energy: 1.030569646208303
Energy: 1.154358044024469
Energy: 1.030569646208303
Energy: 1.1543580440250731
Energy: 1.1687554359245889
Energy: 1.126775319844548
Energy: 1.1687554359257977
Energy: 1.1267753198439436
Energy: 1.1687554359270067
Energy: 1.1267753198439436
Energy: 1.079571575197319
Energy: 1.0736109494325017
Energy: 1.079571575197319
Energy: 1.0736109494325017
Energy: 1.0795715751979233
Energy: 1.0736109494325017
Energy: 1.2007532369536542
Energy: 1.1314290378138931
Energy: 1.2007532369530496
Energy: 1.1314290378144978
Energy: 1.2007532369536542
Energy: 1.1314290378138931
Energy: 1.0802804534495887
Energy: 1.045504778133597
Energy: 1.080280453448984
Energy: 1.0455047781329925
Energy: 1.0802804534483796
Energy: 1.045504778133597
Energy: 1.133673974047698
Energy: 1.0281001640275529
Energy: 1.1336739740483024
Energy: 1.0281001640275529
Energy: 1.133673974047698
Energy: 1.0281001640281575
Energy: 1.0803378664332797
Energy: 1.1263331151103384
Energy: 1.0803378664332797
Energy: 1.1263331151103384
Energy: 1.0803378664332797
Energy: 1.126333115110943
Energy: 1.1324323399670582
Energy: 1.1800397051597216
Energy: 1.1324323399670582
Energy: 1.1800397051591172
Energy: 1.1324323399670582
Energy: 1.1800397051597216
Energy: 1.0782949961213761
Energy: 1.126374806565453
Energy: 1.0782949961225847
Energy: 1.126374806565453
Energy: 1.0782949961219805
Energy: 1.126374806565453

minimum gb energy = 1.0275322344030922 eV
minimum distance =  2.30182363728825 Angstroms
sigma value = 57


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

Energy: 1.1625626520719778
Energy: 1.0264680557026296
Energy: 1.1625626520727605
Energy: 1.0264680557026296
Energy: 1.1625626520719778
Energy: 1.0264680557026296
Energy: 1.0751148405680144
Energy: 0.9723936948070866
Energy: 1.0751148405680144
Energy: 0.9723936948070866
Energy: 1.0751148405672317
Energy: 0.9723936948070866
Energy: 1.1703202389812284
Energy: 1.1946850822507882
Energy: 1.1703202389804455
Energy: 1.1946850822507882
Energy: 1.1703202389812284
Energy: 1.1946850822507882
Energy: 1.0645130542372516
Energy: 1.1009794746675823
Energy: 1.064513054238034
Energy: 1.1009794746667996
Energy: 1.0645130542372516
Energy: 1.1009794746675823
Energy: 1.1437434560297985
Energy: 1.0992255572443501
Energy: 1.1437434560290158
Energy: 1.0992255572443501
Energy: 1.1437434560290158
Energy: 1.0992255572443501
Energy: 1.1771584070881946
Energy: 0.9723459635771885
Energy: 1.1771584070881946
Energy: 0.9723459635771885
Energy: 1.1771584070881946
Energy: 0.9723459635764059
Energy: 1.111181968421473
Energy: 1.1884240991742219
Energy: 1.1111819684206905
Energy: 1.188424099175787
Energy: 1.1111819684206905
Energy: 1.1884240991742219
Energy: 1.0641004503113936
Energy: 1.0822973516900756
Energy: 1.0641004503113936
Energy: 1.082297351689293
Energy: 1.0641004503113936
Energy: 1.0822973516885104
Energy: 1.1067376012049115
Energy: 0.9714754114801645
Energy: 1.1067376012049115
Energy: 0.971475411480947
Energy: 1.1067376012049115
Energy: 0.9714754114801645
Energy: 0.9829312434723015
Energy: 1.2663293594664617
Energy: 0.982931243471519
Energy: 1.1774187561117835
Energy: 0.982931243471519
Energy: 1.1774187561117835
Energy: 1.1111361078430753
Energy: 1.100707615087976
Energy: 1.1111361078422926
Energy: 1.1007076150871933
Energy: 1.1111361078430753
Energy: 1.1007076150871933
Energy: 1.110319816217558
Energy: 1.1607788238538792
Energy: 1.1103198162183407
Energy: 1.160778823855444
Energy: 1.110319816217558
Energy: 1.1607788238546615
Energy: 1.1222116155736332
Energy: 0.9716420361578073
Energy: 1.122211615574416
Energy: 0.9716420361585899
Energy: 1.122211615574416
Energy: 0.9716420361593726
Energy: 1.2168499543198454
Energy: 1.1019798296459027
Energy: 1.216849954320628
Energy: 0.9812935769536734
Energy: 1.216849954320628
Energy: 0.9812935769536734
Energy: 1.0977368016519324
Energy: 0.9779018973838585
Energy: 1.0977368016527151
Energy: 0.9779018973838585
Energy: 1.0977368016527151
Energy: 0.9779018973838585
Energy: 1.1251697905789333
Energy: 1.1689032282437364
Energy: 1.1251697905789333
Energy: 1.1689032282437364
Energy: 1.1251697905789333
Energy: 1.1689032282437364
Energy: 0.9835503487034557
Energy: 1.0752441353922493
Energy: 0.9835503487018904
Energy: 1.0752441353922493
Energy: 0.9835503487026732
Energy: 1.075244135393032
Energy: 1.107701962259997
Energy: 1.1311465589896947
Energy: 1.107701962259997
Energy: 1.0513701356084015
Energy: 1.107701962259997
Energy: 1.0513701356084015
Energy: 0.9834764987171868
Energy: 1.0752637618094147
Energy: 0.9834764987179694
Energy: 1.075263761808632
Energy: 0.9834764987179694
Energy: 1.0752637618094147
Energy: 1.1253630921681392
Energy: 1.1689032433578184
Energy: 1.1253630921673565
Energy: 1.1689032433578184
Energy: 1.1253630921681392
Energy: 1.1689032433578184
Energy: 1.0976531638755203
Energy: 0.9779241904217619
Energy: 1.097653163876303
Energy: 0.9779241904233271
Energy: 1.0976531638747375
Energy: 0.9779241904225444
Energy: 1.2170163052658824
Energy: 1.1114540897405762
Energy: 1.217016305266665
Energy: 1.1114540897405762
Energy: 1.2170163052658824
Energy: 1.1114540897405762
Energy: 1.1221675365900718
Energy: 0.9716713648271019
Energy: 1.1221675365892894
Energy: 0.9716713648271019
Energy: 1.1221675365900718
Energy: 0.9716713648278845
Energy: 1.1103387086292984
Energy: 1.160606511209293
Energy: 1.1103387086292984
Energy: 1.1606065112124235
Energy: 1.1103387086292984
Energy: 1.1606065112124235

minimum gb energy = 0.9714754114801645 eV
minimum distance =  2.32426147481706 Angstroms
sigma value = 17


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

Energy: 1.1086167097211734
Energy: 0.9785378082709357
Energy: 1.1086167097222803
Energy: 0.9785378082709357
Energy: 1.1086167097222803
Energy: 0.9785378082709357
Energy: 0.9425038809380883
Energy: 0.9256558118625109
Energy: 0.9425038809369815
Energy: 0.9256558118625109
Energy: 0.9425038809369815
Energy: 0.9256558118625109
Energy: 1.069516752605619
Energy: 1.0938895853920356
Energy: 1.0695167526067255
Energy: 1.0938895853931423
Energy: 1.0695167526067255
Energy: 1.0938895853931423
Energy: 0.8867193916996204
Energy: 1.0623767961291002
Energy: 0.8867193916996204
Energy: 1.0623767961279933
Energy: 0.8867193916996204
Energy: 1.0623767961279933
Energy: 1.0926005330702013
Energy: 1.0200425758917333
Energy: 1.0926005330702013
Energy: 1.0200425758906264
Energy: 1.0926005330702013
Energy: 1.0200425758906264
Energy: 0.9883633053360291
Energy: 1.0649535964472596
Energy: 0.9883633053360291
Energy: 1.0649535964472596
Energy: 0.9883633053360291
Energy: 1.0649535964472596
Energy: 1.0759938754830622
Energy: 0.946750191402871
Energy: 1.0759938754830622
Energy: 0.9467501914017641
Energy: 1.0759938754830622
Energy: 0.946750191402871
Energy: 0.886658733565046
Energy: 1.0712924435419897
Energy: 0.886658733565046
Energy: 1.0712924435419897
Energy: 0.886658733565046
Energy: 1.0712924435430966
Energy: 1.0332803483185302
Energy: 0.9248215008299918
Energy: 1.0332803483185302
Energy: 0.9248215008299918
Energy: 1.0332803483185302
Energy: 0.924821500828885
Energy: 1.002219806751663
Energy: 0.9453417619576521
Energy: 1.00221980675277
Energy: 0.9453417619576521
Energy: 1.002219806751663
Energy: 0.9453417619576521
Energy: 0.9843206876127212
Energy: 0.9982643441675765
Energy: 0.9843206876138277
Energy: 0.9982643441675765
Energy: 0.9843206876138277
Energy: 0.9982643441686834
Energy: 1.0417552171362507
Energy: 0.9248737759720579
Energy: 1.0417552171384645
Energy: 0.924873775970951
Energy: 1.0417552171373576
Energy: 0.924873775970951
Energy: 0.8863106215749352
Energy: 1.0673235065757496
Energy: 0.8863106215738284
Energy: 1.0673235065757496
Energy: 0.8863106215749352
Energy: 1.0673235065768565
Energy: 1.0015227893895633
Energy: 1.052778425891845
Energy: 1.0015227893884566
Energy: 1.0527784258907382
Energy: 1.0015227893895633
Energy: 1.052778425891845
Energy: 0.9881486833712665
Energy: 1.0530802852537462
Energy: 0.9881486833712665
Energy: 1.0530802852526393
Energy: 0.9881486833712665
Energy: 1.0530802852537462
Energy: 0.9876772026580851
Energy: 1.0632434036956984
Energy: 0.9876772026580851
Energy: 1.0632434036956984
Energy: 0.9876772026569783
Energy: 1.0632434036956984
Energy: 0.9995187577758874
Energy: 1.0524059785588074
Energy: 0.9995187577758874
Energy: 1.0524059785577007
Energy: 0.9995187577758874
Energy: 1.0524059785588074

minimum gb energy = 0.8863106215738284 eV
minimum distance =  2.2926219830801 Angstroms
sigma value = 17


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

Energy: 1.0119974395742337
Energy: 0.9056795561658665
Energy: 1.011997439573379
Energy: 0.9056795561662939
Energy: 1.011997439573379
Energy: 0.9056795561662939
Energy: 0.9117400690732709
Energy: 0.8648660030472363
Energy: 0.9117400690724161
Energy: 0.8648660030468088
Energy: 0.9117400690732709
Energy: 0.8648660030472363
Energy: 0.9983104872891486
Energy: 0.9613335125786264
Energy: 0.9983104872887211
Energy: 0.9613335125790539
Energy: 0.9983104872891486
Energy: 0.9613335125786264
Energy: 0.8356967332773082
Energy: 0.9347715238800677
Energy: 0.8356967332773082
Energy: 0.9347715238800677
Energy: 0.8356967332764534
Energy: 0.9347715238800677
Energy: 0.9198769148609693
Energy: 0.8667349272212769
Energy: 0.9198769148622516
Energy: 0.8667349272208493
Energy: 0.9198769148622516
Energy: 0.8667349272208493
Energy: 0.9509154587181404
Energy: 0.881485573747143
Energy: 0.9509154587185291
Energy: 0.8814855737458608
Energy: 0.9509154587176742
Energy: 0.881485573747143
Energy: 0.9167392374138216
Energy: 0.8984366036541931
Energy: 0.9167392374133941
Energy: 0.8984366036546595
Energy: 0.9167392374138216
Energy: 0.898436603655048
Energy: 0.9098772445229238
Energy: 0.9474690719406854
Energy: 0.9098772445220691
Energy: 0.9474690719406854
Energy: 0.9098772445224964
Energy: 0.9474690719372661
Energy: 0.9402924881467991
Energy: 0.9568165048802789
Energy: 0.9402924881467991
Energy: 0.9568165048811336
Energy: 0.9402924881471875
Energy: 0.956816504881561
Energy: 0.9158079825233879
Energy: 0.8281959771906294
Energy: 0.9158079825259524
Energy: 0.8281959771910179
Energy: 0.9158079825246701
Energy: 0.8281959771906294
Energy: 0.8362030396795082
Energy: 0.9650328864896593
Energy: 0.8362030396777985
Energy: 0.9650328864883772
Energy: 0.8362030396786534
Energy: 0.9650328864917965
Energy: 0.9946170791443311
Energy: 0.8793045053058146
Energy: 0.9946170791434763
Energy: 0.8793045053053873
Energy: 0.9946170791430488
Energy: 0.8793045053058146
Energy: 0.923861235904977
Energy: 0.8870166397096109
Energy: 0.9238612359045498
Energy: 0.8870166397096109
Energy: 0.923861235904977
Energy: 0.887016639708756
Energy: 0.9066514764491123
Energy: 0.9069919517033095
Energy: 0.9066514764486848
Energy: 0.9069919517033095
Energy: 0.9066514764499671
Energy: 0.9069919517033095
Energy: 0.9689138326668832
Energy: 0.8784146891688294
Energy: 0.9689138326668832
Energy: 0.8784146891692568
Energy: 0.9689138326651736
Energy: 0.8784146891688294
Energy: 0.8348781548605004
Energy: 1.0189811603029406
Energy: 0.8348781548609278
Energy: 1.0189811603025134
Energy: 0.8348781548605004
Energy: 1.0189811603029406
Energy: 0.92339073774467
Energy: 0.9365474780091348
Energy: 0.9233907377442426
Energy: 0.9365474780091348
Energy: 0.9233907377438152
Energy: 0.9365474780091348
Energy: 0.9438469667074701
Energy: 1.1326088155095502
Energy: 0.9438469667057607
Energy: 1.1326088155095502
Energy: 0.9438469667061881
Energy: 1.1326088155099774
Energy: 0.9095203275579256
Energy: 0.9445286244746798
Energy: 0.9095203275579256
Energy: 0.9445286244751072
Energy: 0.9095203275579256
Energy: 0.9445286244738249
Energy: 0.9219003802563042
Energy: 0.9312357161443542
Energy: 0.9219003802571589
Energy: 0.9312357161443542
Energy: 0.9219003802567315
Energy: 0.9450158247402728
Energy: 0.9096199844821871
Energy: 0.9446506090997746
Energy: 0.9096199844826144
Energy: 0.9446506090997746
Energy: 0.9096199844834693
Energy: 0.9446506090997746
Energy: 0.9436850025873045
Energy: 1.1325973342281497
Energy: 0.9436850025855951
Energy: 1.1325973342277222
Energy: 0.9436850025864498
Energy: 1.1325973342277222
Energy: 0.9234294741859
Energy: 0.936327113813814
Energy: 0.9234294741863275
Energy: 0.9363271138142025
Energy: 0.9234294741854726
Energy: 0.936327113813814
Energy: 0.8351102337612303
Energy: 1.0190040557620605
Energy: 0.8351102337633672
Energy: 1.019004055762488
Energy: 0.8351102337637947
Energy: 1.019004055762488
Energy: 0.9688805340219541
Energy: 0.8783398303420927
Energy: 0.9688805340210992
Energy: 0.8783398303420927
Energy: 0.9688805340198171
Energy: 0.8783398303425201
Energy: 0.9066446546113307
Energy: 0.9078908252581803
Energy: 0.9066446546104759
Energy: 0.9078908252577529
Energy: 0.9066446546113307
Energy: 0.9078908252577529
Energy: 0.9239064964229626
Energy: 0.8872358659934155
Energy: 0.9239064964212531
Energy: 0.8872358659934155
Energy: 0.9239064964221079
Energy: 0.8872358659934155
Energy: 0.9946547000819324
Energy: 0.8792565732781754
Energy: 0.994654700079368
Energy: 0.8792565732781754
Energy: 0.9946547000810776
Energy: 0.8792565732777481
Energy: 0.8360252624593872
Energy: 0.9652074670626553
Energy: 0.8360252624602421
Energy: 0.9652074670592361
Energy: 0.8360252624606695
Energy: 0.9652074670613731
Energy: 0.915729735589811
Energy: 0.9862055003363026
Energy: 0.9157297355885288
Energy: 0.9837402605073994
Energy: 0.9157297355893835
Energy: 0.9837402605078268
Energy: 0.9402396529272321
Energy: 0.9567486362557791
Energy: 0.9402396529280869
Energy: 0.9567486362557791
Energy: 0.940239652928553
Energy: 0.9567486362562065
Energy: 0.9098727910615726
Energy: 0.9486464174416627
Energy: 0.9098727910624276
Energy: 0.9486464174386707
Energy: 0.9098727910607178
Energy: 0.948646417439953
Energy: 0.9161600561864011
Energy: 0.8985489226720932
Energy: 0.9161600561872559
Energy: 0.8985489226717046
Energy: 0.9161600561876833
Energy: 0.8985489226720932
Energy: 0.9506486086808944
Energy: 0.8815392380733558
Energy: 0.9506486086800396
Energy: 0.881539238072501
Energy: 0.9506486086800396
Energy: 0.8815392380733558
Energy: 0.9199606123425735
Energy: 0.866748923208172
Energy: 0.9199606123494118
Energy: 0.8667489232090267
Energy: 0.9199606123481298
Energy: 0.8667489232090267
Energy: 0.8356286707011694
Energy: 0.9346186132457271
Energy: 0.8356286707015967
Energy: 0.9346186132461933
Energy: 0.8356286706994598
Energy: 0.9346186132465819
Energy: 0.9985628254954838
Energy: 0.9615122817320152
Energy: 0.9985628254950566
Energy: 0.9615122817324426
Energy: 0.9985628254950566
Energy: 0.9615122817324426
Energy: 0.9116736194239666
Energy: 0.8646634262522706
Energy: 0.9116736194239666
Energy: 0.8646634262518431
Energy: 0.9116736194239666
Energy: 0.8646634262518431
Energy: 1.011997439573379
Energy: 0.9056795561662939
Energy: 1.0119974395742337
Energy: 0.9056795561658665
Energy: 1.0119974395729516
Energy: 0.9056795561654392
Energy: 0.9117400690736983
Energy: 0.8648660030485185
Energy: 0.9117400690745531
Energy: 0.8648660030476636
Energy: 0.9117400690745531
Energy: 0.8648660030485185
Energy: 0.998310487286584
Energy: 0.9613335125833277
Energy: 0.998310487286584
Energy: 0.9613335125837551
Energy: 0.9983104872874389
Energy: 0.9613335125841825
Energy: 0.8356967332777356
Energy: 0.9485456502506008
Energy: 0.8356967332773082
Energy: 0.9485456502506008
Energy: 0.8356967332773082
Energy: 0.9485456502501347
Energy: 0.9198769148601146
Energy: 0.8667349272217042
Energy: 0.919876914860542
Energy: 0.8667349272212769
Energy: 0.9198769148601146
Energy: 0.8667349272221316

minimum gb energy = 0.8281959771906294 eV
minimum distance =  2.31388131393118 Angstroms
sigma value = 57


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

Energy: 0.9385904458263098
Energy: 0.8432007619784775
Energy: 0.9385904458263098
Energy: 0.8432007619791732
Energy: 0.938590445825614
Energy: 0.8432007619784775
Energy: 0.9777444939835713
Energy: 0.8138753638994768
Energy: 0.9777444939821794
Energy: 0.8138753638994768
Energy: 0.9777444939828753
Energy: 0.8138753638994768
Energy: 0.946977258997425
Energy: 0.9025488773261521
Energy: 0.946977258997425
Energy: 0.9025488773261521
Energy: 0.946977258997425
Energy: 0.9025488773261521
Energy: 0.7942775312247324
Energy: 0.900202128417206
Energy: 0.79427753122682
Energy: 0.9002021284185978
Energy: 0.7942775312233404
Energy: 0.900202128417902
Energy: 0.8457475039513844
Energy: 0.773360346717048
Energy: 0.8457475039506885
Energy: 0.773360346717048
Energy: 0.8457475039513844
Energy: 0.7733603467177439
Energy: 0.8992570848376464
Energy: 0.8264150833229166
Energy: 0.8992570848376464
Energy: 0.8264150833229166
Energy: 0.8992570848362547
Energy: 0.8264150833229166
Energy: 0.7917264554886886
Energy: 0.8720888634691368
Energy: 0.7917264554900804
Energy: 0.8720888634691368
Energy: 0.7917264554886886
Energy: 0.8720888634691368
Energy: 1.0670809421390426
Energy: 0.8508074572438449
Energy: 1.0670809421404344
Energy: 0.8508074572431488
Energy: 1.0670809421397387
Energy: 0.8508074572431488
Energy: 0.8328544510104752
Energy: 0.8288207479349318
Energy: 0.8328544510104752
Energy: 0.8288207479356277
Energy: 0.832854451011867
Energy: 0.8288207479356277
Energy: 0.8503323886577282
Energy: 0.8423504259099286
Energy: 0.8503323886584243
Energy: 0.8423504259099286
Energy: 0.8503323886584243
Energy: 0.8423504259092328
Energy: 0.7923614962304248
Energy: 0.9014511461762998
Energy: 0.7923614962304248
Energy: 0.901451146174212
Energy: 0.7923614962304248
Energy: 0.901451146175604
Energy: 0.8664859640899188
Energy: 0.7954107582720529
Energy: 0.8664859640899188
Energy: 0.7954107582713571
Energy: 0.8664859640913106
Energy: 0.7954107582713571
Energy: 0.8470126899870438
Energy: 0.9539358142352447
Energy: 0.8470126899884356
Energy: 0.9539358142345488
Energy: 0.8470126899898274
Energy: 0.9539358142352447
Energy: 0.7953574371785813
Energy: 0.8725486285078863
Energy: 0.7953574371792772
Energy: 0.8725486285092781
Energy: 0.7953574371785813
Energy: 0.8725486285078863
Energy: 0.9303696829415642
Energy: 0.8343608024012312
Energy: 0.9303696829415642
Energy: 0.8343608024012312
Energy: 0.9303696829415642
Energy: 0.834360802401927
Energy: 0.8447397606968203
Energy: 0.8452540601005236
Energy: 0.8447397606975161
Energy: 0.8452540600998277
Energy: 0.8447397606968203
Energy: 0.8452540600991318
Energy: 0.848053421055039
Energy: 0.9609900055349354
Energy: 0.8480534210543431
Energy: 0.9609900055356314
Energy: 0.8480534210543431
Energy: 0.9609900055349354
Energy: 0.897522692778679
Energy: 0.9268095481012908
Energy: 0.8975226927807667
Energy: 0.926809548100595
Energy: 0.8975226927807667
Energy: 0.926809548099899
Energy: 0.795280254709529
Energy: 0.9036761642092423
Energy: 0.795280254709529
Energy: 0.9036761642092423
Energy: 0.7952802547109208
Energy: 0.9036761642099382
Energy: 0.7948113389065877
Energy: 0.903585340780794
Energy: 0.7948113389065877
Energy: 0.903585340780794
Energy: 0.7948113389058918
Energy: 0.903585340780794
Energy: 0.8838121053312042
Energy: 0.9050960019265006
Energy: 0.8838121053325961
Energy: 0.905096001924413
Energy: 0.8838121053319001
Energy: 0.9050960019251089
Energy: 0.7889906164450301
Energy: 0.9049446203760116
Energy: 0.7889906164436383
Energy: 0.9049446203767078
Energy: 0.7889906164450301
Energy: 0.9049446203760116
Energy: 0.8625663004038414
Energy: 0.8652623710301618
Energy: 0.8625663004024496
Energy: 0.8652623710301618
Energy: 0.8625663004045374
Energy: 0.8652623710294658
Energy: 0.8528114856737389
Energy: 0.9014012511738015
Energy: 0.8528114856758265
Energy: 0.9014012511738015
Energy: 0.8528114856751307
Energy: 0.9014012511744974
Energy: 0.8527734613545715
Energy: 1.0766784805144618
Energy: 0.8527734613545715
Energy: 1.0766784805144618
Energy: 0.8527734613545715
Energy: 1.0766784805144618
Energy: 0.8435939322022198
Energy: 0.8655643626903488
Energy: 0.8435939322022198
Energy: 0.8655643626903488
Energy: 0.8435939322029158
Energy: 0.8655643626903488
Energy: 0.7889584414336239
Energy: 0.9039103140895778
Energy: 0.7889584414329279
Energy: 0.9039103140895778
Energy: 0.7889584414329279
Energy: 0.9039103140895778

minimum gb energy = 0.773360346717048 eV
minimum distance =  2.28409194204718 Angstroms
sigma value = 43


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

Energy: 0.8588754500964877
Energy: 0.772854844723854
Energy: 0.8588754500954736
Energy: 0.772854844723854
Energy: 0.8588754500954736
Energy: 0.772854844723854
Energy: 0.8445981251524222
Energy: 0.7724012590027551
Energy: 0.844598125151915
Energy: 0.7724012590027551
Energy: 0.8445981251524222
Energy: 0.7724012590027551
Energy: 0.8367435853649217
Energy: 0.775356579527909
Energy: 0.8367435853644147
Energy: 0.775356579526895
Energy: 0.8367435853644147
Energy: 0.7753565795263879
Energy: 0.8786058856119809
Energy: 0.799102866183238
Energy: 0.8786058856109669
Energy: 0.7991028661827311
Energy: 0.878605885611474
Energy: 0.7991028661822239
Energy: 0.8358255134369843
Energy: 0.7420178771406866
Energy: 0.8358255134369843
Energy: 0.7420178771406866
Energy: 0.8358255134369843
Energy: 0.7420178771406866
Energy: 0.7902046429837006
Energy: 0.7501633590830673
Energy: 0.7902046429837006
Energy: 0.7501633590835745
Energy: 0.7902046429837006
Energy: 0.7501633590830673
Energy: 0.7095740256041567
Energy: 0.7716537967658804
Energy: 0.7095740256041567
Energy: 0.7716537967663875
Energy: 0.709574025605678
Energy: 0.7716537967663875
Energy: 0.833929569262541
Energy: 0.7364234555151393
Energy: 0.8339295692640619
Energy: 0.7364234555151393
Energy: 0.8339295692650762
Energy: 0.7364234555156465
Energy: 0.7546485814844616
Energy: 0.7438888464608574
Energy: 0.7546485814839546
Energy: 0.7438888464608574
Energy: 0.7546485814844616
Energy: 0.7438888464613644
Energy: 0.7635700552364504
Energy: 0.7357545714764671
Energy: 0.7635700552334083
Energy: 0.7357545714749458
Energy: 0.7635700552359435
Energy: 0.7357545714759599
Energy: 0.9088929327447034
Energy: 0.7272232481170952
Energy: 0.9088929327457175
Energy: 0.7272232481176021
Energy: 0.9088929327457175
Energy: 0.7272232481170952
Energy: 0.71912558385633
Energy: 0.7451924457358164
Energy: 0.7191255838558229
Energy: 0.7451924457353094
Energy: 0.7191255838558229
Energy: 0.7451924457348023
Energy: 0.7620308415182311
Energy: 0.7064880463855921
Energy: 0.7620308415197522
Energy: 0.7064880463860991
Energy: 0.76203084151671
Energy: 0.7064880463855921
Energy: 0.9133745770718967
Energy: 0.8032551081186824
Energy: 0.9133745770713896
Energy: 0.8032551081176682
Energy: 0.9133745770718967
Energy: 0.8032551081171613
Energy: 0.7339389532306166
Energy: 0.7421084738740934
Energy: 0.7339389532311238
Energy: 0.7421084738746004
Energy: 0.7339389532306166
Energy: 0.7421084738746004
Energy: 0.7802367832124545
Energy: 0.7810024562887802
Energy: 0.7802367832124545
Energy: 0.7810024562887802
Energy: 0.7802367832129616
Energy: 0.7810024562887802
Energy: 0.7106856747181449
Energy: 0.8060060637700213
Energy: 0.7106856747176379
Energy: 0.8060060637705282
Energy: 0.7106856747176379
Energy: 0.8060060637700213
Energy: 0.760501849256276
Energy: 0.7036394815355664
Energy: 0.7605018492557689
Energy: 0.7036394815365805
Energy: 0.760501849256276
Energy: 0.7036394815360736
Energy: 0.7115413138134195
Energy: 0.8427874535160007
Energy: 0.7115413138124055
Energy: 0.8427874535154938
Energy: 0.7115413138134195
Energy: 0.8427874535154938
Energy: 0.7414188221401345
Energy: 0.8207074249413719
Energy: 0.7414188221406416
Energy: 0.820707424941879
Energy: 0.7414188221401345
Energy: 0.820707424941879
Energy: 0.8194611327540074
Energy: 0.7485238340875073
Energy: 0.8194611327545144
Energy: 0.7485238340875073
Energy: 0.8194611327545144
Energy: 0.7485238340870004
Energy: 0.7835937514352561
Energy: 0.8360008613265882
Energy: 0.7835937514347491
Energy: 0.8360008613260811
Energy: 0.783593751433735
Energy: 0.8360008613260811
Energy: 0.7793056179179603
Energy: 0.8390978873782337
Energy: 0.7793056179169463
Energy: 0.8390978873787406
Energy: 0.7793056179174532
Energy: 0.8390978873787406
Energy: 0.7988407041654455
Energy: 0.8242739741453854
Energy: 0.7988407041659524
Energy: 0.8242739741453854
Energy: 0.7988407041654455
Energy: 0.8242739741448784
Energy: 0.7104721509770276
Energy: 0.7372196373049061
Energy: 0.7104721509780418
Energy: 0.7372196373049061
Energy: 0.7104721509760137
Energy: 0.7372196373054131
Energy: 0.7351526637700414
Energy: 0.8035291657179684
Energy: 0.7351526637700414
Energy: 0.8035291657179684
Energy: 0.7351526637695343
Energy: 0.8035291657179684
Energy: 0.7974292048723631
Energy: 0.7314822432579217
Energy: 0.7974292048728702
Energy: 0.7314822432579217
Energy: 0.7974292048718561
Energy: 0.7314822432558935
Energy: 0.6778628269044261
Energy: 0.8204739755328878
Energy: 0.6778628269049332
Energy: 0.8204739755333949
Energy: 0.6778628269039191
Energy: 0.8204739755333949
Energy: 0.7350156106220581
Energy: 0.7531030361103787
Energy: 0.7350156106215511
Energy: 0.7531030361103787
Energy: 0.7350156106220581
Energy: 0.7531030361103787
Energy: 0.7338247296931478
Energy: 0.863263430079989
Energy: 0.7338247296926408
Energy: 0.8632634300794819
Energy: 0.7338247296926408
Energy: 0.863263430079989
Energy: 0.6847844835041365
Energy: 0.8157835115430564
Energy: 0.6847844835036294
Energy: 0.8157835115440704
Energy: 0.6847844835046435
Energy: 0.8157835115430564
Energy: 0.7356260812609111
Energy: 0.7339857749736859
Energy: 0.7356260812609111
Energy: 0.7339857749736859
Energy: 0.735626081261418
Energy: 0.7339857749731789
Energy: 0.7136257765958424
Energy: 0.7374053508266932
Energy: 0.7136257765948284
Energy: 0.7374053508221298
Energy: 0.7136257765958424
Energy: 0.7374053508398302
Energy: 0.9065056658359789
Energy: 0.9164289211071414
Energy: 0.9065056658364858
Energy: 0.9164289211076483
Energy: 0.9065056658369928
Energy: 0.9164289211076483
Energy: 0.7636008400893006
Energy: 0.7146305991384253
Energy: 0.7636008400903147
Energy: 0.7146305991389322
Energy: 0.7636008400893006
Energy: 0.7146305991384253
Energy: 0.6692207470658263
Energy: 0.7375510465089818
Energy: 0.6692207470663334
Energy: 0.7375510465084749
Energy: 0.6692207470658263
Energy: 0.7375510465099959

minimum gb energy = 0.6692207470658263 eV
minimum distance =  2.27771618126965 Angstroms
sigma value = 81


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

Energy: 0.4151660020428256
Energy: 0.46108979345884665
Energy: 0.09617697117326106
Energy: 0.46108979345884665
Energy: 0.4151660020428256
Energy: 0.46108979345884665
Energy: 0.9510520304832791
Energy: 0.09720440272244449
Energy: 0.9510520304832791
Energy: 0.09720440272430747
Energy: 0.9510520304832791
Energy: 0.09720440272244449
Energy: 0.8304943034808301
Energy: 0.09630929527430936
Energy: 0.8304943034790094
Energy: 0.09630929527430936
Energy: 0.8304943034808301
Energy: 0.09630929527430936
Energy: 0.09617697117326106
Energy: 0.46108979345884665
Energy: 0.09617697117326106
Energy: 0.46108979345884665
Energy: 0.09617697117326106
Energy: 0.46108979345884665
Energy: 0.9510520304814162
Energy: 0.09720440272244449
Energy: 0.9510520304832791
Energy: 0.09720440272244449
Energy: 0.9510520304814162
Energy: 0.09720440272244449
Energy: 0.8304943034790094
Energy: 0.09630929527430936
Energy: 0.8304943034808301
Energy: 0.09630929527430936
Energy: 0.8304943034790094
Energy: 0.09630929527430936
Energy: 0.4151660020428256
Energy: 0.46108979346070955
Energy: 0.09617697117326106
Energy: 0.46108979346070955
Energy: 0.4151660020428256
Energy: 0.46108979345884665
Energy: 0.9510520304814162
Energy: 0.09720440272244449
Energy: 0.9510520304832791
Energy: 0.09720440272244449
Energy: 0.9510520304814162
Energy: 0.09720440272244449
Energy: 0.8304943034808301
Energy: 0.09630929527244637
Energy: 0.8304943034808301
Energy: 0.09630929527244637
Energy: 0.8304943034790094
Energy: 0.09630929527430936
Energy: 0.09617697117326106
Energy: 0.46108979345884665
Energy: 0.09617697117326106
Energy: 0.46108979345884665
Energy: 0.09617697117326106
Energy: 0.46108979345884665

minimum gb energy = 0.09617697117326106 eV
minimum distance =  2.42499050358936 Angstroms
sigma value = 3


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

Energy: 0.8038808923702166
Energy: 0.7344096045936583
Energy: 0.8038808923702166
Energy: 0.7344096045931008
Energy: 0.8038808923702166
Energy: 0.7344096045931008
Energy: 0.7530710116148819
Energy: 0.7540272318653547
Energy: 0.7530710116148819
Energy: 0.7540272318659121
Energy: 0.7530710116148819
Energy: 0.7540272318659121
Energy: 0.7917520464782037
Energy: 0.6624442645941956
Energy: 0.7917520464782037
Energy: 0.662444264594753
Energy: 0.7917520464782037
Energy: 0.662444264594753
Energy: 0.8482016903143414
Energy: 0.7384818804517971
Energy: 0.8482016903143414
Energy: 0.7384818804523545
Energy: 0.8482016903143414
Energy: 0.7384818804517971
Energy: 0.6450831891140911
Energy: 0.7538616475467123
Energy: 0.6450831891124187
Energy: 0.7538616475467123
Energy: 0.6450831891124187
Energy: 0.7538616475472697
Energy: 0.796114961715837
Energy: 0.8265574433528987
Energy: 0.7961149617152795
Energy: 0.8265574433528987
Energy: 0.7961149617163944
Energy: 0.8265574433534563
Energy: 0.8089728848353598
Energy: 0.7531239127374105
Energy: 0.8089728848353598
Energy: 0.7531239127379681
Energy: 0.8089728848353598
Energy: 0.753123912736853
Energy: 0.6423014117818765
Energy: 0.7670857162829458
Energy: 0.642301411782434
Energy: 0.7670857162829458
Energy: 0.6423014117818765
Energy: 0.7670857162829458
Energy: 0.8111064298266965
Energy: 0.8120288796854911
Energy: 0.8111064298266965
Energy: 0.8120288796854911
Energy: 0.8111064298278114
Energy: 0.8120288796854911
Energy: 0.733207721045971
Energy: 0.6893975286523819
Energy: 0.7332077210454134
Energy: 0.6893975286529395
Energy: 0.7332077210454134
Energy: 0.689397528653497
Energy: 0.6850387800197727
Energy: 0.7625641333266111
Energy: 0.6850387800186577
Energy: 0.7625641333266111
Energy: 0.6850387800203303
Energy: 0.7625641333260536
Energy: 0.8429476703128618
Energy: 0.8440709804006705
Energy: 0.8429476703128618
Energy: 0.8440709804006705
Energy: 0.8429476703128618
Energy: 0.8440709804012281
Energy: 0.7735456171150968
Energy: 0.6512790920458515
Energy: 0.7735456171156544
Energy: 0.651279092045294
Energy: 0.7735456171156544
Energy: 0.6512790920458515
Energy: 0.7069721531885615
Energy: 0.8164737798180365
Energy: 0.7069721531896764
Energy: 0.8164737798180365
Energy: 0.706972153189119
Energy: 0.8164737798174789
Energy: 0.7750362872318707
Energy: 0.8151612881731382
Energy: 0.7750362872313131
Energy: 0.8151612881725806
Energy: 0.7750362872313131
Energy: 0.8151612881731382
Energy: 0.7241300701544207
Energy: 0.6422369924511426
Energy: 0.7241300701549782
Energy: 0.6422369924522576
Energy: 0.7241300701538632
Energy: 0.6422369924522576
Energy: 0.7597837838232928
Energy: 0.8373797664338878
Energy: 0.7597837838227354
Energy: 0.8373797664338878
Energy: 0.7597837838227354
Energy: 0.8373797664338878
Energy: 0.781440983580854
Energy: 0.7836776549625049
Energy: 0.7814409835802965
Energy: 0.7836776549625049
Energy: 0.781440983580854
Energy: 0.7836776549630623
Energy: 0.7817789082107279
Energy: 0.6568465312119852
Energy: 0.7817789082096128
Energy: 0.6568465312114278
Energy: 0.7817789082096128
Energy: 0.6568465312119852
Energy: 0.7417375089893946
Energy: 0.8827808946002997
Energy: 0.7417375089893946
Energy: 0.8827808946008573
Energy: 0.7417375089905095
Energy: 0.8827808946008573
Energy: 0.8010755523811756
Energy: 0.7566830958200658
Energy: 0.8010755523817331
Energy: 0.7566830958195083
Energy: 0.8010755523817331
Energy: 0.7566830958195083
Energy: 0.6883685906396477
Energy: 0.762368981099434
Energy: 0.6883685906396477
Energy: 0.7623689810999915
Energy: 0.6883685906379752
Energy: 0.762368981099434
Energy: 0.7543970191301979
Energy: 0.867701359132831
Energy: 0.7543970191296403
Energy: 0.867701359132831
Energy: 0.7543970191296403
Energy: 0.8677013591333885
Energy: 0.7823507404338473
Energy: 0.6503003199020263
Energy: 0.7823507404338473
Energy: 0.6503003199020263
Energy: 0.7823507404338473
Energy: 0.650300319901469
Energy: 0.8345022147443245
Energy: 0.7183639322251555
Energy: 0.8345022147443245
Energy: 0.7183639322251555
Energy: 0.8345022147443245
Energy: 0.7183639322251555
Energy: 0.7288487171643644
Energy: 0.8293909049476444
Energy: 0.7288487171649217
Energy: 0.829390904948202
Energy: 0.7288487171649217
Energy: 0.8293909049476444
Energy: 0.8590578339363999
Energy: 0.6487625756263719
Energy: 0.8590578339363999
Energy: 0.6487625756269294
Energy: 0.8590578339363999
Energy: 0.6487625756269294
Energy: 0.8085705527501788
Energy: 0.7371871376307985
Energy: 0.8085705527501788
Energy: 0.737187137630241
Energy: 0.8085705527496212
Energy: 0.737187137630241
Energy: 0.704768428187391
Energy: 0.7538552399275464
Energy: 0.7047684281879486
Energy: 0.7538552399275464
Energy: 0.704768428187391
Energy: 0.7538552399275464
Energy: 0.8622343962430536
Energy: 0.6938004512185623
Energy: 0.8622343962424961
Energy: 0.6938004512180047
Energy: 0.8622343962424961
Energy: 0.6938004512191196
Energy: 0.8075959908656537
Energy: 0.8175605504733687
Energy: 0.8075959908662113
Energy: 0.8175605504728113
Energy: 0.8075959908656537
Energy: 0.8175605504722538
Energy: 0.6833894757073715
Energy: 0.7453506537202329
Energy: 0.6833894757073715
Energy: 0.7453506537196753
Energy: 0.6833894757079291
Energy: 0.7453506537196753
Energy: 0.8104441958862098
Energy: 0.7478701045455445
Energy: 0.8104441958862098
Energy: 0.7478701045455445
Energy: 0.8104441958862098
Energy: 0.747870104546102

minimum gb energy = 0.6422369924511426 eV
minimum distance =  2.30697695389135 Angstroms
sigma value = 67


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

Energy: 1.0274936645047272
Energy: 0.9010905157028726
Energy: 1.0274936645031383
Energy: 0.9010905157020783
Energy: 1.0274936645039328
Energy: 0.9010905157028726
Energy: 0.8994977400246444
Energy: 0.9239117590705231
Energy: 0.8994977400254387
Energy: 0.9239117590697288
Energy: 0.8994977400246444
Energy: 0.9239117590697288
Energy: 0.8989085828972156
Energy: 0.9287427353274451
Energy: 0.8989085828972156
Energy: 0.9287427353282395
Energy: 0.8989085828964213
Energy: 0.9287427353274451
Energy: 0.977668588594931
Energy: 0.9118829347845708
Energy: 0.9776685885957254
Energy: 0.9118829347845708
Energy: 0.977668588594931
Energy: 0.9118829347845708
Energy: 0.788498067585292
Energy: 0.884997993917035
Energy: 0.7884980675844975
Energy: 0.8849979939162406
Energy: 0.788498067585292
Energy: 0.884997993917035
Energy: 0.9647310513639473
Energy: 0.9650933744908717
Energy: 0.964731051363153
Energy: 0.9650933744908717
Energy: 0.964731051363153
Energy: 0.9650933744900771
Energy: 0.8967418637237042
Energy: 0.8534621018041305
Energy: 0.8967418637237042
Energy: 0.8534621018033361
Energy: 0.8967418637237042
Energy: 0.8534621018041305
Energy: 0.8557284264052603
Energy: 0.8749300964744301
Energy: 0.8557284264052603
Energy: 0.8749300964752245
Energy: 0.8557284264036715
Energy: 0.8749300964752245
Energy: 0.9974093632375124
Energy: 1.0086002570872752
Energy: 0.9974093632375124
Energy: 1.0086002570864807
Energy: 0.9974093632375124
Energy: 1.0086002570872752
Energy: 0.8977615915409243
Energy: 0.8083254277536704
Energy: 0.8977615915409243
Energy: 0.8083254277528761
Energy: 0.8977615915401299
Energy: 0.8083254277528761
Energy: 0.9076066787202299
Energy: 0.9587021902656253
Energy: 0.9076066787194357
Energy: 0.958702190264831
Energy: 0.9076066787210243
Energy: 0.958702190264831
Energy: 0.9017075167406716
Energy: 0.9433838339161754
Energy: 0.901707516739083
Energy: 0.9433838339161754
Energy: 0.901707516739083
Energy: 0.9433838339161754
Energy: 0.9028426041851976
Energy: 0.8859130297044172
Energy: 0.9028426041851976
Energy: 0.8859130297044172
Energy: 0.9028426041851976
Energy: 0.8859130297044172
Energy: 0.8841514928369508
Energy: 1.035202157370503
Energy: 0.8841514928369508
Energy: 1.0352021573712973
Energy: 0.8841514928361567
Energy: 1.035202157370503
Energy: 0.9058439529408003
Energy: 0.8915695353864294
Energy: 0.9058439529408003
Energy: 0.8915695353864294
Energy: 0.9058439529408003
Energy: 0.8915695353864294
Energy: 0.8030784202126546
Energy: 0.9185001788255621
Energy: 0.8030784202126546
Energy: 0.9185001788263565
Energy: 0.8030784202126546
Energy: 0.9185001788255621
Energy: 0.9176134504829117
Energy: 0.9767962018486984
Energy: 0.9176134504829117
Energy: 0.9767962018486984
Energy: 0.9176134504837059
Energy: 0.9767962018494928
Energy: 0.9216445948609431
Energy: 0.7853182630262405
Energy: 0.9216445948609431
Energy: 0.7853182630262405
Energy: 0.9216445948617374
Energy: 0.7853182630270348
Energy: 0.956246630806197
Energy: 0.8886690745538273
Energy: 0.956246630806197
Energy: 0.8886690745562104
Energy: 0.956246630806197
Energy: 0.8886690745562104
Energy: 0.7920608070741162
Energy: 0.9236581517025535
Energy: 0.7920608070764994
Energy: 0.9236581517017591
Energy: 0.7920608070764994
Energy: 0.9236581517033479
Energy: 0.9832063268781057
Energy: 0.8045887593689427
Energy: 0.9832063268773112
Energy: 0.8045887593689427
Energy: 0.9832063268773112
Energy: 0.8045887593681484
Energy: 0.9908954631191623
Energy: 1.0294691368253561
Energy: 0.9908954631183677
Energy: 1.0294691368253561
Energy: 0.9908954631191623
Energy: 1.0294691368261504
Energy: 0.8030530567191888
Energy: 0.87705539891453
Energy: 0.8030530567191888
Energy: 0.8770553989153244
Energy: 0.8030530567191888
Energy: 0.87705539891453

minimum gb energy = 0.7853182630262405 eV
minimum distance =  2.31962794800669 Angstroms
sigma value = 33


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

Energy: 1.1078148103680494
Energy: 0.9548018703565345
Energy: 1.1078148103680494
Energy: 0.9548018703560306
Energy: 1.1078148103680494
Energy: 0.9548018703560306
Energy: 0.9782516842950469
Energy: 1.0082168069117055
Energy: 0.978251684294543
Energy: 1.0082168069122097
Energy: 0.9782516842950469
Energy: 1.0082168069117055
Energy: 1.0519862338883925
Energy: 1.0516630943808263
Energy: 1.0519862338883925
Energy: 1.0516630943808263
Energy: 1.0519862338883925
Energy: 1.0516630943808263
Energy: 1.0634063338048316
Energy: 0.9856948966244945
Energy: 1.0634063338048316
Energy: 0.9856948966244945
Energy: 1.0634063338048316
Energy: 0.9856948966249984
Energy: 0.9205966491954375
Energy: 1.0024821376122643
Energy: 0.9205966491949336
Energy: 1.0024821376117603
Energy: 0.9205966491954375
Energy: 1.0024821376117603
Energy: 1.1372599535755645
Energy: 1.1029114510205993
Energy: 1.1372599535750605
Energy: 1.0914152246544764
Energy: 1.1372599535745567
Energy: 1.0914152246544764
Energy: 0.9757659021798945
Energy: 0.939880899284375
Energy: 0.9757659021788866
Energy: 0.9398808992848788
Energy: 0.9757659021793904
Energy: 0.9398808992848788
Energy: 0.9723369361017085
Energy: 1.0638869661257282
Energy: 0.9723369361012044
Energy: 1.0638869661262322
Energy: 0.9723369361012044
Energy: 1.0638869661262322
Energy: 1.001238169548567
Energy: 1.0606283909204488
Energy: 1.001238169547559
Energy: 1.0606283909204488
Energy: 1.001238169548567
Energy: 1.0606283909204488
Energy: 1.0606546088152675
Energy: 1.0113485277273089
Energy: 1.0606546088147635
Energy: 1.011348527727813
Energy: 1.0606546088147635
Energy: 1.011348527727813
Energy: 1.0161788059685593
Energy: 1.0525867148654824
Energy: 1.0161788059680552
Energy: 1.0525867148639707
Energy: 1.0161788059685593
Energy: 1.0525867148654824
Energy: 0.9774023555385514
Energy: 0.9903370574522614
Energy: 0.977402355540063
Energy: 0.9903370574522614
Energy: 0.9774023555395591
Energy: 0.9903370574522614
Energy: 1.101314744172227
Energy: 0.9596565689339146
Energy: 1.101314744172227
Energy: 0.9596565689339146
Energy: 1.101314744172227
Energy: 0.9596565689344186
Energy: 0.985509939520314
Energy: 1.0507102599357583
Energy: 0.9855099395208179
Energy: 1.0507102599357583
Energy: 0.9855099395208179
Energy: 1.0507102599357583
Energy: 1.0150950779932442
Energy: 1.0054683692857482
Energy: 1.0150950779932442
Energy: 1.0054683692847406
Energy: 1.0150950779932442
Energy: 1.0054683692852444
Energy: 1.063025273229221
Energy: 1.0602299066093526
Energy: 1.063025273229221
Energy: 1.0602299066093526
Energy: 1.063025273229221
Energy: 1.0602299066093526
Energy: 0.9099306372839961
Energy: 1.0548170449634469
Energy: 0.9099306372814764
Energy: 1.0548170449639507
Energy: 0.9099306372814764
Energy: 1.0548170449634469
Energy: 1.080389637923817
Energy: 1.0612944736693786
Energy: 1.080389637924321
Energy: 1.061294473668371
Energy: 1.0803896379248248
Energy: 1.061294473668371
Energy: 0.9794632193008038
Energy: 1.0674464060898816
Energy: 0.9794632193018118
Energy: 1.0674464060898816
Energy: 0.9794632193002998
Energy: 1.0674464060898816
Energy: 0.9787248678644427
Energy: 1.0085123188633611
Energy: 0.9787248678634348
Energy: 1.008512318862857
Energy: 0.9787248678639388
Energy: 1.0085123188633611
Energy: 1.0576784067535658
Energy: 1.057145400696598
Energy: 1.0576784067526037
Energy: 1.057145400696598
Energy: 1.0576784067535658
Energy: 1.057145400696598
Energy: 1.0148533063601795
Energy: 0.8793563556432853
Energy: 1.0148533063601795
Energy: 0.8793563556422774
Energy: 1.0148533063601795
Energy: 0.8793563556427814
Energy: 1.015928692988185
Energy: 1.0525527127859997
Energy: 1.015928692988689
Energy: 1.0525527127859997
Energy: 1.015928692988689
Energy: 1.0525527127854957
Energy: 1.060423025812536
Energy: 1.0548927623856057
Energy: 1.060423025813544
Energy: 1.0548927623861097
Energy: 1.060423025812032
Energy: 1.0855778928306328
Energy: 0.9752673394885726
Energy: 0.9904492099132582
Energy: 0.9752673394875647
Energy: 0.9904492099132582
Energy: 0.9752673394885726
Energy: 0.9904492099132582
Energy: 1.0148362740804662
Energy: 1.0641729045584505
Energy: 1.0148362740789543
Energy: 1.0641729045584505
Energy: 1.0148362740804662
Energy: 1.0641729045584505
Energy: 0.9761792626218989
Energy: 0.9734928763379616
Energy: 0.9761792626224028
Energy: 0.9734928763374576
Energy: 0.9761792626213949
Energy: 0.9734928763374576
Energy: 0.9792993048865739
Energy: 1.1291934019651282
Energy: 0.9792993048865739
Energy: 1.1291934019651282
Energy: 0.9792993048865739
Energy: 1.1121938450779898
Energy: 0.9727433208432001
Energy: 1.002819845831812
Energy: 0.9727433208432001
Energy: 1.002819845831812
Energy: 0.9727433208426962
Energy: 1.002819845831308
Energy: 0.9749492698561459
Energy: 0.9358830017621304
Energy: 0.9749492698551381
Energy: 0.9358830017626343
Energy: 0.9749492698571539
Energy: 0.9358830017621304
Energy: 1.113794714648686
Energy: 1.1077241496171162
Energy: 1.113794714648182
Energy: 1.1077241496166121
Energy: 1.1137947146491898
Energy: 1.1077241496171162
Energy: 0.9239036389297636
Energy: 1.008799014008991
Energy: 0.9239036389292596
Energy: 1.0087990140094951
Energy: 0.9239036389297636
Energy: 1.0087990140094951
Energy: 1.0606525123073527
Energy: 1.0179563668005085
Energy: 1.0606525123073527
Energy: 1.0179563668014706
Energy: 1.0606525123078563
Energy: 1.0179563668014706
Energy: 1.0131013395798085
Energy: 1.0087240591010385
Energy: 1.0131013395782966
Energy: 1.0087240591010385
Energy: 1.0131013395782966
Energy: 1.0087240591010385
Energy: 0.9914102657800963
Energy: 1.0527753008111338
Energy: 0.9914102657800963
Energy: 1.0527753008111338
Energy: 0.9914102657806003
Energy: 1.0527753008111338
Energy: 1.130932353247597
Energy: 0.9554256704523717
Energy: 1.1309323532470932
Energy: 0.9554256704523717
Energy: 1.1309323532470932
Energy: 0.9554256704523717
Energy: 0.9789375343886698
Energy: 1.0029344122519737
Energy: 0.9789375343891737
Energy: 1.0029344122524775
Energy: 0.9789375343891737
Energy: 1.0029344122514696

minimum gb energy = 0.8793563556422774 eV
minimum distance =  2.29255361314198 Angstroms
sigma value = 41


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

Energy: 1.1912058562984524
Energy: 1.1302687541940866
Energy: 1.1912058562984524
Energy: 1.1302687541954624
Energy: 1.1912058562984524
Energy: 1.1302687541954624
Energy: 1.1087949850294962
Energy: 1.1664952963248165
Energy: 1.1087949850308723
Energy: 1.1664952963261923
Energy: 1.1087949850308723
Energy: 1.1664952963261923
Energy: 1.2804683735775024
Energy: 1.1577113692945864
Energy: 1.2804683735788782
Energy: 1.1577113692945864
Energy: 1.2804683735788782
Energy: 1.1577113692945864
Energy: 1.2032198733497588
Energy: 1.1680262980803644
Energy: 1.2032198733497588
Energy: 1.1680262980803644
Energy: 1.2032198733497588
Energy: 1.1680262980803644
Energy: 1.095458457775942
Energy: 1.1499402997379138
Energy: 1.095458457775942
Energy: 1.1499402997379138
Energy: 1.095458457775942
Energy: 1.1499402997379138
Energy: 1.2654092615796766
Energy: 1.2077402494358072
Energy: 1.2654092615796766
Energy: 1.2077402494371832
Energy: 1.2654092615810526
Energy: 1.2077402494344314
Energy: 1.19053473578703
Energy: 1.0971889368644658
Energy: 1.19053473578703
Energy: 1.0971889368644658
Energy: 1.19053473578703
Energy: 1.0971889368644658
Energy: 1.1716409095514801
Energy: 1.162326506349506
Energy: 1.1716409095514801
Energy: 1.162326506349506
Energy: 1.1716409095514801
Energy: 1.1623265063481303
Energy: 1.1105840166312135
Energy: 1.1088965792914887
Energy: 1.1105840166325895
Energy: 1.1088965792914887
Energy: 1.1105840166312135
Energy: 1.1088965792914887
Energy: 1.1936697009702841
Energy: 1.1437458599412607
Energy: 1.1936697009702841
Energy: 1.1437458599412607
Energy: 1.1936697009702841
Energy: 1.1437458599412607
Energy: 1.11193138428973
Energy: 1.1580665693159746
Energy: 1.111931384288354
Energy: 1.1580665693159746
Energy: 1.111931384288354
Energy: 1.1580665693159746
Energy: 1.1595519782753958
Energy: 1.1646987486899216
Energy: 1.1595519782767716
Energy: 1.1646987486899216
Energy: 1.1595519782753958
Energy: 1.1646987486899216
Energy: 1.1884892906477935
Energy: 1.2019745700428002
Energy: 1.1884892906477935
Energy: 1.2019745700428002
Energy: 1.1884892906491693
Energy: 1.2019745700428002
Energy: 1.100481399962995
Energy: 1.1700644878718207
Energy: 1.1004813999616192
Energy: 1.1700644878718207
Energy: 1.100481399962995
Energy: 1.1700644878718207

minimum gb energy = 1.095458457775942 eV
minimum distance =  2.24881293721869 Angstroms
sigma value = 11


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

Energy: 1.3317968191203393
Energy: 1.3180750543021045
Energy: 1.3317968191203393
Energy: 1.3180750543021045
Energy: 1.331796819119735
Energy: 1.3180750543021045
Energy: 1.209390564603485
Energy: 1.2720872228913385
Energy: 1.2093905646040894
Energy: 1.2720872228913385
Energy: 1.2093905646046939
Energy: 1.2720872228913385
Energy: 1.3379171078951928
Energy: 1.261636248862949
Energy: 1.3379171078951928
Energy: 1.261636248862949
Energy: 1.3379171078951928
Energy: 1.261636248862949
Energy: 1.2767777707559127
Energy: 1.2285726520635318
Energy: 1.2767777707559127
Energy: 1.228572652064136
Energy: 1.2767777707565173
Energy: 1.228572652064136
Energy: 1.2878842309712055
Energy: 1.2507483531732988
Energy: 1.28788423097181
Energy: 1.2507483531732988
Energy: 1.2878842309724143
Energy: 1.2507483531732988
Energy: 1.2466907038497308
Energy: 1.3018342413327952
Energy: 1.2466907038497308
Energy: 1.3018342413327952
Energy: 1.2466907038503352
Energy: 1.3018342413327952
Energy: 1.2692139135433622
Energy: 1.2500119364861573
Energy: 1.2692139135427578
Energy: 1.2500119364861573
Energy: 1.2692139135433622
Energy: 1.2500119364861573
Energy: 1.2582032742975198
Energy: 1.2559944272235142
Energy: 1.2582032742975198
Energy: 1.2559944272229098
Energy: 1.2582032742975198
Energy: 1.2559944272229098
Energy: 1.2718060366710444
Energy: 1.2520908205710848
Energy: 1.2718060366710444
Energy: 1.2520908205710848
Energy: 1.271806036671649
Energy: 1.2520908205710848
Energy: 1.2456277588848097
Energy: 1.2756830352932407
Energy: 1.2456277588836007
Energy: 1.2756830352932407
Energy: 1.245627758884205
Energy: 1.2756830352932407
Energy: 1.229152513474037
Energy: 1.2619329473688814
Energy: 1.2291525134746415
Energy: 1.2619329473688814
Energy: 1.2291525134746415
Energy: 1.2619329473688814
Energy: 1.2713132949548482
Energy: 1.2909664718043588
Energy: 1.2713132949554526
Energy: 1.2909664718043588
Energy: 1.2713132949548482
Energy: 1.2909664718043588
Energy: 1.2798910023943335
Energy: 1.265392190522201
Energy: 1.2798910023937293
Energy: 1.2653921905215966
Energy: 1.2798910023943335
Energy: 1.265392190522201
Energy: 1.265980878670457
Energy: 1.2923999714191816
Energy: 1.265980878670457
Energy: 1.2923999714191816
Energy: 1.2659808786686435
Energy: 1.2923999714191816
Energy: 1.2089341700450116
Energy: 1.2551308231367566
Energy: 1.2089341700450116
Energy: 1.2551308231367566
Energy: 1.2089341700450116
Energy: 1.2551308231367566
Energy: 1.268540007670456
Energy: 1.2508961914477241
Energy: 1.268540007670456
Energy: 1.2508961914477241
Energy: 1.268540007670456
Energy: 1.2508961914465153
Energy: 1.224404275841144
Energy: 1.2643439431767618
Energy: 1.224404275841144
Energy: 1.2643439431767618
Energy: 1.224404275841144
Energy: 1.2643439431767618
Energy: 1.2943005093353115
Energy: 1.305013898527598
Energy: 1.294300509334707
Energy: 1.305013898526994
Energy: 1.2943005093353115
Energy: 1.305013898527598
Energy: 1.2341412736831696
Energy: 1.2143987603984983
Energy: 1.2341412736837465
Energy: 1.2143987603984983
Energy: 1.2341412736831696
Energy: 1.2143987603984983
Energy: 1.256079413994583
Energy: 1.2573036392154142
Energy: 1.2560794139951874
Energy: 1.2573036392154142
Energy: 1.2560794139957918
Energy: 1.2573036392154142
Energy: 1.219491263722593
Energy: 1.242798795455077
Energy: 1.219491263722593
Energy: 1.242798795455077
Energy: 1.219491263722593
Energy: 1.242798795455077
Energy: 1.327769825170046
Energy: 1.3028142363387647
Energy: 1.3277698251706505
Energy: 1.3028142363387647
Energy: 1.327769825170046
Energy: 1.3028142363387647
Energy: 1.289257717813367
Energy: 1.2590475022317693
Energy: 1.289257717813367
Energy: 1.2590475022311651
Energy: 1.289257717813367
Energy: 1.2590475022311651
Energy: 1.30103872318209
Energy: 1.271934313903353
Energy: 1.3010387231826945
Energy: 1.271934313903353
Energy: 1.30103872318209
Energy: 1.271934313903353
Energy: 1.2490616600014595
Energy: 1.2612535329117494
Energy: 1.2490616600014595
Energy: 1.2612535329111447
Energy: 1.2490616600014595
Energy: 1.2612535329117494
Energy: 1.2454415619672288
Energy: 1.2578243248286651
Energy: 1.2454415619666244
Energy: 1.2578243248286651
Energy: 1.2454415619672288
Energy: 1.257824324828061
Energy: 1.238976716166415
Energy: 1.2974330144415351
Energy: 1.238976716166415
Energy: 1.2974330144445576
Energy: 1.238976716166415
Energy: 1.2974330144433486
Energy: 1.2754633937754287
Energy: 1.2434545360879872
Energy: 1.27546339377422
Energy: 1.243454536087383
Energy: 1.27546339377422
Energy: 1.243454536087383
Energy: 1.2662574815113186
Energy: 1.3011369600527742
Energy: 1.2662574815113186
Energy: 1.3011369600527742
Energy: 1.2662574815113186
Energy: 1.3011369600527742
Energy: 1.2434522907321774
Energy: 1.2016786051075927
Energy: 1.2434522907327819
Energy: 1.2016786051075927
Energy: 1.2434522907321774
Energy: 1.2016786051075927
Energy: 1.2446816214837948
Energy: 1.2857330770836637
Energy: 1.2446816214837948
Energy: 1.2857330770824549
Energy: 1.2446816214837948
Energy: 1.2857330770830593

minimum gb energy = 1.2016786051075927 eV
minimum distance =  2.23956343276031 Angstroms
sigma value = 57


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

Energy: 1.2023106142124065
Energy: 1.218658376068069
Energy: 1.2023106142124065
Energy: 1.218658376068069
Energy: 1.2023106142124065
Energy: 1.218658376068069
Energy: 1.202898220454896
Energy: 1.254682594298847
Energy: 1.202898220454896
Energy: 1.254682594299923
Energy: 1.2028982204559713
Energy: 1.254682594298847
Energy: 1.2789682357958014
Energy: 1.2585422839876186
Energy: 1.2789682357958014
Energy: 1.2585422839876186
Energy: 1.2789682357958014
Energy: 1.2585422839876186
Energy: 1.213107553687097
Energy: 1.4144556640987482
Energy: 1.213107553687097
Energy: 1.4144556640987482
Energy: 1.213107553687097
Energy: 1.5113846343077078
Energy: 1.2787407539772373
Energy: 1.2586012706995742
Energy: 1.2787407539761617
Energy: 1.2586012706995742
Energy: 1.2787407539761617
Energy: 1.2586012706995742
Energy: 1.2082685140721015
Energy: 1.282080256640617
Energy: 1.208268514073177
Energy: 1.282080256640617
Energy: 1.208268514073177
Energy: 1.282080256640617
Energy: 1.2023106142124065
Energy: 1.218658376068069
Energy: 1.2023106142124065
Energy: 1.218658376068069
Energy: 1.2023106142124065
Energy: 1.218658376068069
Energy: 1.202898220454896
Energy: 1.254682594299923
Energy: 1.2028982204559713
Energy: 1.254682594299923
Energy: 1.202898220454896
Energy: 1.254682594299923
Energy: 1.2789682357947258
Energy: 1.2585422839886942
Energy: 1.2789682357958014
Energy: 1.2585422839886942
Energy: 1.2789682357958014
Energy: 1.2585422839886942
Energy: 1.213107553687097
Energy: 1.3974044546381235
Energy: 1.213107553687097
Energy: 1.3277075015076936
Energy: 1.213107553687097
Energy: 1.327707501506618
Energy: 1.2787407539783129
Energy: 1.2586012707006498
Energy: 1.2787407539772373
Energy: 1.2586012707006498
Energy: 1.2787407539783129
Energy: 1.2586012707006498
Energy: 1.208268514073177
Energy: 1.196662880046452
Energy: 1.2082685140742528
Energy: 1.1966628800475279
Energy: 1.2082685140742528
Energy: 1.196662880046452
Energy: 1.2023106142124065
Energy: 1.218658376068069
Energy: 1.2023106142124065
Energy: 1.218658376068069
Energy: 1.2023106142124065
Energy: 1.218658376068069
Energy: 1.202898220454896
Energy: 1.254682594298847
Energy: 1.202898220454896
Energy: 1.254682594298847
Energy: 1.2028982204559713
Energy: 1.254682594298847
Energy: 1.2789682357958014
Energy: 1.2585422839876186
Energy: 1.2789682357958014
Energy: 1.2585422839876186
Energy: 1.2789682357947258
Energy: 1.2585422839876186
Energy: 1.213107553687097
Energy: 1.2182618696012297
Energy: 1.213107553687097
Energy: 1.2182618696012297
Energy: 1.2131075536881728
Energy: 1.2182618696023053
Energy: 1.2787407539772373
Energy: 1.2586012706984986
Energy: 1.2787407539772373
Energy: 1.2586012706984986
Energy: 1.2787407539761617
Energy: 1.2586012706984986

minimum gb energy = 1.196662880046452 eV
minimum distance =  2.27291064673746 Angstroms
sigma value = 9


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

Energy: 1.316477255481645
Energy: 1.2776638897094454
Energy: 1.316477255480767
Energy: 1.2776638897085673
Energy: 1.316477255481645
Energy: 1.277663889707689
Energy: 1.3205809889571072
Energy: 1.2950851332608428
Energy: 1.3205809889579854
Energy: 1.2950851332599647
Energy: 1.3205809889579854
Energy: 1.2950851332608428
Energy: 1.3134071455701235
Energy: 1.290370030332536
Energy: 1.3134071455701235
Energy: 1.290370030332536
Energy: 1.3733385328242198
Energy: 1.290370030332536
Energy: 1.2816280578403132
Energy: 1.3977418253410234
Energy: 1.281628057839435
Energy: 1.3977418253419016
Energy: 1.2816280578403132
Energy: 1.3977418253419016
Energy: 1.303317681872413
Energy: 1.3051866530755802
Energy: 1.3033176818732914
Energy: 1.3051866530755802
Energy: 1.303317681872413
Energy: 1.3051866530747023
Energy: 1.3100712357117494
Energy: 1.2964389610221914
Energy: 1.3100712357117494
Energy: 1.2964389610221914
Energy: 1.3100712357117494
Energy: 1.2964389610221914
Energy: 1.2752181138561185
Energy: 1.3315443064852026
Energy: 1.2752181138561185
Energy: 1.331544306484324
Energy: 1.2752181138561185
Energy: 1.3315443064852026
Energy: 1.2684959914575533
Energy: 1.3329281822702221
Energy: 1.2684959914584317
Energy: 1.3329281822702221
Energy: 1.2684959914575533
Energy: 1.332928182269344
Energy: 1.4204781395284458
Energy: 1.311991664993095
Energy: 1.4204781395284458
Energy: 1.311991664993095
Energy: 1.4204781395284458
Energy: 1.311991664993095
Energy: 1.2753863532184797
Energy: 1.2997712484058774
Energy: 1.2753863532193577
Energy: 1.2997712484058774
Energy: 1.2753863532184797
Energy: 1.2997712484058774
Energy: 1.278533257789776
Energy: 1.3207346108413418
Energy: 1.2785332577906543
Energy: 1.3207346108404636
Energy: 1.278533257789776
Energy: 1.3207346108404636
Energy: 1.380681289568754
Energy: 1.2877376723528342
Energy: 1.380681289568754
Energy: 1.2877376723528342
Energy: 1.380681289568754
Energy: 1.2877376723528342
Energy: 1.2844222188718384
Energy: 1.3714792106929776
Energy: 1.2844222188718384
Energy: 1.3714792106929776
Energy: 1.2844222188718384
Energy: 1.3714792106929776
Energy: 1.310964723338027
Energy: 1.3183949618866526
Energy: 1.310964723338027
Energy: 1.3183949618875306
Energy: 1.310964723338027
Energy: 1.3183949618866526
Energy: 1.3647367072277587
Energy: 1.2932622531730473
Energy: 1.3647367072277587
Energy: 1.2932622531730473
Energy: 1.364736707228637
Energy: 1.2932622531739255
Energy: 1.3173209921166653
Energy: 1.3188732346512901
Energy: 1.3173209921166653
Energy: 1.3188732346512901
Energy: 1.3173209921166653
Energy: 1.3188732346512901
Energy: 1.3217128510365472
Energy: 1.3169176673447633
Energy: 1.3217128510365472
Energy: 1.3169176673447633
Energy: 1.3217128510365472
Energy: 1.3169176673456413
Energy: 1.4454355755775345
Energy: 1.2901791893658183
Energy: 1.445435575578413
Energy: 1.2901791893658183
Energy: 1.445435575578413
Energy: 1.2901791893658183
Energy: 1.276461035810882
Energy: 1.319033148560366
Energy: 1.276461035810882
Energy: 1.3190331485612443
Energy: 1.276461035810882
Energy: 1.319033148560366
Energy: 1.2878045345124611
Energy: 1.2751032181056412
Energy: 1.2878045345124611
Energy: 1.2751032181047628
Energy: 1.2878045345124611
Energy: 1.2751032181056412
Energy: 1.385304182770154
Energy: 1.296930270497643
Energy: 1.385304182770154
Energy: 1.296930270497643
Energy: 1.385304182770154
Energy: 1.296930270497643

minimum gb energy = 1.2684959914575533 eV
minimum distance =  2.24419676362714 Angstroms
sigma value = 27


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

Energy: 1.2301283343313483
Energy: 1.2654172216432429
Energy: 1.2301283343313483
Energy: 1.265417221643983
Energy: 1.2301283343313483
Energy: 1.265417221643983
Energy: 1.205665901293312
Energy: 1.2387024267286788
Energy: 1.2056659012925717
Energy: 1.2387024267294189
Energy: 1.205665901293312
Energy: 1.2387024267286788
Energy: 1.3148863303028409
Energy: 1.2100924658320407
Energy: 1.3148863303028409
Energy: 1.210092465833521
Energy: 1.3148863303035812
Energy: 1.2100924658342613
Energy: 1.2407032794736845
Energy: 1.2459468067544928
Energy: 1.2407032794729442
Energy: 1.2459468067552328
Energy: 1.2407032794729442
Energy: 1.2459468067552328
Energy: 1.2390493543291798
Energy: 1.2335272942919628
Energy: 1.2390493543276995
Energy: 1.2335272942875213
Energy: 1.2390493543284395
Energy: 1.2335272942897422
Energy: 1.2671304209397898
Energy: 1.2344431803648241
Energy: 1.2671304209397898
Energy: 1.2344431803611227
Energy: 1.2671304209412704
Energy: 1.2344431803648241
Energy: 1.229876493083095
Energy: 1.2376816320245965
Energy: 1.229876493083095
Energy: 1.2376816320245965
Energy: 1.229876493083095
Energy: 1.2376816320245965
Energy: 1.307036268919207
Energy: 1.305092222257969
Energy: 1.307036268919207
Energy: 1.3050922222587094
Energy: 1.307036268919207
Energy: 1.3050922222587094
Energy: 1.2417334245150482
Energy: 1.2358884947930378
Energy: 1.2417334245143077
Energy: 1.2358884947930378
Energy: 1.2417334245150482
Energy: 1.2358884947930378
Energy: 1.240834949023349
Energy: 1.2372776612911702
Energy: 1.240834949023349
Energy: 1.2372776612919103
Energy: 1.2408349490240895
Energy: 1.2372776612919103
Energy: 1.2407302268302094
Energy: 1.2372897365984388
Energy: 1.2407302268302094
Energy: 1.2372897365984388
Energy: 1.2407302268294689
Energy: 1.2372897365976985
Energy: 1.2417746720704683
Energy: 1.2340240718223336
Energy: 1.2417746720697278
Energy: 1.2340240718215931
Energy: 1.2417746720697278
Energy: 1.2340240718215931
Energy: 1.3070457745969362
Energy: 1.3050877756047656
Energy: 1.3070457745969362
Energy: 1.305087775605506
Energy: 1.3070457745969362
Energy: 1.305087775605506
Energy: 1.2298522282282356
Energy: 1.2376163721343096
Energy: 1.2298522282289759
Energy: 1.2376163721343096
Energy: 1.2298522282282356
Energy: 1.2376163721350497
Energy: 1.2671556554141923
Energy: 1.234142262470474
Energy: 1.2671556554149326
Energy: 1.234142262470474
Energy: 1.2671556554141923
Energy: 1.234142262469734
Energy: 1.2390481764214352
Energy: 1.2371564604670218
Energy: 1.2390481764214352
Energy: 1.2371564604677623
Energy: 1.2390481764214352
Energy: 1.2371564604670218
Energy: 1.2407645342573812
Energy: 1.245922788438609
Energy: 1.2407645342581213
Energy: 1.2459227884393493
Energy: 1.2407645342603424
Energy: 1.2459227884393493
Energy: 1.3143018701423188
Energy: 1.2129747358421834
Energy: 1.3143018701423188
Energy: 1.2129747358421834
Energy: 1.314301870143059
Energy: 1.2129747358421834
Energy: 1.2056001322356709
Energy: 1.2387192712857125
Energy: 1.2056001322356709
Energy: 1.2387192712864525
Energy: 1.2056001322349306
Energy: 1.2387192712857125
Energy: 1.2301283343313483
Energy: 1.2654172216432429
Energy: 1.2301283343313483
Energy: 1.265417221643983
Energy: 1.2301283343320886
Energy: 1.265417221643983
Energy: 1.205665901293312
Energy: 1.2387024267286788
Energy: 1.2056659012925717
Energy: 1.2387024267286788
Energy: 1.205665901293312
Energy: 1.2387024267294189
Energy: 1.3148863303028409
Energy: 1.210092465833521
Energy: 1.3148863303028409
Energy: 1.2100924658320407
Energy: 1.3148863303035812
Energy: 1.210092465833521
Energy: 1.2407032794729442
Energy: 1.2459468067544928
Energy: 1.2407032794736845
Energy: 1.2459468067544928
Energy: 1.2407032794729442
Energy: 1.2459468067552328
Energy: 1.2390493543284395
Energy: 1.2335272942897422
Energy: 1.2390493543276995
Energy: 1.2335272942882616
Energy: 1.2390493543284395
Energy: 1.2335272942897422
Energy: 1.2671304209412704
Energy: 1.2344431803640838
Energy: 1.26713042094053
Energy: 1.2344431803626033
Energy: 1.2671304209412704
Energy: 1.2344431803655642

minimum gb energy = 1.2056001322349306 eV
minimum distance =  2.26907009250374 Angstroms
sigma value = 19


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

Energy: 1.2317450004818777
Energy: 1.297069836263419
Energy: 1.2317450004818777
Energy: 1.297069836264058
Energy: 1.2317450004818777
Energy: 1.297069836263419
Energy: 1.2604775024180583
Energy: 1.2225081581021273
Energy: 1.2604775024180583
Energy: 1.2225081581021273
Energy: 1.2604775024180583
Energy: 1.2225081581021273
Energy: 1.2902050598221413
Energy: 1.1731520952970333
Energy: 1.2902050598253363
Energy: 1.1731520952970333
Energy: 1.2902050598227803
Energy: 1.1731520952970333
Energy: 1.1908612760171018
Energy: 1.294530148323134
Energy: 1.1908612760171018
Energy: 1.294530148323134
Energy: 1.1908612760171018
Energy: 1.294530148323134
Energy: 1.2362832562376873
Energy: 1.251958515880814
Energy: 1.2362832562383261
Energy: 1.251958515880814
Energy: 1.2362832562376873
Energy: 1.251958515880175
Energy: 1.295468470962455
Energy: 1.1959051511112138
Energy: 1.295468470962455
Energy: 1.1959051511112138
Energy: 1.295468470962455
Energy: 1.1959051511112138
Energy: 1.1678902435432745
Energy: 1.2820719174479873
Energy: 1.1678902435432745
Energy: 1.2820719174479873
Energy: 1.1678902435432745
Energy: 1.2820719174479873
Energy: 1.217475116455767
Energy: 1.2618949169160596
Energy: 1.217475116455767
Energy: 1.2618949169166984
Energy: 1.217475116455767
Energy: 1.2618949169160596
Energy: 1.3531697529867825
Energy: 1.1692268606618383
Energy: 1.3531697529874216
Energy: 1.1692268606618383
Energy: 1.3531697529874216
Energy: 1.1692268606618383
Energy: 1.24600613276039
Energy: 1.236984369883952
Energy: 1.24600613276039
Energy: 1.236984369883952
Energy: 1.24600613276039
Energy: 1.236984369883313
Energy: 1.171853496687826
Energy: 1.3044172683740172
Energy: 1.171853496687826
Energy: 1.3044172683740172
Energy: 1.171853496687187
Energy: 1.3044172683740172
Energy: 1.2591916691626606
Energy: 1.1696317634942304
Energy: 1.2591916691626606
Energy: 1.1696317634935913
Energy: 1.2591916691626606
Energy: 1.1696317634942304
Energy: 1.174212991785688
Energy: 1.2041029946928394
Energy: 1.1742129917863269
Energy: 1.2041029946928394
Energy: 1.174212991785688
Energy: 1.2041029946928394
Energy: 1.191227781698914
Energy: 1.2958327318158112
Energy: 1.191227781698914
Energy: 1.2958327318158112
Energy: 1.191227781698914
Energy: 1.2958327318164502
Energy: 1.2668294864074894
Energy: 1.170902011060091
Energy: 1.2668294864074894
Energy: 1.170902011060091
Energy: 1.2668294864074894
Energy: 1.17090201106073
Energy: 1.2964300552067296
Energy: 1.1619877206882336
Energy: 1.2964300552067296
Energy: 1.1619877206882336
Energy: 1.2964300552067296
Energy: 1.1619877206882336
Energy: 1.1890927180009845
Energy: 1.2541698042217606
Energy: 1.1890927180009845
Energy: 1.2541698042223997
Energy: 1.1890927180009845
Energy: 1.2541698042223997
Energy: 1.2519076926440835
Energy: 1.2729460592364634
Energy: 1.2519076926447228
Energy: 1.2729460592364634
Energy: 1.2519076926440835
Energy: 1.2729460592364634
Energy: 1.2797707700312135
Energy: 1.1913696565093763
Energy: 1.2797707700312135
Energy: 1.1913696565093763
Energy: 1.2797707700312135
Energy: 1.1913696565093763
Energy: 1.187989059188761
Energy: 1.29802951515428
Energy: 1.187989059188761
Energy: 1.298029515154919
Energy: 1.187989059188761
Energy: 1.29802951515428
Energy: 1.1614327752518834
Energy: 1.3061033225551433
Energy: 1.1614327752525224
Energy: 1.3061033225551433
Energy: 1.1614327752525224
Energy: 1.3061033225557823
Energy: 1.359735594359462
Energy: 1.1716934555794514
Energy: 1.359735594359462
Energy: 1.1716934555794514
Energy: 1.359735594359462
Energy: 1.1716934555794514
Energy: 1.2284098826137382
Energy: 1.2107221564874524
Energy: 1.2284098826137382
Energy: 1.2107221564868134
Energy: 1.2284098826137382
Energy: 1.2107221564874524
Energy: 1.2272354931153375
Energy: 1.3028755272732626
Energy: 1.2272354931146985
Energy: 1.3028755272732626
Energy: 1.2272354931153375
Energy: 1.3028755272732626
Energy: 1.2788077396345108
Energy: 1.1725029091777606
Energy: 1.278807739633872
Energy: 1.1725029091777606
Energy: 1.278807739633872
Energy: 1.1725029091777606
Energy: 1.209462231656498
Energy: 1.1853933831202026
Energy: 1.209462231656498
Energy: 1.1853933831202026
Energy: 1.209462231656498
Energy: 1.1853933831208416
Energy: 1.161322466162168
Energy: 1.3033673374141757
Energy: 1.1613224661615291
Energy: 1.3033673374141757
Energy: 1.161322466162168
Energy: 1.3033673374141757
Energy: 1.2655222017419145
Energy: 1.191909741069099
Energy: 1.2655222017419145
Energy: 1.191909741069099
Energy: 1.2655222017419145
Energy: 1.191909741069099
Energy: 1.2902535771699173
Energy: 1.1928400915263573
Energy: 1.290253577170556
Energy: 1.1928400915263573
Energy: 1.290253577170556
Energy: 1.1928400915263573

minimum gb energy = 1.1613224661615291 eV
minimum distance =  2.24032959442644 Angstroms
sigma value = 101


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

Energy: 1.1594413299223894
Energy: 1.3062283445394132
Energy: 1.1594413299223894
Energy: 1.3062283445394132
Energy: 1.1594413299229511
Energy: 1.3062283445394132
Energy: 1.2137219951050824
Energy: 1.1894957787907243
Energy: 1.2137219951062057
Energy: 1.1894957787907243
Energy: 1.2137219951050824
Energy: 1.1916357480211317
Energy: 1.1981481494064912
Energy: 1.1231042252423387
Energy: 1.1981481494059292
Energy: 1.1231042252423387
Energy: 1.1981481494059292
Energy: 1.1231042252429007
Energy: 1.1041711416318
Energy: 1.2235784533060439
Energy: 1.1041711416312385
Energy: 1.2235784533082907
Energy: 1.1041711416318
Energy: 1.223578453303797
Energy: 1.1402613663939958
Energy: 1.1599642786558535
Energy: 1.1402613663939958
Energy: 1.1599642786558535
Energy: 1.1402613663934338
Energy: 1.1599642786558535
Energy: 1.22258745014163
Energy: 1.1227958156764524
Energy: 1.2225874501421918
Energy: 1.1227958156764524
Energy: 1.2225874501421918
Energy: 1.1227958156758908
Energy: 1.1583237764259093
Energy: 1.2049524350902865
Energy: 1.1583237764253473
Energy: 1.2049524350902865
Energy: 1.1583237764253473
Energy: 1.2049524350902865
Energy: 1.1126315927768962
Energy: 1.2066367395123883
Energy: 1.112631592777458
Energy: 1.2066367395112647
Energy: 1.1126315927768962
Energy: 1.2066367395107034
Energy: 1.223738836148202
Energy: 1.1251946870517469
Energy: 1.2237388361476402
Energy: 1.1251946870517469
Energy: 1.223738836148202
Energy: 1.1251946870517469
Energy: 1.1844684921810458
Energy: 1.1788444269569738
Energy: 1.1844684921810458
Energy: 1.1788444269586587
Energy: 1.1844684921810458
Energy: 1.1788444269592204
Energy: 1.1081417114794943
Energy: 1.3893731916907113
Energy: 1.1081417114789323
Energy: 1.3893731916907113
Energy: 1.1081417114789323
Energy: 1.3893731916907113
Energy: 1.2328500860372258
Energy: 1.1561163063248463
Energy: 1.2328500860394727
Energy: 1.1561163063254078
Energy: 1.2328500860383493
Energy: 1.1561163063254078
Energy: 1.256242743725432
Energy: 1.1223597221986137
Energy: 1.256242743725432
Energy: 1.1223597221986137
Energy: 1.2562427437259935
Energy: 1.1223597221991757
Energy: 1.159429866618642
Energy: 1.2818711311763897
Energy: 1.1594298666192038
Energy: 1.2818711311763897
Energy: 1.159429866617519
Energy: 1.2818711311763897
Energy: 1.2134143130821033
Energy: 1.1602448826124308
Energy: 1.2134143130809802
Energy: 1.1602448826124308
Energy: 1.2134143130821033
Energy: 1.1602448826124308
Energy: 1.1986489830599747
Energy: 1.1208719767318651
Energy: 1.1986489830594127
Energy: 1.1208719767324267
Energy: 1.1986489830599747
Energy: 1.1208719767324267
Energy: 1.1051602802293161
Energy: 1.2244245780818195
Energy: 1.1051602802293161
Energy: 1.224424578081258
Energy: 1.105160280229878
Energy: 1.2244245780818195
Energy: 1.1107178335950458
Energy: 1.1716336241728815
Energy: 1.1107178335950458
Energy: 1.1716336241728815
Energy: 1.1107178335950458
Energy: 1.1716336241728815
Energy: 1.2203479825129309
Energy: 1.1254796076531668
Energy: 1.2203479825173735
Energy: 1.1254796076531668
Energy: 1.2203479825140542
Energy: 1.1254796076531668
Energy: 1.1280794633679627
Energy: 1.208713337728721
Energy: 1.1280794633679627
Energy: 1.208713337728721
Energy: 1.1280794633674014
Energy: 1.208713337728721
Energy: 1.1084765559975907
Energy: 1.3916039928231154
Energy: 1.108476555998152
Energy: 1.3916039928225539
Energy: 1.1084765559975907
Energy: 1.3916039928214303
Energy: 1.2652783133486531
Energy: 1.1165062382247481
Energy: 1.2652783133486531
Energy: 1.11650623822531
Energy: 1.2652783133492147
Energy: 1.1165062382247481
Energy: 1.2748290876733268
Energy: 1.122479600098358
Energy: 1.2748290876727648
Energy: 1.1224796000977961
Energy: 1.2748290876716415
Energy: 1.122479600098358
Energy: 1.1042317655694422
Energy: 1.3012556355165392
Energy: 1.1042317655700038
Energy: 1.3012556355159774
Energy: 1.1042317655700038
Energy: 1.3012556355165392
Energy: 1.218444887808924
Energy: 1.1550786283389474
Energy: 1.2184448878094856
Energy: 1.1550786283383858
Energy: 1.2184448878078005
Energy: 1.1550786283389474
Energy: 1.2634174706021752
Energy: 1.120760123595369
Energy: 1.2634174706032983
Energy: 1.120760123595369
Energy: 1.2634174706021752
Energy: 1.120760123595369
Energy: 1.1595041669120345
Energy: 1.2622707720172
Energy: 1.1595041669109112
Energy: 1.2622707720172
Energy: 1.1595041669120345
Energy: 1.2622707720172
Energy: 1.1601418197671223
Energy: 1.1885223701236427
Energy: 1.1601418197671223
Energy: 1.1885223701236427
Energy: 1.160141819767684
Energy: 1.1885223701236427
Energy: 1.30189812836487
Energy: 1.1371947344489688
Energy: 1.30189812836487
Energy: 1.1371947344489688
Energy: 1.30189812836487
Energy: 1.1371947344489688
Energy: 1.1103866138525282
Energy: 1.2588282406802964
Energy: 1.1103866138525282
Energy: 1.2588282406808584
Energy: 1.1103866138525282
Energy: 1.2588282406802964
Energy: 1.106185577995713
Energy: 1.2520698977936986
Energy: 1.106185577995713
Energy: 1.2520698977936986
Energy: 1.1061855779962744
Energy: 1.2520698977936986
Energy: 1.2750422052345372
Energy: 1.1166646996048273
Energy: 1.2750422052345372
Energy: 1.1166646996048273
Energy: 1.2750422052345372
Energy: 1.1166646996048273
Energy: 1.269427431413963
Energy: 1.1231755051110872
Energy: 1.2694274314145246
Energy: 1.1231755051110872
Energy: 1.2694274314145246
Energy: 1.1231755051105257

minimum gb energy = 1.1041711416312385 eV
minimum distance =  2.25534904232543 Angstroms
sigma value = 33


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

Energy: 0.020849886661020667
Energy: 1.015649179256917
Energy: 0.020849886661020667
Energy: 1.0156491792564502
Energy: 0.020849886661020667
Energy: 1.015649179256917
Energy: 0.021629183378150472
Energy: 0.44276274909466545
Energy: 0.021629183378150472
Energy: 0.44276274909466545
Energy: 0.021629183378150472
Energy: 0.4427627490941988
Energy: 1.4640785294842726
Energy: 0.44368080860969766
Energy: 1.4640785294846876
Energy: 0.4436808086078827
Energy: 1.4640785294842726
Energy: 0.44368080860969766
Energy: 0.021629183379083886
Energy: 0.44276274909513225
Energy: 0.021629183379083886
Energy: 0.4427627490941988
Energy: 0.021629183379083886
Energy: 0.4427627490955989

minimum gb energy = 0.020849886661020667 eV
minimum distance =  2.48510358931509 Angstroms
sigma value = 1