Model name: model_name=EAM_Dynamo_FoilesBaskesDaw_1986Universal3_Cu__MO_666348409573_004
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.614999935030937
cohesive_energy=3.5402784116098815
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
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: 0.013691634565287818
Energy: 0.01459201119410233
Energy: 0.8077536022694141
Energy: 0.014592011193475113
Energy: 0.01459201119410233
Energy: 0.7894103465225042
Energy: 0.01459201119410233
Energy: 0.7894103465225042
Energy: 0.8077536022687869
Energy: 0.01459201119410233
Energy: 0.013691634565287818
Energy: 0.01459201119410233
Energy: 0.01459201119410233
Energy: 0.7894103465230966
Energy: 0.01459201119410233
Energy: 0.7894103465230966

minimum gb energy = 0.013691634565287818 eV
minimum distance =  2.46584189791903 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 0.9221524934409038
Energy: 0.9038079109899435
Energy: 0.8422555187395452
Energy: 0.9038079109899435
Energy: 0.8513241585936349
Energy: 0.8980261315823854
Energy: 0.8451313484837902
Energy: 0.8980261315793427
Energy: 0.8090588943003907
Energy: 0.8931381376467336
Energy: 0.8440239907669507
Energy: 0.8931381376467336
Energy: 0.8360884624717083
Energy: 0.9135905069375148
Energy: 0.8320815846245754
Energy: 0.9135905069420788
Energy: 0.8388705288042537
Energy: 0.9052041177534488
Energy: 0.8409722640730811
Energy: 0.9052041177534488
Energy: 0.8092658489268687
Energy: 0.8862298283827799
Energy: 0.810099461926359
Energy: 0.8862298283865834
Energy: 0.8543994464963763
Energy: 0.8930594313283158
Energy: 0.8102506120183077
Energy: 0.893059431329837
Energy: 0.7619276363283484
Energy: 0.9047953069940587
Energy: 0.8080681904393303
Energy: 0.9047953069948195
Energy: 0.8331805673680099
Energy: 0.8462976611172195
Energy: 0.8480899357446937
Energy: 0.8462976611187408
Energy: 0.8067618836962077
Energy: 0.8926316563908051
Energy: 0.755579237474651
Energy: 0.8926316563900444
Energy: 0.8402211292610628
Energy: 0.8917326646555737
Energy: 0.8332974064662597
Energy: 0.8917326646601377
Energy: 0.8349567674604487
Energy: 0.9048314215941478
Energy: 0.8161542231363754
Energy: 0.9048314215941478
Energy: 0.8433529252693738
Energy: 0.8927252751962872
Energy: 0.8544250445065291
Energy: 0.8927252751962872
Energy: 0.8486148571727141
Energy: 0.9001620755129291
Energy: 0.8264634756656627
Energy: 0.90016207551369
Energy: 0.8411890787355185
Energy: 0.9052365259101981
Energy: 0.8434793703754827
Energy: 0.9052365259086766
Energy: 0.8411692521816001
Energy: 0.9054127201552918
Energy: 0.8433572770234538
Energy: 0.9054127201552918
Energy: 0.8439246299136367
Energy: 0.8931772770967026
Energy: 0.7951045700035776
Energy: 0.8931772770959419
Energy: 0.8452213640560834
Energy: 0.8934484958713853
Energy: 0.851845846162575
Energy: 0.893448495872146
Energy: 0.8070705708280145
Energy: 0.9042709283502354
Energy: 0.815883660326352
Energy: 0.9042709283509961
Energy: 0.8450035614545152
Energy: 0.8462203612490103
Energy: 0.8356332976770467
Energy: 0.8462203612497708
Energy: 0.8080400722484053
Energy: 0.8929253852722551
Energy: 0.7810955504190856
Energy: 0.8929253852722551
Energy: 0.8323972607723499
Energy: 0.901461913541161
Energy: 0.841431303242871
Energy: 0.901461913541161
Energy: 0.840753668701874
Energy: 0.9052956655491616
Energy: 0.7998268144395139
Energy: 0.9052956655499224
Energy: 0.8280061624733255
Energy: 0.8942954464345475
Energy: 0.8090243393211675
Energy: 0.8942954464345475
Energy: 0.8103530767984142
Energy: 0.8856844452885811
Energy: 0.85410255512747
Energy: 0.8856844452885811
Energy: 0.841285264590711
Energy: 0.9050657717186545
Energy: 0.7992545944053884
Energy: 0.9050657717186545
Energy: 0.840417677056502
Energy: 0.8991244294507605
Energy: 0.8329821946735908
Energy: 0.8991244294515214
Energy: 0.7971140354331034
Energy: 0.8927467651103085
Energy: 0.8440113914808439
Energy: 0.8927467651095479
Energy: 0.8503675724196127
Energy: 0.903991672256326
Energy: 0.8401685385659149
Energy: 0.9039916722570868
Energy: 0.8573069419918474
Energy: 0.9040944276096513
Energy: 0.8381527725249924
Energy: 0.9040944276096513
Energy: 0.852037650700179
Energy: 0.8986639265269115
Energy: 0.8431876623197944
Energy: 0.8986639265261508
Energy: 0.830021551797521
Energy: 0.8934731893220951
Energy: 0.8490076285742462
Energy: 0.8934731893205737
Energy: 0.8388145762847131
Energy: 0.9129013282659273
Energy: 0.8331152583531864
Energy: 0.9129013282636452

minimum gb energy = 0.755579237474651 eV
minimum distance =  2.28164938911934 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 0.9889070658654031
Energy: 0.9671273855177122
Energy: 0.8799285036584574
Energy: 0.967127385516845
Energy: 0.8817360255427374
Energy: 0.9425722890152783
Energy: 0.8855405741535745
Energy: 0.9425722890170131
Energy: 0.8434940343654332
Energy: 0.9667052282680566
Energy: 0.8883294561298414
Energy: 0.9667052282706585
Energy: 0.8643632182634279
Energy: 0.9180501751441739
Energy: 0.8455114626836098
Energy: 0.9180501751493383
Energy: 0.8646690955684456
Energy: 0.9516045830974569
Energy: 0.8630849501789406
Energy: 0.9516045831017934
Energy: 0.8996518506321933
Energy: 0.9521917564764129
Energy: 0.8630738364235355
Energy: 0.9521917564772802
Energy: 0.8813993851515125
Energy: 0.9189834301417186
Energy: 0.8634773622858237
Energy: 0.9189834301417186
Energy: 0.7913182036698693
Energy: 0.9671668463083813
Energy: 0.8260085348167725
Energy: 0.9671668463127179
Energy: 0.8654438354498704
Energy: 0.9008641414749823
Energy: 0.8855905562846335
Energy: 0.9008641414715131
Energy: 0.8575593774934128
Energy: 0.9674704213536545
Energy: 0.8517597246381534
Energy: 0.9674704213562565
Energy: 0.8814486087956765
Energy: 0.9269456410860129
Energy: 0.8892460570039495
Energy: 0.9269456410868802
Energy: 0.8288758812528225
Energy: 0.9584475062738592
Energy: 0.8880920904635594
Energy: 0.958447506281665
Energy: 0.9014497794875748
Energy: 0.9500317186050197
Energy: 0.8727825900704813
Energy: 0.9500317186102235
Energy: 0.9011493862025158
Energy: 0.9500370794059223
Energy: 0.8901757237375433
Energy: 0.9500370793989839
Energy: 0.828744565204195
Energy: 0.9584150206043986
Energy: 0.8885063897556003
Energy: 0.9584150206104698
Energy: 0.8814832174394701
Energy: 0.9270261859360915
Energy: 0.8789132357029428
Energy: 0.9270261859291531
Energy: 0.8575572415646754
Energy: 0.9677926768687836
Energy: 0.8231927868190472
Energy: 0.967792676869651
Energy: 0.8654339473557463
Energy: 0.9007358330401847
Energy: 0.8858488130478148
Energy: 0.9007358330393173
Energy: 0.7913133022410639
Energy: 0.9674282042583369
Energy: 0.8435083032847058
Energy: 0.9674282042592042
Energy: 0.8814528403491051
Energy: 0.9188506435490938
Energy: 0.8501716652174539
Energy: 0.9188506435482264
Energy: 0.8995902040651459
Energy: 0.9522504716640942
Energy: 0.8712877074842448
Energy: 0.9522504716606248
Energy: 0.8646674078363252
Energy: 0.9514594315208583
Energy: 0.8777817288201568
Energy: 0.9514594315260623
Energy: 0.8643364049638336
Energy: 0.9183521219003821
Energy: 0.8787668690579897
Energy: 0.9183521219055859
Energy: 0.8436207116312358
Energy: 0.966624018708633
Energy: 0.8845358688583879
Energy: 0.9666240187060311
Energy: 0.8816446087484832
Energy: 0.9425472408231307
Energy: 0.8855424670842525
Energy: 0.9425472408213961
Energy: 0.9889070658645358
Energy: 0.9671273855177122
Energy: 0.9085009715561472
Energy: 0.967127385516845
Energy: 0.8817360255418701
Energy: 0.9425722890152783
Energy: 0.8855405741544419
Energy: 0.9425722890178803
Energy: 0.8434940343654332
Energy: 0.9667052282680566
Energy: 0.8849573789771871
Energy: 0.9667052282697912
Energy: 0.8643632182634279
Energy: 0.9180501751441739
Energy: 0.845511462684477
Energy: 0.9180501751493383

minimum gb energy = 0.7913133022410639 eV
minimum distance =  2.27028576181289 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 0.940347314761213
Energy: 1.0163823297044519
Energy: 0.9357895858040562
Energy: 1.0163823297054602
Energy: 0.8890526053294773
Energy: 0.9857908640899804
Energy: 0.9203815871109878
Energy: 0.9857908640899804
Energy: 0.894001947761255
Energy: 1.0430029305734023
Energy: 0.9198545662614129
Energy: 1.0430029305734023
Energy: 0.915326465227245
Energy: 0.9916004433291626
Energy: 0.8876015032106458
Energy: 0.9916004433271463
Energy: 0.8888722518087385
Energy: 1.0167576228956507
Energy: 0.8702192830365026
Energy: 1.0167576228936344
Energy: 0.9611693524600743
Energy: 1.0428429383484343
Energy: 0.8872496273717235
Energy: 1.0428429383484343
Energy: 0.9227696420646152
Energy: 0.9223420615696171
Energy: 0.9100196831542131
Energy: 0.9223420615686088
Energy: 0.9825872244957761
Energy: 1.0172079871402226
Energy: 0.8477071689485481
Energy: 1.0172079871402226
Energy: 0.910252367256712
Energy: 0.9807970180708103
Energy: 0.922865946817994
Energy: 0.9807970180687938
Energy: 0.9196072984721674
Energy: 1.0428994091617958
Energy: 0.878125592082718
Energy: 1.0428994091617958
Energy: 0.9016798910709277
Energy: 1.0163128811936446
Energy: 0.9192978553827311
Energy: 1.0163128811936446
Energy: 0.8884850476909414
Energy: 1.0163101470217228
Energy: 0.9194867527377815
Energy: 1.0163101470217228
Energy: 0.9197099684594733
Energy: 0.9926757386691415
Energy: 0.8793735880422574
Energy: 0.9926757386681333
Energy: 0.9104015582581615
Energy: 0.919851688250676
Energy: 0.9435182637579451
Energy: 0.919851688250676
Energy: 0.875697335751037
Energy: 1.0171246680185484
Energy: 0.8454252496057909
Energy: 1.0171246680195567
Energy: 0.9201310845856617
Energy: 0.9238856443473645
Energy: 0.8883667216358058
Energy: 0.9238856443483728
Energy: 0.8320256464758973
Energy: 1.043063427732672
Energy: 0.8316341952347358
Energy: 1.0430634277316637
Energy: 0.8877371981380501
Energy: 0.9875730155688344
Energy: 0.9332590487718082
Energy: 0.9875730155688344
Energy: 0.8997967231610579
Energy: 0.9911578431534297
Energy: 0.889154129431526
Energy: 0.9911578431534297
Energy: 0.8906658916629122
Energy: 1.0430624813366263
Energy: 0.9211377043505556
Energy: 1.043062481335618
Energy: 0.9295122007694336
Energy: 0.9766873588256147
Energy: 0.9245834906977832
Energy: 0.9766873588246066
Energy: 0.9399076408525558
Energy: 1.0166288457857495
Energy: 0.9517575477531823
Energy: 1.0166288457867576
Energy: 0.921146833161328
Energy: 0.9857112111603846
Energy: 0.9199394236991819
Energy: 0.9857112111603846
Energy: 0.8794905796895525
Energy: 1.0433667940427853
Energy: 0.9197106372002696
Energy: 1.0433667940437934
Energy: 0.9197626636474228
Energy: 0.937367849871887
Energy: 0.8871383419325237
Energy: 0.9373678498668458

minimum gb energy = 0.8316341952347358 eV
minimum distance =  2.27714059626456 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 1.0004908501006813
Energy: 0.9992695622845827
Energy: 1.0199092977335542
Energy: 0.999269562288191
Energy: 0.9543732073284878
Energy: 1.0528384050818467
Energy: 0.9798850032617872
Energy: 1.0528384050782384
Energy: 0.8824807820296248
Energy: 0.9973063114030232
Energy: 0.9676530545896339
Energy: 0.9973063114030232
Energy: 0.9900028482981228
Energy: 1.073825028466138
Energy: 0.9021550173881396
Energy: 1.0738250284637598
Energy: 1.0360924682642583
Energy: 1.0524593730601812
Energy: 0.9839126316011509
Energy: 1.0524593730601812
Energy: 0.8731934414092459
Energy: 0.9919771104491976
Energy: 0.9026686694055088
Energy: 0.9919771104479947
Energy: 0.9875866535623297
Energy: 0.9023631032878136
Energy: 0.9034946647473417
Energy: 0.902363103285408
Energy: 0.9577209159244041
Energy: 0.9921099775273454
Energy: 0.8950368312054945
Energy: 0.99210997752494
Energy: 0.986811853746309
Energy: 1.0527202131319529
Energy: 0.9829874925881784
Energy: 1.0527202131295474
Energy: 0.9942188808677827
Energy: 0.9993023498457689
Energy: 0.9024693064215424
Energy: 0.9993023498493772
Energy: 0.929707944621749
Energy: 1.053555694027835
Energy: 0.9367343099529384
Energy: 1.0535556940266324
Energy: 0.9897161645875269
Energy: 1.014073258245718
Energy: 0.9023127812999991
Energy: 1.0140732582433123
Energy: 0.8733212758584804
Energy: 0.9994626255830716
Energy: 0.9569585269221113
Energy: 0.9994626255830716
Energy: 0.9478485041694239
Energy: 0.9918495014071314
Energy: 0.9797809114489974
Energy: 0.9918495014059285
Energy: 0.8733234599391434
Energy: 0.9997669289360901
Energy: 0.9576363969863457
Energy: 0.9997669289372927
Energy: 0.9896878371382447
Energy: 1.014082113181427
Energy: 0.9021448142050609
Energy: 1.0140821131826299
Energy: 0.9297103777509196
Energy: 1.053544385277836
Energy: 0.9866413012654537
Energy: 1.053544385277836
Energy: 0.9942139049251526
Energy: 0.9993410243434578
Energy: 0.9024585603364909
Energy: 0.9993410243446605
Energy: 0.9868685876886005
Energy: 1.0526797121767084
Energy: 0.9828964938709159
Energy: 1.0526797121767084
Energy: 0.9582135937700029
Energy: 0.9921478649771585
Energy: 0.8950666605413851
Energy: 0.9921478649795641
Energy: 0.9859573279943358
Energy: 0.9024210272085709
Energy: 0.9034995893450468
Energy: 0.9024210272073682

minimum gb energy = 0.8731934414092459 eV
minimum distance =  2.35740004079609 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 0.943285770865649
Energy: 1.021357188695682
Energy: 1.0780279346812762
Energy: 1.0213571886912196
Energy: 0.928319502133611
Energy: 1.067616740754581
Energy: 0.9168501755874595
Energy: 1.0676167407560684
Energy: 0.9176263739075001
Energy: 1.005223970953541
Energy: 0.9166046281005209
Energy: 1.005223970953541
Energy: 0.9439534805713964
Energy: 0.9307570993010573
Energy: 1.0343114920174559
Energy: 0.9307570993025448
Energy: 1.0327299619053445
Energy: 0.9285404731299617
Energy: 0.9675097826287805
Energy: 0.9285404731284741
Energy: 0.9208940899880715
Energy: 1.0686351892744743
Energy: 0.9198019208753547
Energy: 1.0686351892744743
Energy: 0.9172596930862197
Energy: 1.06203548524757
Energy: 0.917134452214395
Energy: 1.0620354852460827
Energy: 1.0321868628436335
Energy: 0.9179468833944868
Energy: 0.9418830936046718
Energy: 0.9179468833959742
Energy: 0.916749750966796
Energy: 1.063770764616942
Energy: 0.9303562684902795
Energy: 1.0637707646154544
Energy: 1.0689300585818406
Energy: 1.0048242689845372
Energy: 0.9204527742520221
Energy: 1.0048242689845372
Energy: 0.9757642274635182
Energy: 1.0622551507901883
Energy: 1.1368368959730026
Energy: 1.0622551507872133
Energy: 0.9171454220168902
Energy: 0.9527526468924797
Energy: 1.066685408434754
Energy: 0.9527526468909923
Energy: 1.0224248730700538
Energy: 1.0054837600827677
Energy: 0.9169874756687814
Energy: 1.00548376008723
Energy: 0.9167582591709376
Energy: 0.930325488750502
Energy: 0.9418185980756175
Energy: 0.9303254887490148
Energy: 0.916641175403911
Energy: 1.0525653681494114
Energy: 1.0242360338788818
Energy: 1.0525653681494114
Energy: 0.9281994924165876
Energy: 0.983474966844635
Energy: 0.9207197402100131
Energy: 0.9834749668476098
Energy: 0.9171511884060173
Energy: 0.9996291289188376
Energy: 1.0671092776449254
Energy: 0.9996291289188376

minimum gb energy = 0.9166046281005209 eV
minimum distance =  2.33864587112369 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 1.0498082081180546
Energy: 1.0482565257926044
Energy: 1.1471147827839885
Energy: 1.0482565257900773
Energy: 1.0566236942466405
Energy: 1.0087696539507929
Energy: 0.9456134330518281
Energy: 1.0087696539474236
Energy: 1.049545709303587
Energy: 1.0457280886873663
Energy: 0.9453949918104907
Energy: 1.045728088686524
Energy: 0.9476621017805559
Energy: 1.0476263683442473
Energy: 1.0146817633017968
Energy: 1.0476263683484595
Energy: 1.078824949450078
Energy: 1.0160592807180269
Energy: 0.9677725867379426
Energy: 1.0160592807180269
Energy: 0.9572899982263077
Energy: 0.9801340409282525
Energy: 1.0486013130455911
Energy: 0.9801340409274101
Energy: 0.9500212828889376
Energy: 1.053510370225069
Energy: 0.9458319872453643
Energy: 1.053510370222542
Energy: 1.042150621797702
Energy: 1.046126168523382
Energy: 0.954270756983641
Energy: 1.0461261685259091
Energy: 0.9600810998773333
Energy: 1.0923908568679899
Energy: 1.0823300162618053
Energy: 1.0923908568663052
Energy: 1.1430199923356585
Energy: 1.0183857846979205
Energy: 0.9458923768317385
Energy: 1.0183857846962356
Energy: 0.9501569709045248
Energy: 0.9563465242640729
Energy: 1.0521727073141798
Energy: 0.9563465242623881
Energy: 0.9549453960379995
Energy: 1.049932741851211
Energy: 0.9547868428548794
Energy: 1.049932741853738
Energy: 1.0684988042658419
Energy: 0.9564598917639017
Energy: 1.0443297330877102
Energy: 0.9564598917622167
Energy: 0.945455743829474
Energy: 1.0434862065141466
Energy: 1.059040881637842
Energy: 1.0434862065158315
Energy: 1.0269721489088592
Energy: 1.0547996254903647
Energy: 0.9582686938169074
Energy: 1.0547996254920493
Energy: 1.0558922390948087
Energy: 1.0467935173413532
Energy: 1.042329779210924
Energy: 1.0467935173421956
Energy: 0.9460624335117612
Energy: 1.0377508079395739
Energy: 1.1529417428213105
Energy: 1.0377508079412203
Energy: 1.049102845697154
Energy: 1.043202364144979
Energy: 0.957331523711099
Energy: 1.043202364144979
Energy: 0.9458299812674059
Energy: 1.0586135486357182
Energy: 1.0102772856456963
Energy: 1.0586135486365607
Energy: 0.9458047217615346
Energy: 1.0470082029158254
Energy: 0.9481003238926561
Energy: 1.0470082029166676
Energy: 0.995233447453569
Energy: 1.0450531033083597
Energy: 1.0495022382471464
Energy: 1.045053103306675
Energy: 0.9460930871279509
Energy: 1.1058990622944882
Energy: 1.1454868632350355
Energy: 1.1058990622961729
Energy: 1.0691409423885805
Energy: 1.049000362456404
Energy: 0.9457753522093272
Energy: 1.0490003624580886
Energy: 0.9542995588705564
Energy: 1.0529749864324214
Energy: 1.049906865844864
Energy: 1.0529749864341063
Energy: 0.9541417548856422
Energy: 1.0451426185155128
Energy: 1.0638459146036037
Energy: 1.0451426185171977
Energy: 1.0737648931886827
Energy: 1.0485956629688227
Energy: 0.9469558753298503
Energy: 1.0485956629654531
Energy: 0.9674685644074166
Energy: 1.0847916139105795
Energy: 1.171080465010102
Energy: 1.084791613911422
Energy: 1.0487060641865737
Energy: 0.9863711823600029
Energy: 1.0498011712766073
Energy: 0.9863711823583181
Energy: 1.1211182621978701
Energy: 1.0672414471887743
Energy: 0.9500235830842781
Energy: 1.0672414471887743
Energy: 0.9545054397025068
Energy: 1.0917202996899134
Energy: 1.0496767552219877
Energy: 1.0917202996899134

minimum gb energy = 0.9453949918104907 eV
minimum distance =  2.25494408625729 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 0.911433037787115
Energy: 0.9101787931261237
Energy: 1.1344667887750919
Energy: 0.9101787931261237
Energy: 1.0813817212913042
Energy: 0.9861193691603753
Energy: 1.060632838065058
Energy: 0.9861193691603753
Energy: 0.9120175732019378
Energy: 0.9099671031730334
Energy: 1.0609916340659349
Energy: 0.909967103171094
Energy: 0.912030060861786
Energy: 0.9100184357909056
Energy: 1.0049963799766866
Energy: 0.910018435792845
Energy: 1.0814665845273068
Energy: 0.9860358684577653
Energy: 1.0267646089517775
Energy: 0.9860358684597046
Energy: 0.911433037787115
Energy: 0.9101787931261237
Energy: 1.135632877741628
Energy: 0.9101787931280632
Energy: 1.0813817212913042
Energy: 0.9861193691603753
Energy: 1.060632838065058
Energy: 0.9861193691603753
Energy: 0.9120175732019378
Energy: 0.9099671031730334
Energy: 1.0609916340659349
Energy: 0.909967103171094
Energy: 0.912030060861786
Energy: 0.910018435792845
Energy: 1.0607038441117689
Energy: 0.910018435792845
Energy: 1.0814665845273068
Energy: 0.9860358684597046
Energy: 1.063907180059845
Energy: 0.9860358684616439
Energy: 0.911433037787115
Energy: 0.9101787931261237
Energy: 1.1830577540249487
Energy: 0.9101787931261237
Energy: 1.0813817212913042
Energy: 0.9861193691603753
Energy: 1.060632838065058
Energy: 0.9861193691603753
Energy: 0.9120175732019378
Energy: 0.9099671031730334
Energy: 1.0609916340659349
Energy: 0.909967103171094

minimum gb energy = 0.909967103171094 eV
minimum distance =  2.31964983139744 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 1.0012364914760443
Energy: 1.1378148604220948
Energy: 1.2126180466180487
Energy: 1.1378148604192235
Energy: 1.107605470513645
Energy: 1.0388188636721138
Energy: 0.9996550754433813
Energy: 1.0388188636713962
Energy: 0.9784560717539487
Energy: 0.990266309688228
Energy: 0.9959678905164595
Energy: 0.9902663096889457
Energy: 1.0745433877746609
Energy: 1.1521594862616131
Energy: 0.998964294322647
Energy: 1.1521594862587416
Energy: 1.1011881977172973
Energy: 1.0430974389763565
Energy: 0.9947476156767439
Energy: 1.0430974389785097
Energy: 0.9911225180621301
Energy: 0.989481343085804
Energy: 1.0790136547353515
Energy: 0.9894813430865219
Energy: 1.2490662595802922
Energy: 1.039376050254119
Energy: 0.9960316847985482
Energy: 1.0393760502526834
Energy: 0.9847411061948953
Energy: 1.1564404639025796
Energy: 1.086915611923499
Energy: 1.1564404639076042
Energy: 0.9806394903499319
Energy: 1.1573544536360927
Energy: 0.9985542155579837
Energy: 1.1573544536339395
Energy: 0.9799931627751775
Energy: 1.0351557427370428
Energy: 0.9891445770998701
Energy: 1.0351557427377605
Energy: 0.9862618693522752
Energy: 1.1448971979438822
Energy: 1.22572192456616
Energy: 1.1448971979417288
Energy: 1.1004522373892696
Energy: 1.1195518652214713
Energy: 0.9840998567311815
Energy: 1.119551865222189
Energy: 0.9806401906565939
Energy: 1.063625125880265
Energy: 1.164880292290492
Energy: 1.063625125880265
Energy: 1.0777868492926261
Energy: 1.087504443910964
Energy: 1.0058047648526491
Energy: 1.0875044439023833
Energy: 0.9871830990249058
Energy: 1.1081015536769552
Energy: 1.0855202191714952
Energy: 1.1081015536769552
Energy: 0.9842684038319703
Energy: 1.1798927851655663
Energy: 1.0759167849053035
Energy: 1.1798927851648484
Energy: 1.04091597374352
Energy: 1.107902801475876
Energy: 0.9873175875195292
Energy: 1.107902801475876
Energy: 0.9893401135693244
Energy: 1.0393968981297734
Energy: 1.0997342915697275
Energy: 1.0393968981297734
Energy: 1.1030455099566483
Energy: 1.065185508796013
Energy: 0.9925250354050571
Energy: 1.0651855087974484
Energy: 0.9841903260916713
Energy: 1.0456373628700788
Energy: 1.0520592161615554
Energy: 1.04563736286649
Energy: 1.0817211597687129
Energy: 1.1443282318225543
Energy: 1.075884252439607
Energy: 1.144328231823272
Energy: 1.0583544541631866
Energy: 1.0919152652877417
Energy: 0.979727031816379
Energy: 1.091915265286306
Energy: 0.9985895327307326
Energy: 1.114562804152052
Energy: 0.9806266624954968
Energy: 1.114562804151334
Energy: 1.2507333635796214
Energy: 1.0467990249532266
Energy: 0.9842813883070793
Energy: 1.0467990249539445
Energy: 0.997015597134382
Energy: 1.1323693355323303
Energy: 1.1849766140620366
Energy: 1.1323693355344837
Energy: 1.0345656364853635
Energy: 0.990028710811243
Energy: 0.9792102575975031
Energy: 0.9900287108141141
Energy: 1.0895145801091326
Energy: 1.111442128471326
Energy: 1.0740846606021184
Energy: 1.1114421284720442
Energy: 1.0112556695966224
Energy: 1.1484056402105127
Energy: 1.074650474804963
Energy: 1.1484056402141014
Energy: 1.036152763089011
Energy: 0.9897787514536327
Energy: 0.9783400863421392
Energy: 0.9897787514543505
Energy: 0.9991937301351215
Energy: 1.1311283058957184
Energy: 1.183998283409555
Energy: 1.1311283058950008
Energy: 1.1855777676460535
Energy: 1.0583436655694167
Energy: 0.9834806689052855
Energy: 1.0583436655708522
Energy: 1.0001939286333486
Energy: 1.0411818299130333
Energy: 0.9792177209343453
Energy: 1.0411818299137512
Energy: 0.9988742534692188
Energy: 1.091255216983157
Energy: 0.9787688622471075
Energy: 1.0912552169824392
Energy: 1.0807668686904375
Energy: 1.1470173639312509
Energy: 1.0740528945075352
Energy: 1.147017363933404
Energy: 0.994755726475102
Energy: 1.135176215297997
Energy: 1.249154212459007
Energy: 1.1351762153001506

minimum gb energy = 0.9783400863421392 eV
minimum distance =  2.28166463541402 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 0.996408260098844
Energy: 0.9942186155597917
Energy: 1.2371443062406253
Energy: 0.9942186155586529
Energy: 1.0055426697598446
Energy: 1.078798667762628
Energy: 1.0009853775846445
Energy: 1.078798667762628
Energy: 0.9893989950996434
Energy: 0.9936601986250924
Energy: 0.9894380022094008
Energy: 0.9936601986262312
Energy: 0.9776075939064439
Energy: 1.079595033425807
Energy: 0.9997515725312619
Energy: 1.0795950334246682
Energy: 0.9766729426313694
Energy: 1.0650213388526988
Energy: 0.9895580884989156
Energy: 1.06502133885156
Energy: 0.9919204934550306
Energy: 0.9941205684858769
Energy: 1.192650584378311
Energy: 0.9941205684881547
Energy: 1.2394406413630608
Energy: 1.1907262278167758
Energy: 0.9949369358098641
Energy: 1.1907262278167758
Energy: 0.9775052289675048
Energy: 0.9944708284523016
Energy: 1.2058985863316487
Energy: 0.9944708284545792
Energy: 1.1941815804692977
Energy: 0.9958969503920159
Energy: 0.9997261255232431
Energy: 0.9958969503931546
Energy: 0.9911688108253874
Energy: 1.0556544368680465
Energy: 0.9916936547223552
Energy: 1.0556544368680465
Energy: 0.9821377743016204
Energy: 0.9960095297655028
Energy: 1.19343582684003
Energy: 0.9960095297655028
Energy: 1.1066643997314143
Energy: 1.076150087759749
Energy: 0.9778813142546828
Energy: 1.07615008775861
Energy: 0.9952078350770137
Energy: 1.0606696218072502
Energy: 1.111367531479131
Energy: 1.0606696218061116
Energy: 1.235578886332338
Energy: 1.0614834056774662
Energy: 0.9917071809465142
Energy: 1.061483405678605
Energy: 0.9895948292224391
Energy: 1.0253256124185606
Energy: 1.1058901699707424
Energy: 1.0253256124185606
Energy: 1.194181830508896
Energy: 0.9947927367891998
Energy: 0.977764612660992
Energy: 0.9947927367880609
Energy: 0.995297070191336
Energy: 0.9967211101326989
Energy: 0.990015304552354
Energy: 0.9967211101338378
Energy: 1.0010791282691611
Energy: 0.9977794535545655
Energy: 0.9904814700748399
Energy: 0.9977794535523137
Energy: 0.9918946755766034
Energy: 0.9941422140532431
Energy: 0.9756879119137468
Energy: 0.9941422140521042
Energy: 1.0001484330554649
Energy: 1.0247530556122415
Energy: 1.2384659899536425
Energy: 1.0247530556122415
Energy: 1.2458557042400251
Energy: 0.9935232282003386
Energy: 0.9898813853515446
Energy: 0.9935232282003386
Energy: 0.9992907472385861
Energy: 1.0669680333055394
Energy: 1.1104682399692487
Energy: 1.0669680333044005

minimum gb energy = 0.9756879119137468 eV
minimum distance =  2.28281987207984 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 1.021396211961697
Energy: 1.0196276719353023
Energy: 1.242396605464321
Energy: 1.0196276719304707
Energy: 1.2135042222986687
Energy: 1.0619639875614881
Energy: 1.0016413251298004
Energy: 1.0619639875486038
Energy: 0.9911458130473669
Energy: 1.019652781077374
Energy: 1.015889549771635
Energy: 1.0196527810741527
Energy: 1.009988740254081
Energy: 1.080123496936212
Energy: 1.001639447565897
Energy: 1.0801234969378224
Energy: 0.9916905233894323
Energy: 1.060771211219847
Energy: 1.0120342709384127
Energy: 1.060771211219847
Energy: 0.9909642903694763
Energy: 1.0207944207334307
Energy: 1.1796639359866297
Energy: 1.0207944207382622
Energy: 1.112588906644858
Energy: 1.1041188849967347
Energy: 1.0072912019732325
Energy: 1.1041188849959296
Energy: 0.9907495233827788
Energy: 1.0201647520313784
Energy: 1.2078555247903615
Energy: 1.02016475203621
Energy: 1.1217782843823858
Energy: 1.068502531237251
Energy: 1.0008387680749824
Energy: 1.0685025312316139
Energy: 0.9918053351052228
Energy: 1.0813747735188766
Energy: 1.097649703872153
Energy: 1.0813747735196817
Energy: 1.0152537150693208
Energy: 1.1561947038598945
Energy: 1.012814914091985
Energy: 1.1561947038631157
Energy: 1.0257865570491747
Energy: 1.0610459798169316
Energy: 1.0116452032855878
Energy: 1.061045979812905
Energy: 1.0250423445943608
Energy: 1.0223943750670799
Energy: 1.0132318292459381
Energy: 1.0223943750558426
Energy: 1.0149492994246225
Energy: 1.0138226288832273
Energy: 1.010628579670992
Energy: 1.0138226288904746
Energy: 0.9917785355455809
Energy: 1.1579844997780848
Energy: 1.1167957431013429
Energy: 1.1579844997764743
Energy: 1.2595132298511587
Energy: 1.0132237175352554
Energy: 1.0006490196699938
Energy: 1.013223717524787
Energy: 0.9916681360662388
Energy: 1.0618768714534408
Energy: 1.0453768844087115
Energy: 1.0618768714550513
Energy: 1.007984078788911
Energy: 1.1466493824972324
Energy: 1.0113228242898025
Energy: 1.146649382491595
Energy: 0.9919245469217655
Energy: 1.021402721836651
Energy: 1.0130085908467579
Energy: 1.0214027218334298
Energy: 0.9920644056561924
Energy: 1.0612478008476602
Energy: 1.0119500121617115
Energy: 1.0612478008524922
Energy: 1.015171780544844
Energy: 1.1570105338719217
Energy: 1.0008771718208656
Energy: 1.1570105338743373
Energy: 0.9912221095830793
Energy: 1.019722842844855
Energy: 1.0994350798379076
Energy: 1.0197228428335814
Energy: 1.1956194210090205
Energy: 1.0683971772510075
Energy: 1.0072498941384371
Energy: 1.068397177246176
Energy: 1.0223559319930138
Energy: 1.0207222559200666
Energy: 1.1790233196452264
Energy: 1.0207222559168454
Energy: 1.0222963600067196
Energy: 1.0616865274909153
Energy: 1.0078482309532544
Energy: 1.0616865274925258
Energy: 1.010103144679829
Energy: 1.0199730891241001
Energy: 1.016060416849939
Energy: 1.0199730891289318
Energy: 0.9915009348230994
Energy: 1.0809988473747898
Energy: 1.0080079760835856
Energy: 1.0809988473739844
Energy: 1.0099961151983252
Energy: 1.0615060971021484
Energy: 1.0013981521660902
Energy: 1.06150609710698
Energy: 0.990015193081915
Energy: 1.0201446910780962
Energy: 1.0912308316345372
Energy: 1.0201446910861491
Energy: 1.0212092933092196
Energy: 1.0162004789779406
Energy: 1.00203318430963
Energy: 1.0162004789714985
Energy: 0.9900583459949525
Energy: 1.020223284025557
Energy: 1.1618337253379607
Energy: 1.020223284025557

minimum gb energy = 0.990015193081915 eV
minimum distance =  2.26932644606284 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 0.9816468095970421
Energy: 0.9629558113613103
Energy: 1.2616432284988122
Energy: 0.9629558113621517
Energy: 0.9490484047670648
Energy: 0.9828018777644836
Energy: 0.9646907092453493
Energy: 0.982801877761741
Energy: 0.9780225666963634
Energy: 1.037286862580151
Energy: 1.0651626762985669
Energy: 1.0372868625809923
Energy: 0.9828435503559264
Energy: 0.9490117680713144
Energy: 0.9647949692480423
Energy: 0.9490117680734959
Energy: 0.9820482676330345
Energy: 1.0104814735680316
Energy: 1.073556739687306
Energy: 1.0104814735674705
Energy: 0.964185336702239
Energy: 1.0315954902805526
Energy: 0.9639913901133272
Energy: 1.031595490280802
Energy: 0.9522898815651905
Energy: 1.0104900598086421
Energy: 0.9820229368791468
Energy: 1.010490059807832
Energy: 0.9640534929532877
Energy: 0.9487740165036781
Energy: 0.9826512480573741
Energy: 0.9487740165047689
Energy: 1.065105354763755
Energy: 1.0308149716603003
Energy: 0.9780148685343217
Energy: 1.0308149716603003

minimum gb energy = 0.9487740165036781 eV
minimum distance =  2.31285056979632 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 0.9551726707093294
Energy: 0.951324758981537
Energy: 1.0944785047075736
Energy: 0.9513247589830583
Energy: 1.07379609164277
Energy: 0.9979996371921626
Energy: 0.9050960288763232
Energy: 0.9979996371974874
Energy: 0.9144289449626168
Energy: 0.9469959120327025
Energy: 1.0834590568316738
Energy: 0.9469959120243351
Energy: 0.9154851192655581
Energy: 0.9898193212358088
Energy: 0.9332313738913756
Energy: 0.9898193212495009
Energy: 0.9235444817166688
Energy: 0.9957585021450509
Energy: 1.099064973085066
Energy: 0.9957585021511365
Energy: 0.9373065349356207
Energy: 0.9584908020090476
Energy: 0.9196917585353519
Energy: 0.9584908020082868
Energy: 0.9275730879433138
Energy: 1.0027804008688408
Energy: 0.9252279288032353
Energy: 1.0027804008703622
Energy: 0.9243416681005464
Energy: 0.9602745379405405
Energy: 0.9142442257190375
Energy: 0.9602745379435831
Energy: 0.9413919393225482
Energy: 0.9933874879571315
Energy: 0.9243156444852669
Energy: 0.9933874879601744
Energy: 0.9375040459926185
Energy: 0.9917989030751164
Energy: 0.9160848361465873
Energy: 0.9917989030705522
Energy: 0.9067173792050991
Energy: 0.9594370108236735
Energy: 0.9105381048248862
Energy: 0.9594370108229127
Energy: 0.9126066295626928
Energy: 1.0975589662886116
Energy: 1.0647070871701576
Energy: 1.0975589662886116
Energy: 0.9472768149842185
Energy: 0.9566761719462812
Energy: 0.9593341856171416
Energy: 0.9566761719508452
Energy: 0.9241023171201384
Energy: 0.9567708077670534
Energy: 0.9464772821406013
Energy: 0.9567708077632499
Energy: 1.172452418182021
Energy: 0.9918651225388981
Energy: 0.9103372019937672
Energy: 0.9918651225411801
Energy: 0.9342746471512253
Energy: 0.9398069539616819
Energy: 1.0822829535014464
Energy: 0.9398069539738527
Energy: 1.0676240079868917
Energy: 0.997800989367016
Energy: 0.9049586272055616
Energy: 0.997800989367016
Energy: 0.9293786861564126
Energy: 0.9567252808672656
Energy: 0.9979802665648639
Energy: 0.9567252808703083
Energy: 0.928442924267787
Energy: 1.0036023095705389
Energy: 0.9215389661556637
Energy: 1.0036023095712998
Energy: 0.9122804554815109
Energy: 0.9902417208688604
Energy: 0.9570346408242995
Energy: 0.9902417208688604
Energy: 0.9025382499444983
Energy: 0.9578100603280503
Energy: 0.9351438633025337
Energy: 0.9578100603242468
Energy: 0.9277111536915736
Energy: 0.9937027042503177
Energy: 0.9299878937236685
Energy: 0.9937027042556424
Energy: 0.9086993939510958
Energy: 0.9584510340518554
Energy: 0.9038933347283342
Energy: 0.9584510340602229
Energy: 1.048926479062438
Energy: 0.9567371956714452
Energy: 0.9124313563757
Energy: 0.9567371956737271
Energy: 1.0454082242271758
Energy: 0.9412716650643493
Energy: 0.9059880366215254
Energy: 0.9412716650635887
Energy: 0.9458959566641771
Energy: 0.9575184963819947
Energy: 0.9237080903671007
Energy: 0.9575184963797126
Energy: 0.9110704950937863
Energy: 0.9830277492779964
Energy: 0.993095416868589
Energy: 0.9830277492734323
Energy: 0.9425851695040269
Energy: 0.9961536769702196
Energy: 0.933268104862138
Energy: 0.9961536769656555
Energy: 0.9126208040428896
Energy: 0.9967686252106582
Energy: 1.00117798433041
Energy: 0.9967686252121796
Energy: 1.095945673480425
Energy: 0.9564070501097026
Energy: 0.9282239309283747
Energy: 0.9564070501127454
Energy: 0.9142085839335898
Energy: 0.9443240911731903
Energy: 1.0073237388654377
Energy: 0.9443240911640624
Energy: 1.1079449700411976
Energy: 0.9718715834612626
Energy: 0.9124215628048181
Energy: 0.9718715834574593
Energy: 0.9323773867423772
Energy: 0.9592326876652747
Energy: 0.9043376752081407
Energy: 0.9592326876629926

minimum gb energy = 0.9025382499444983 eV
minimum distance =  2.27575215322031 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 0.9134075048516116
Energy: 0.911939876158234
Energy: 0.9096331577399259
Energy: 0.9119398761571822
Energy: 0.9080108856427992
Energy: 0.924541136943945
Energy: 0.8692726279485784
Energy: 0.9245411369449968
Energy: 0.856463240387424
Energy: 0.9122834468512627
Energy: 1.2013434605641653
Energy: 0.912283446854418
Energy: 0.8816934213004101
Energy: 0.96058653380159
Energy: 0.8688454975842358
Energy: 0.9605865338026179
Energy: 0.8558796918717919
Energy: 0.9975836764394608
Energy: 1.059459440530065
Energy: 0.9975836764373573
Energy: 0.8552847065421402
Energy: 0.915883077369575
Energy: 0.8692620101240363
Energy: 0.9158830773716786
Energy: 0.8559288261984825
Energy: 0.9970408870582375
Energy: 0.8853355598933099
Energy: 0.9970408870603411
Energy: 0.8561493214006959
Energy: 0.9156993238211675
Energy: 0.921265738021235
Energy: 0.9156993238243227
Energy: 0.9113686937261147
Energy: 0.907813753366271
Energy: 0.8838923900066745
Energy: 0.9078137533673228
Energy: 0.9113878443722503
Energy: 0.9078564960702832
Energy: 0.9206762648983379
Energy: 0.9078564960692315
Energy: 0.856394206523441
Energy: 0.9157334373512147
Energy: 0.8864449647585397
Energy: 0.9157334373522665
Energy: 0.8559246908107855
Energy: 0.9969739724978424
Energy: 0.9104686289891207
Energy: 0.9969739724967907
Energy: 0.8554573800760595
Energy: 0.9158851843151562
Energy: 0.8691162468439158
Energy: 0.9158851843151562
Energy: 0.8558917787561322
Energy: 0.997525907581361
Energy: 1.093248566095425
Energy: 0.9975259075824128
Energy: 0.8817603678317883
Energy: 0.9635846111008664
Energy: 0.8686602824696781
Energy: 0.9635846110966594
Energy: 0.8562935510009757
Energy: 0.9123073906919258
Energy: 0.9373191538414352
Energy: 0.912307390690874
Energy: 0.9080632969493317
Energy: 0.924654040773152
Energy: 0.8692194138845548
Energy: 0.9246540407668414
Energy: 0.9134075048526634
Energy: 0.911939876158234
Energy: 0.9096331577020863
Energy: 0.9119398761571822
Energy: 0.9080108856417475
Energy: 0.924541136943945
Energy: 0.8692726279475266
Energy: 0.924541136943945
Energy: 0.856463240387424
Energy: 0.9122834468512627
Energy: 1.201343460565217
Energy: 0.9122834468533663
Energy: 0.8816934213035654
Energy: 0.9605865338026179
Energy: 0.8688454975842358
Energy: 0.9605865338036695
Energy: 0.8558796918717919
Energy: 0.9975836764394608
Energy: 1.0594594405311166
Energy: 0.9975836764363055
Energy: 0.8552847065410885
Energy: 0.9158830773685233
Energy: 0.8692620101240363
Energy: 0.9158830773706268
Energy: 0.8559288261984825
Energy: 0.9970408870582375
Energy: 0.8853355598943616
Energy: 0.9970408870603411

minimum gb energy = 0.8552847065410885 eV
minimum distance =  2.29363742609602 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 0.900199991544351
Energy: 0.8986149285676415
Energy: 1.0602457749656864
Energy: 0.8986149285689415
Energy: 1.0008285675586435
Energy: 0.8860785358048671
Energy: 0.859512536975935
Energy: 0.8860785358055172
Energy: 0.8639008311444347
Energy: 0.8876809827898777
Energy: 1.0865124562336481
Energy: 0.8876809827892277
Energy: 0.8951723551421887
Energy: 0.8577793148832995
Energy: 0.8587651377323481
Energy: 0.85777931488785
Energy: 0.8564160189341812
Energy: 0.9541384399851419
Energy: 0.8862658614460239
Energy: 0.954138439985792
Energy: 0.8519910787559737
Energy: 0.8768084729026634
Energy: 0.8729309061791806
Energy: 0.8768084729033134
Energy: 0.8676419420644348
Energy: 0.9385642298399699
Energy: 0.8979729635987438
Energy: 0.9385642298380196
Energy: 0.8534786757592067
Energy: 0.9298803548102812
Energy: 0.8517447796302371
Energy: 0.9298803548128814
Energy: 0.900893603914976
Energy: 0.9234988723747976
Energy: 0.898318116039744
Energy: 0.9234988723760977
Energy: 0.8983596700092943
Energy: 0.9262696269065612
Energy: 0.8669222647430419
Energy: 0.9262696269065612
Energy: 0.8636675163719354
Energy: 0.9082526724994823
Energy: 0.8518495533828557
Energy: 0.9082526725007825
Energy: 0.8668739433805005
Energy: 0.9314345186856265
Energy: 0.8591786823527549
Energy: 0.9314345186869267
Energy: 0.8500610572600275
Energy: 0.918163903342911
Energy: 0.859244191533431
Energy: 0.918163903342911
Energy: 0.8568038311924442
Energy: 0.9530361489718404
Energy: 0.9159533787551138
Energy: 0.9530361489711904
Energy: 0.8523397947957144
Energy: 0.8671105209284347
Energy: 0.9064731010411969
Energy: 0.867110520932335
Energy: 0.8637731179578588
Energy: 0.888678741009114
Energy: 1.019763532019435
Energy: 0.8886787410078137
Energy: 0.8702530576054791
Energy: 0.8691865367638312
Energy: 0.8590240843037266
Energy: 0.8691865367657813
Energy: 0.8594352550261082
Energy: 0.8994163382518546
Energy: 0.8672595658377019
Energy: 0.8994163382499043
Energy: 0.9916932535972925
Energy: 0.9331441302845989
Energy: 0.8658834235933245
Energy: 0.9331441302871992
Energy: 0.8727615716683891
Energy: 0.8873990087380319
Energy: 0.897080502589768
Energy: 0.8873990087386819
Energy: 0.8633675552937575
Energy: 0.878626297583434
Energy: 0.8598283190285247
Energy: 0.8786262975827841
Energy: 0.8598775667623018
Energy: 0.8999671483845814
Energy: 1.0157914639257815
Energy: 0.8999671483865316
Energy: 0.8833337582124066
Energy: 0.869626410813816
Energy: 0.8739389357762647
Energy: 0.8696264108131659
Energy: 0.8641779673100066
Energy: 0.9400007975839435
Energy: 1.016673321595252
Energy: 0.9400007975845937
Energy: 0.8818298140479923
Energy: 0.9000718610281472
Energy: 0.8595862971011692
Energy: 0.9000718610287973
Energy: 0.8589613733457918
Energy: 0.9549213431729925
Energy: 0.8707826624733414
Energy: 0.9549213431716923
Energy: 1.0121026336672037
Energy: 0.9187400431596325
Energy: 0.8651157166823115
Energy: 0.9187400431609327
Energy: 0.9097855196321385
Energy: 1.037267558851533
Energy: 0.8518281337674851
Energy: 1.037267558852183
Energy: 0.913194656312149
Energy: 0.9525095653893947
Energy: 0.858107771821791
Energy: 0.9525095653887445
Energy: 0.8590364078184253
Energy: 0.9175298575618644
Energy: 0.8825726166672657
Energy: 0.9175298575605644
Energy: 0.8624327684857144
Energy: 0.9528729394122907
Energy: 0.8717346401560477
Energy: 0.9528729394135909
Energy: 0.8512334236579436
Energy: 0.903846649548722
Energy: 0.8612894352035081
Energy: 0.9038466495461218
Energy: 0.8647889997433647
Energy: 0.9262000876498787
Energy: 1.03709858916646
Energy: 0.9262000876498787
Energy: 0.897459162810056
Energy: 1.0532661601346995
Energy: 0.8745797327798966
Energy: 1.0532661601320992
Energy: 0.8571984281547459
Energy: 0.900196017054135
Energy: 0.889711562596765
Energy: 0.9001960170528348
Energy: 0.9064862458335622
Energy: 0.9396582400581575
Energy: 0.8658064466434678
Energy: 0.9396582400594574
Energy: 0.873900866736612
Energy: 0.8709379973911612
Energy: 0.8523674890104093
Energy: 0.8709379973866107
Energy: 0.8686426715278933
Energy: 0.9550562561384841
Energy: 0.860494659223039
Energy: 0.9550562561404344

minimum gb energy = 0.8500610572600275 eV
minimum distance =  2.28410669078608 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 0.9880488981278923
Energy: 0.8157997123149496
Energy: 0.975130358850195
Energy: 0.8157997123149496
Energy: 0.9641225563384023
Energy: 0.8162368720476915
Energy: 0.8091445725142091
Energy: 0.8162368720493923
Energy: 0.82188232828698
Energy: 0.9355116694528659
Energy: 1.1570586384790944
Energy: 0.9355116694528659
Energy: 0.8311349551525137
Energy: 0.850338498794243
Energy: 0.8216513621521994
Energy: 0.850338498794243
Energy: 0.7929512497968756
Energy: 0.8706232254014051
Energy: 0.9500544391181251
Energy: 0.8706232254048071
Energy: 0.7941588729831827
Energy: 0.7932191847494048
Energy: 0.7961980245689283
Energy: 0.7932191847477037
Energy: 0.8104765302403371
Energy: 0.9355443161628709
Energy: 0.801891616780376
Energy: 0.9355443161645719
Energy: 0.7987387473206808
Energy: 0.9352555033714455
Energy: 0.8217371792753653
Energy: 0.9352555033731463
Energy: 0.8170924653635759
Energy: 0.8705972371169742
Energy: 0.9374349425270936
Energy: 0.8705972371169742
Energy: 0.8506424743177939
Energy: 0.8672015811685543
Energy: 0.7948750798784089
Energy: 0.8672015811685543
Energy: 0.9882218593250612
Energy: 0.8205264353251208
Energy: 0.7930730180415846
Energy: 0.8205264353251208
Energy: 0.9701540239586218
Energy: 0.9369583480427705
Energy: 0.7994904324446631
Energy: 0.9369583480444713
Energy: 0.8176046191136926
Energy: 0.7949151035903088
Energy: 0.7945046777730845
Energy: 0.7949151035886078
Energy: 0.8216143920763441
Energy: 0.8685865897227928
Energy: 0.818427691739774
Energy: 0.8685865897227928
Energy: 0.7861381684038075
Energy: 0.7948594581574995
Energy: 0.8181046790761567
Energy: 0.7948594581574995

minimum gb energy = 0.7861381684038075 eV
minimum distance =  2.308194224651 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 0.7827244217555279
Energy: 0.7513429990125461
Energy: 0.9563962664728535
Energy: 0.751342998992584
Energy: 0.9048757708026848
Energy: 0.7707824509807646
Energy: 0.7457260052702458
Energy: 0.7707824509714967
Energy: 0.7530386132552859
Energy: 0.7517377194862119
Energy: 1.1145074957336754
Energy: 0.7517377194790827
Energy: 0.7577835250912683
Energy: 0.7708521711498237
Energy: 0.7415697296861403
Energy: 0.7708521711434074
Energy: 0.7615432017366026
Energy: 0.8107082553557219
Energy: 0.758203731806363
Energy: 0.8107082553664157
Energy: 0.7487902822424186
Energy: 0.7716411256757314
Energy: 0.7637662062353806
Energy: 0.7716411256636119
Energy: 0.7614603480765105
Energy: 0.8124404015151839
Energy: 0.7700017739440491
Energy: 0.8124404015123322
Energy: 0.7341320640415104
Energy: 0.7710172298896595
Energy: 0.7638860747924117
Energy: 0.7710172298853819
Energy: 0.7614468524032005
Energy: 0.812207667081456
Energy: 0.9574928640465986
Energy: 0.812207667089298
Energy: 0.9026585491132448
Energy: 0.8277912158123024
Energy: 0.7418064070452746
Energy: 0.8277912158144413
Energy: 0.7615081340199683
Energy: 0.8292868648254492
Energy: 0.7428823424396407
Energy: 0.8292868648432721
Energy: 0.7784854202187113
Energy: 0.8278977599328369
Energy: 0.7410958049201701
Energy: 0.8278977599364015
Energy: 0.7905065165194227
Energy: 0.7666122478555218
Energy: 0.7450629199683748
Energy: 0.7666122478590863
Energy: 1.0192865852112851
Energy: 0.8282370634012433
Energy: 0.7416525138679475
Energy: 0.8282370633998174
Energy: 0.7610443344004941
Energy: 0.7520084593178213
Energy: 0.7451266880870739
Energy: 0.7520084593327926
Energy: 0.7688572736372749
Energy: 0.8285561611474093
Energy: 0.7448732658830012
Energy: 0.8285561611431317
Energy: 0.7627857494786385
Energy: 0.8105001970405676
Energy: 0.745524125153489
Energy: 0.8105001970448451
Energy: 0.7651859917524602
Energy: 0.8097244793127517
Energy: 0.7717085359563322
Energy: 0.8097244793056225
Energy: 0.7627604558258281
Energy: 0.7683152851598319
Energy: 0.7716731915865503
Energy: 0.7683152851584062
Energy: 0.7626581182089965
Energy: 0.7673210298649065
Energy: 0.7716973263597724
Energy: 0.7673210298841553
Energy: 0.7651986425540834
Energy: 0.8097559261992628
Energy: 0.7715846601292279
Energy: 0.8097559262099566
Energy: 0.7627901362906921
Energy: 0.8101920272395211
Energy: 0.7452864652295897
Energy: 0.8101920272487891
Energy: 0.7744931481852041
Energy: 0.8284932442496109
Energy: 0.7451537350310727
Energy: 0.828493244248898
Energy: 0.7610089507960489
Energy: 0.7520206625657883
Energy: 0.7459019098331882
Energy: 0.7520206625729177
Energy: 1.019526936729729
Energy: 0.8283917333109035
Energy: 0.7416124619333249
Energy: 0.8283917333101907
Energy: 0.7905804701550061
Energy: 0.7669762946575848
Energy: 0.7443590926145863
Energy: 0.7669762946525944
Energy: 0.7784816667122738
Energy: 0.8277939184964062
Energy: 0.7410136865715418
Energy: 0.8277939184935544
Energy: 0.7614554150669615
Energy: 0.8290879970816898
Energy: 0.7438548610289262
Energy: 0.8290879970816898
Energy: 0.9025951099273946
Energy: 0.827808487582329
Energy: 0.7418081146435082
Energy: 0.8278084875816161
Energy: 0.7614785596556487
Energy: 0.8121755188227581
Energy: 0.8851604214891376
Energy: 0.8121755188248968
Energy: 0.7340623510990776
Energy: 0.7711431978494373
Energy: 0.7639086073274786
Energy: 0.7711431978515761
Energy: 0.7614431401095894
Energy: 0.8123036645097985
Energy: 1.0205735061981296
Energy: 0.8123036645097985
Energy: 0.7485771700963136
Energy: 0.7715498253732443
Energy: 0.7638849418972571
Energy: 0.771549825367541
Energy: 0.7613498428555429
Energy: 0.8106922039346083
Energy: 1.027552801415904
Energy: 0.8106922039267661
Energy: 0.7584716618834915
Energy: 0.7709259249082036
Energy: 0.7416203708632867
Energy: 0.7709259249146199

minimum gb energy = 0.7340623510990776 eV
minimum distance =  2.32207815044686 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 0.7163423895600486
Energy: 0.7153410843615805
Energy: 0.6864620621106664
Energy: 0.715341084360354
Energy: 0.7043485561930851
Energy: 0.7151880998706968
Energy: 0.6791893823366681
Energy: 0.7151880998706968
Energy: 0.6928973934439028
Energy: 0.8100735932987186
Energy: 1.1834376487314415
Energy: 0.8100735932987186
Energy: 0.6742948034049464
Energy: 0.7151837521048267
Energy: 0.6793794842327211
Energy: 0.7151837521060532
Energy: 0.6785626029659448
Energy: 0.7148589873551364
Energy: 0.675496117386237
Energy: 0.7148589873551364
Energy: 0.6678703809008881
Energy: 0.7153189084221524
Energy: 0.6759893845401231
Energy: 0.715318908423379
Energy: 0.7005100897150094
Energy: 0.7497682189644639
Energy: 0.9187884500715074
Energy: 0.7497682189620108
Energy: 0.6745328764199724
Energy: 0.715909762132633
Energy: 0.7183073386242171
Energy: 0.7159097621314064
Energy: 0.6785488828361418
Energy: 0.7150683304121539
Energy: 0.9248206225976602
Energy: 0.7150683304133805
Energy: 0.9702332537340758
Energy: 0.7994828205323736
Energy: 0.6760815117082467
Energy: 0.7994828205323736
Energy: 0.7004454154331952
Energy: 0.7492646732619801
Energy: 0.6768620092055807
Energy: 0.7492646732632067
Energy: 0.9673957057592938
Energy: 0.7154001581053603
Energy: 0.6797179492949356
Energy: 0.7154001581078134
Energy: 0.678450103585656
Energy: 0.7151006257123458
Energy: 0.6729022526474827
Energy: 0.7151006257123458
Energy: 0.9177920159020405
Energy: 0.7493484509083502
Energy: 0.6744754295450393
Energy: 0.7493484509083502
Energy: 0.7149260736819326
Energy: 0.74994675585263
Energy: 0.6764743112165493
Energy: 0.74994675585263
Energy: 0.7152371238483085
Energy: 0.7155045880831529
Energy: 0.6795671866210121
Energy: 0.7155045880831529
Energy: 0.6786504012119816
Energy: 0.8003625327731675
Energy: 0.6680949057011973
Energy: 0.8003625327743941
Energy: 0.6898841168937997
Energy: 0.8307645809985843
Energy: 0.674457501165853
Energy: 0.8307645809998109
Energy: 0.6801998431769242
Energy: 0.7168796112778111
Energy: 0.6743728159420357
Energy: 0.7168796112765844
Energy: 0.674383976400322
Energy: 0.7158969911224655
Energy: 0.6734461489633945
Energy: 0.715896991121239

minimum gb energy = 0.6678703809008881 eV
minimum distance =  2.32775096121135 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 0.6554956501450544
Energy: 0.6178139837175194
Energy: 0.6022889545708244
Energy: 0.6178139837156038
Energy: 0.8149163104763515
Energy: 0.6340134781617174
Energy: 0.6210147238248696
Energy: 0.6340134781607596
Energy: 0.616088801841759
Energy: 0.6157809176996222
Energy: 0.8467710201385121
Energy: 0.6157809176996222
Energy: 0.6174492384750501
Energy: 0.6343799067282713
Energy: 0.6209835870713788
Energy: 0.6343799067914848
Energy: 0.6202699923986105
Energy: 0.6341860919914948
Energy: 0.5986652670307984
Energy: 0.6341860919914948
Energy: 0.5946100467754005
Energy: 0.6346116821918485
Energy: 0.6209070250327785
Energy: 0.6346116821889751
Energy: 0.620744474441819
Energy: 0.6158587283860679
Energy: 0.6182819017024611
Energy: 0.6158587283860679
Energy: 0.5910065813669537
Energy: 0.6551770561706872
Energy: 0.617183667224984
Energy: 0.6551770561726027
Energy: 0.620227649305872
Energy: 0.6342846919770436
Energy: 0.8148328447369388
Energy: 0.6342846919760858
Energy: 0.5947797532018222
Energy: 0.6178282370903057
Energy: 0.6567365164330501
Energy: 0.6178282370874324
Energy: 0.6206800667388064
Energy: 0.6158297814537138
Energy: 0.9960742423163076
Energy: 0.6158297814537138
Energy: 0.841738540657237
Energy: 0.8772181064803302
Energy: 0.6172548358632473
Energy: 0.8772181064832035
Energy: 0.6201736460715688
Energy: 0.6341028787888255
Energy: 0.7955099511476935
Energy: 0.6341028787897833
Energy: 0.8441627811721906
Energy: 0.6158828140406214
Energy: 0.6214641439742189
Energy: 0.6158828140396637
Energy: 0.6206690238669206
Energy: 0.6157903118366378
Energy: 0.5944411211453149
Energy: 0.6157903118385533
Energy: 0.8255311105807708
Energy: 0.7261250469518854
Energy: 0.6229690810084555
Energy: 0.7261250469499699
Energy: 0.6204087797595988
Energy: 0.6547188249266532
Energy: 0.5937823295286537
Energy: 0.654718824927611
Energy: 0.8229422174872183
Energy: 0.6338522736178824
Energy: 0.6212119276742347
Energy: 0.6338522736188402
Energy: 0.6594959712469499
Energy: 0.6156881758899233
Energy: 0.603844826825486
Energy: 0.6156881758889655
Energy: 0.9924307861108387
Energy: 0.7240800497529427
Energy: 0.6235683927140082
Energy: 0.7240800497491116
Energy: 0.6204159648441311
Energy: 0.7213544549707854
Energy: 0.5911731636325323
Energy: 0.7213544549650388
Energy: 0.6167923782838695
Energy: 0.634268188290796
Energy: 0.6207881891928435
Energy: 0.6342681882917537
Energy: 0.6210149743961616
Energy: 0.616252393624729
Energy: 0.8405566487540076
Energy: 0.6162523936237712
Energy: 0.5994333304936248
Energy: 0.7243109400579766
Energy: 0.6237295578091152
Energy: 0.7243109400589344
Energy: 0.619203127710014
Energy: 0.7230083169510454
Energy: 0.8300634223223706
Energy: 0.7230083169510454
Energy: 0.5946111487364033
Energy: 0.6551595532772271
Energy: 0.621270434306143
Energy: 0.6551595532772271

minimum gb energy = 0.5910065813669537 eV
minimum distance =  2.33202784925538 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 0.8779354211623869
Energy: 0.5724175218273714
Energy: 0.9363549152883381
Energy: 0.5724175218250157
Energy: 0.8855626201250966
Energy: 0.559277313951705
Energy: 0.5514480022802808
Energy: 0.5592773139501346
Energy: 0.5715158258386858
Energy: 0.5492741564120871
Energy: 0.5404666584927063
Energy: 0.549274156408161
Energy: 0.7200181783326375
Energy: 0.5597970790918495
Energy: 0.5514710544477734
Energy: 0.5597970790910644
Energy: 0.5481744190479205
Energy: 0.5874870077218994
Energy: 0.5412999917366874
Energy: 0.5874870077179734
Energy: 0.5550399175410766
Energy: 0.5600643469436507
Energy: 0.5513118676798787
Energy: 0.5600643469444359
Energy: 0.5507103413070491
Energy: 0.5593694489722428
Energy: 0.5555779025191467
Energy: 0.5593694489730281
Energy: 0.5361622336785254
Energy: 0.572436927919542
Energy: 0.5488382041371712
Energy: 0.5724369279242534
Energy: 0.5531487646423001
Energy: 0.572397758696873
Energy: 0.7982232710797273
Energy: 0.572397758759655
Energy: 0.5342915366648672
Energy: 0.5495883862939852
Energy: 0.572381049047865
Energy: 0.5495883862955556
Energy: 0.550749443130263
Energy: 0.5594349784977558
Energy: 1.008696413025186
Energy: 0.5594349784977558
Energy: 0.5361845353756265
Energy: 0.5727449703826478
Energy: 0.8778305245153248
Energy: 0.5727449703826478
Energy: 0.5532812470956127
Energy: 0.5745206034365063
Energy: 1.0716477584475634
Energy: 0.5745206034372917
Energy: 0.745481044457981
Energy: 0.629037967995642
Energy: 0.5722290801501125
Energy: 0.6290379679979977
Energy: 0.5507601152336954
Energy: 0.5593712795011216
Energy: 0.874521926243198
Energy: 0.5593712795011216
Energy: 0.7507126856177104
Energy: 0.5736220966198414
Energy: 0.548835853018817
Energy: 0.5736220966167006
Energy: 0.553196029753741
Energy: 0.5725488519698533
Energy: 0.792085751875157
Energy: 0.5725488519714237
Energy: 0.7386822752035798
Energy: 0.6288223015250061
Energy: 0.5513170014111632
Energy: 0.6288223015312879
Energy: 0.5508004369500806
Energy: 0.5721300434638767
Energy: 0.5461691818860258
Energy: 0.5721300434654472
Energy: 0.7438296750308224
Energy: 0.5729749569847791
Energy: 0.5562316809060781
Energy: 0.5729749569855642
Energy: 0.5741797109089934
Energy: 0.572542297830549
Energy: 0.5438781585822312
Energy: 0.5725422978321194
Energy: 1.0066174566590127
Energy: 0.5871748771598845
Energy: 0.5513762066853549
Energy: 0.5871748771575288
Energy: 0.8784215368590867
Energy: 0.571482756690884
Energy: 0.5455943873697384
Energy: 0.5714827566924545
Energy: 0.8921017621786953
Energy: 0.5727810891048163
Energy: 0.556097110470387
Energy: 0.5727810891032457
Energy: 0.5741637787480585
Energy: 0.6296053232846383
Energy: 0.5347277293944678
Energy: 0.6296053232846383
Energy: 0.8741010439775758
Energy: 0.5863889217156418
Energy: 0.5514642202953521
Energy: 0.5863889217156418
Energy: 0.5505868522401495
Energy: 0.5723808269042449
Energy: 0.7481840754786799
Energy: 0.5723808269026743
Energy: 0.5573209777328154
Energy: 0.5720197663157658
Energy: 0.555964478029251
Energy: 0.5720197663118397
Energy: 0.5534178667463973
Energy: 0.6298268065362582
Energy: 0.7349215346214374
Energy: 0.6298268065370435
Energy: 0.5464104075929892
Energy: 0.6042785167218129
Energy: 0.5536743590617418
Energy: 0.6042785167218129
Energy: 0.5552867154906834
Energy: 0.5727031844842729
Energy: 0.7479113679644284
Energy: 0.5727031844827026
Energy: 0.5360532065383983
Energy: 0.5721615103460506
Energy: 0.577357488001005
Energy: 0.5721615103452654

minimum gb energy = 0.5342915366648672 eV
minimum distance =  2.32055580004084 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 0.7907484624693998
Energy: 0.5172484527639772
Energy: 0.8377060411571813
Energy: 0.5172484527593207
Energy: 0.9073537542852499
Energy: 0.5143607547611692
Energy: 0.5155131674756855
Energy: 0.5143607547618344
Energy: 0.534444659585568
Energy: 0.5141665015763878
Energy: 1.001865951041108
Energy: 0.5141665015770529
Energy: 0.7917992986725031
Energy: 0.5155684006919696
Energy: 0.5155767617701754
Energy: 0.5155684006846526
Energy: 0.5135095065434205
Energy: 0.5194811395737251
Energy: 0.49650333291103077
Energy: 0.5194811394766674
Energy: 0.7876508846870036
Energy: 0.5145311916225386
Energy: 0.5153673645592174
Energy: 0.5145311914423316
Energy: 0.5151183006539263
Energy: 0.5251638659592027
Energy: 0.5097084193738368
Energy: 0.5251638659538811
Energy: 0.6471883815007898
Energy: 0.5243138497356145
Energy: 0.5155942342843557
Energy: 0.5243138497302929
Energy: 0.5166706015259305
Energy: 0.5257096825878622
Energy: 0.718395366878249
Energy: 0.5257096825838711
Energy: 0.5074547443877693
Energy: 0.5142719422862146
Energy: 0.5139719299811069
Energy: 0.5142719422842191
Energy: 0.5150526796375764
Energy: 0.5151700049846254
Energy: 0.7917044509038788
Energy: 0.5151700049055278
Energy: 0.506905548423216
Energy: 0.5143308502015637
Energy: 0.5347145787984288
Energy: 0.5143308502015637
Energy: 0.5168028317678309
Energy: 0.5258578821377989
Energy: 1.0146136431033874
Energy: 0.5258578821371338
Energy: 0.5055450719128345
Energy: 0.5171027674108177
Energy: 0.790815232317758
Energy: 0.5171027674028353
Energy: 0.5151088566145168
Energy: 0.5145151451324417
Energy: 1.0169356839551063
Energy: 0.5145151451304462
Energy: 0.6689776889461247
Energy: 0.5141595515375078
Energy: 0.5348148892682263
Energy: 0.5141595515414384
Energy: 0.5168971423371609
Energy: 0.5248095542709955
Energy: 0.9563958451879466
Energy: 0.524809554276317
Energy: 0.6699088900444572
Energy: 0.708159589125865
Energy: 0.5138787688768078
Energy: 0.7081595891225388
Energy: 0.5150433520550771
Energy: 0.5138360311658497
Energy: 0.7847275337331903
Energy: 0.5138360311651846
Energy: 0.6718245489969161
Energy: 0.5150449315823397
Energy: 0.515466618254854
Energy: 0.5150449315630491
Energy: 0.5168240600734474
Energy: 0.534646880004608
Energy: 0.6449282994577864
Energy: 0.5346468799819915
Energy: 0.6749858420832976
Energy: 0.5243872334735729
Energy: 0.5188453835385769
Energy: 0.5243872334749032
Energy: 0.5150473804820719
Energy: 0.5138075060901723
Energy: 0.5039034557883592
Energy: 0.5138075060901723
Energy: 0.9346595481636985
Energy: 0.5151482060679428
Energy: 0.5155306220197189
Energy: 0.5151482060659471
Energy: 0.5362755404575804
Energy: 0.5344463385589239
Energy: 0.5050788463855057
Energy: 0.5344463385555979
Energy: 0.9126627938869818
Energy: 0.5238814038188193
Energy: 0.5188562433593568
Energy: 0.5238814038268017
Energy: 0.7914653272955874
Energy: 0.5140845958934108
Energy: 0.504055818476325
Energy: 0.5140845958927457
Energy: 1.0145149072804474
Energy: 0.5158485074295904
Energy: 0.515556235520135
Energy: 0.5158485074269296
Energy: 0.5359705727647717
Energy: 0.5828562487725105
Energy: 0.5030188846422109
Energy: 0.5828562487691844
Energy: 0.7961833253510373
Energy: 0.524612061169535
Energy: 0.518628166085019
Energy: 0.5246120611702001
Energy: 0.5150204071328545
Energy: 0.7071183985087826
Energy: 0.6763063744957393
Energy: 0.7071183985081174
Energy: 0.7820622976608258
Energy: 0.5135972028541494
Energy: 0.5156126675281623
Energy: 0.5135972028521538
Energy: 0.5168570218017963
Energy: 0.588191743190468
Energy: 0.6677219476100033
Energy: 0.5881917431784944
Energy: 0.5125328568086179
Energy: 0.5343766263564901
Energy: 0.5188585190909702
Energy: 0.5343766263551597
Energy: 0.5103711909972155
Energy: 0.5620678429826379
Energy: 0.671624349455284
Energy: 0.5620678429733857
Energy: 0.5012136715163736
Energy: 0.5134181676847963
Energy: 0.5170017702047338
Energy: 0.5134181676867918
Energy: 0.5168119522211712
Energy: 0.5875836625075023
Energy: 0.9321572888090773
Energy: 0.5875836625041763

minimum gb energy = 0.49650333291103077 eV
minimum distance =  2.3231804702965 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 0.7378912933444262
Energy: 0.5009914030033036
Energy: 0.5271084936750365
Energy: 0.5009914030050343
Energy: 0.9221496471781478
Energy: 0.4981160758612368
Energy: 0.4712839471660658
Energy: 0.4981160758583522
Energy: 0.7097560833175509
Energy: 0.49788480420681536
Energy: 0.43715174727272427
Energy: 0.4978848042045339
Energy: 0.8198999379622464
Energy: 0.4981564683563948
Energy: 0.47119676850599856
Energy: 0.49815646835466415
Energy: 0.4973966864367831
Energy: 0.46979114496197644
Energy: 0.4388799393586356
Energy: 0.4697911449613995
Energy: 0.7919877791600689
Energy: 0.49846643070492197
Energy: 0.4713306658372776
Energy: 0.49846643070838353
Energy: 0.46897860790193685
Energy: 0.5143695775925557
Energy: 0.4666319580931089
Energy: 0.5143695775931326
Energy: 0.6777687494590662
Energy: 0.4974539228756073
Energy: 0.4713464812229058
Energy: 0.49745392287849194
Energy: 0.47076605209534544
Energy: 0.48356320489504395
Energy: 0.5917767908504459
Energy: 0.48356320489677473
Energy: 0.559359580814807
Energy: 0.5139534764549188
Energy: 0.4694044667420829
Energy: 0.513953476452611
Energy: 0.4723111717365258
Energy: 0.49808985947566925
Energy: 0.7167053555468311
Energy: 0.49808985947566925
Energy: 0.43678640629021154
Energy: 0.49747761532696816
Energy: 0.4977616374882812
Energy: 0.49747761532639123
Energy: 0.47088516530016467
Energy: 0.48261685953083644
Energy: 0.8190031141386843
Energy: 0.48261685952968264
Energy: 0.43722338557779694
Energy: 0.4980221255990526
Energy: 0.7098744413208646
Energy: 0.4980221256013341
Energy: 0.4725133455816517
Energy: 0.4981421127325455
Energy: 1.0008445585230412
Energy: 0.49814211273196857
Energy: 0.43883733840734146
Energy: 0.5009809931140193
Energy: 0.7379908160217108
Energy: 0.5009809931111348
Energy: 0.47087101955330657
Energy: 0.4826311806267219
Energy: 1.000868873699783
Energy: 0.4826311806272987
Energy: 0.5854604507953797
Energy: 0.49806434465225996
Energy: 0.7098956595363218
Energy: 0.49806434465168303
Energy: 0.47265163501239754
Energy: 0.4981119397698666
Energy: 0.8969882777222737
Energy: 0.4981119397681358
Energy: 0.5883536931425948
Energy: 0.5010477476684706
Energy: 0.49790861586804586
Energy: 0.5010477476678937
Energy: 0.4708597314155016
Energy: 0.482581227025971
Energy: 0.7917469245362734
Energy: 0.4825812270277018
Energy: 0.5845981328869354
Energy: 0.49823169992010935
Energy: 0.4694342769030059
Energy: 0.49823169992010935
Energy: 0.47227595244220094
Energy: 0.4973032361482185
Energy: 0.678660466523105
Energy: 0.4973032361482185
Energy: 0.5942378063615493
Energy: 0.5158020540345072
Energy: 0.47123988862702476
Energy: 0.515802054036815
Energy: 0.470778011400321
Energy: 0.4973820153388754
Energy: 0.560058363545117
Energy: 0.49738201534002924
Energy: 0.8269077951674342
Energy: 0.4981669404386804
Energy: 0.4723962852792415
Energy: 0.49816694043810344
Energy: 0.499268094910846
Energy: 0.49735296798973677
Energy: 0.43679204871964117
Energy: 0.49735296798915984
Energy: 0.8375616576065433
Energy: 0.5158750680353456
Energy: 0.47135905349952845
Energy: 0.5158750680324609
Energy: 0.7108025056305421
Energy: 0.49854079403456647
Energy: 0.43637586133962497
Energy: 0.4985407940391819
Energy: 1.000831099365782
Energy: 0.4981696530424001
Energy: 0.4731882320737994
Energy: 0.49816965304470784
Energy: 0.7390103227547233
Energy: 0.49745295703187364
Energy: 0.43677386658433925
Energy: 0.49745295703014286
Energy: 0.9150956431305294
Energy: 0.5138666867553757
Energy: 0.47132260150222566
Energy: 0.513866686753645
Energy: 0.7107605175326783
Energy: 0.49865223557397886
Energy: 0.4380995465738007
Energy: 0.498652235572825
Energy: 0.8969840383024839
Energy: 0.4981087068505919
Energy: 0.47304597418606104
Energy: 0.498108706849438
Energy: 0.4991444859511557
Energy: 0.49726082295639273
Energy: 0.5863562706546352
Energy: 0.49726082295696966
Energy: 0.6902262285884028
Energy: 0.5137784125965021
Energy: 0.47137886492762354
Energy: 0.5137784125901821
Energy: 0.470858291982992
Energy: 0.49841546854495633
Energy: 0.5849803395979357
Energy: 0.49841546854495633
Energy: 0.6772389551565444
Energy: 0.49714332457637966
Energy: 0.47311980070800075
Energy: 0.4971433245769566
Energy: 0.47243556526911573
Energy: 0.49730680245112424
Energy: 0.5940175328313029
Energy: 0.4973068024499704
Energy: 0.44849021192629823
Energy: 0.5307898585025711
Energy: 0.4724345653697088
Energy: 0.5307898585043019
Energy: 0.4733047562363202
Energy: 0.49841857606963463
Energy: 0.8272638355879623
Energy: 0.49841857607021156
Energy: 0.43680149007502284
Energy: 0.49727314793780375
Energy: 0.501114477940021
Energy: 0.49727314793722677
Energy: 0.4727094129224367
Energy: 0.49733149534739957
Energy: 0.8375459929058523
Energy: 0.4973314953456689

minimum gb energy = 0.43637586133962497 eV
minimum distance =  2.33723010997965 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.015485467221479376
Energy: 0.016080693793050185
Energy: 0.5966482170005859
Energy: 0.016080693791744295
Energy: 0.5963021696348808
Energy: 0.22697569854417451
Energy: 0.22661386800457056
Energy: 0.22697569854200622
Energy: 0.015485467221922884
Energy: 0.016080693792187805
Energy: 0.5966481971853682
Energy: 0.016080693792187805
Energy: 0.5963021696353242
Energy: 0.22697569854375563
Energy: 0.22661387337383818
Energy: 0.22697569854200622
Energy: 0.015485467221479376
Energy: 0.016080693792606675
Energy: 0.5966482100370267
Energy: 0.016080693792187805
Energy: 0.5963021696357679
Energy: 0.22697569854375563
Energy: 0.22661387709596265
Energy: 0.22697569854200622

minimum gb energy = 0.015485467221479376 eV
minimum distance =  2.54156642213375 Angstroms
sigma value = 1