Model name: model_name=EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_Pt__MO_637493005914_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Pt
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.921837165951729
cohesive_energy=5.850593855970826
mass=195.084
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.6330986430362e-19, 2.6181168376194e-19, 3.45329947339092e-19, 4.1868880888004996e-19, 4.832933772928319e-19, 5.409044446982039e-19, 5.925570172017299e-19, 6.38984891701782e-19, 6.807536365501619e-19, 7.18307054674488e-19, 7.52012044523946e-19, 7.821778261888979e-19, 8.090847805802939e-19, 8.33034116905326e-19, 8.54293398661872e-19, 8.72891465029344e-19, 8.88818702947938e-19, 9.0223372790442e-19, 9.13303166268726e-19, 9.22153589994942e-19, 9.28892344917546e-19, 9.33609152928042e-19, 9.3638412285813e-19, 9.37294159186242e-19, 9.363072183796979e-19, 9.33094854228528e-19, 9.272276833948199e-19, 9.18188202825792e-19, 9.05356370164086e-19, 8.87987173274892e-19, 8.651817910665359e-19, 8.358555499577999e-19, 7.98625771513542e-19, 7.51715641846656e-19, 6.929894595040201e-19, 6.198068373928019e-19, 5.2882243070120995e-19, 4.1574721258002597e-19, 2.7505687799521795e-19, 9.95836091215968e-20, -1.199586495938382e-19, -3.9635446660208997e-19, -7.471606536761939e-19, -1.196013642044562e-18, -1.77620505998508e-18, -2.53562076273474e-18, -3.5452964557152e-18, -4.912273559844e-18, -6.804332012233619e-18, -9.5000262424713e-18, -1.347448173136974e-17, -1.9598625675405e-17, -2.96003735308134e-17, -4.725203416058159e-17]
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: -1.26270300404689e-25 eV

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

Energy: 0.019170723393262184
Energy: 0.020207794827073883
Energy: 0.5386380673757027
Energy: 0.11510934466470356
Energy: 0.020207794827073883
Energy: 0.6486730582735873
Energy: 0.020207794827073883
Energy: 0.6486730582735873
Energy: 0.5386380673757027
Energy: 0.020207794827073883
Energy: 0.019170723393262184
Energy: 0.020207794827073883
Energy: 0.11510934466470356
Energy: 0.6486730582735873
Energy: 0.020207794827073883
Energy: 0.6486730582735873

minimum gb energy = 0.019170723393262184 eV
minimum distance =  2.71239931350895 Angstroms
sigma value = 1


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

Energy: 1.2012972516296938
Energy: 0.8728972740771265
Energy: 0.9176510426683534
Energy: 0.9075825205245405
Energy: 0.8648754471378013
Energy: 0.9644419367650509
Energy: 0.8671686786939623
Energy: 0.9644419367656971
Energy: 0.9068726723338028
Energy: 0.9147879519837414
Energy: 1.3073160800866914
Energy: 0.9147879519837414
Energy: 0.8710608718295579
Energy: 0.8689119511062737
Energy: 0.869319251939909
Energy: 0.8689119511062737
Energy: 1.1232749894483736
Energy: 0.8702265589566989
Energy: 0.8696559992221358
Energy: 0.8702265589566989
Energy: 0.9081363139798021
Energy: 0.9452687501450572
Energy: 0.8710140889175515
Energy: 0.9452687501457036
Energy: 0.8995930080939123
Energy: 0.9106454123513926
Energy: 1.1226441502823834
Energy: 0.9106454123533315
Energy: 0.9070698440668454
Energy: 0.9095755210063938
Energy: 0.9539171121371048
Energy: 0.9095755210063938
Energy: 0.9863968306040675
Energy: 0.936652285559254
Energy: 0.9576922170900161
Energy: 0.936652285559254
Energy: 0.997160134370622
Energy: 0.9370468964477234
Energy: 0.9473374752568764
Energy: 0.9370468964477234
Energy: 0.942724432579627
Energy: 0.9365923584548794
Energy: 0.9876828218899907
Energy: 0.9365923584548794
Energy: 0.9065523248014797
Energy: 0.9345972579476609
Energy: 0.9726418372531008
Energy: 0.9345972579476609
Energy: 0.8970799504926559
Energy: 0.9096790263366528
Energy: 0.8708321446553295
Energy: 0.9096790263360065
Energy: 0.9025685231770283
Energy: 0.9119006172116466
Energy: 0.8652727143886728
Energy: 0.9119006172116466
Energy: 0.8676932238108164
Energy: 0.8690625075499573
Energy: 0.8681933541450002
Energy: 0.869062507549311
Energy: 0.9032489542790828
Energy: 0.869535352553756
Energy: 0.86824218941981
Energy: 0.869535352553756
Energy: 0.917629585321522
Energy: 0.9078700824632164
Energy: 0.9021615688162028
Energy: 0.9078700824625701
Energy: 0.8682250980357593
Energy: 0.8698148987077178
Energy: 0.8641962965616132
Energy: 0.8698148987077178
Energy: 0.8994741405816871
Energy: 0.9080934273828355
Energy: 0.9089133930383965
Energy: 0.9080934273828355
Energy: 0.9346145986458864
Energy: 0.8699356568525908
Energy: 0.8712335014379695
Energy: 0.8699356568525908
Energy: 0.8696188113704402
Energy: 0.8717576268066867
Energy: 1.12088929818579
Energy: 0.8717576268066867
Energy: 0.8705982533086205
Energy: 0.8696945542187224
Energy: 0.9063063330106148
Energy: 0.8696945542193687
Energy: 1.1213249965586027
Energy: 0.9119466957313028
Energy: 0.899392139265157
Energy: 0.9119466957313028
Energy: 0.9550141693749121
Energy: 0.9115121570622741
Energy: 0.9148848449450032
Energy: 0.9115121570622741
Energy: 0.9593047113870169
Energy: 0.9360756272710654
Energy: 0.9871857412432884
Energy: 0.9360756272710654
Energy: 0.9483244450516685
Energy: 0.935190278477956
Energy: 0.9963707211884921
Energy: 0.9351902784786023
Energy: 0.9877929574743043
Energy: 0.9356080402548638
Energy: 0.9401298989785263
Energy: 0.9356080402542177
Energy: 0.9492008226110967
Energy: 0.9342181838888017
Energy: 0.9069765067197988
Energy: 0.9342181838888017
Energy: 0.8664409500012995
Energy: 0.9083959079874864
Energy: 0.8982382028970987
Energy: 0.90839590798684
Energy: 0.8661893959974821
Energy: 0.9100891559461709
Energy: 0.9022239342413917
Energy: 0.9100891559468172
Energy: 0.8693244402878286
Energy: 0.8694629677668915
Energy: 0.8636365981141709
Energy: 0.8694629677668915
Energy: 0.8686112859671464
Energy: 0.8694250191311541
Energy: 0.9052284024000071
Energy: 0.8694250191311541
Energy: 0.8686346953921975
Energy: 0.8710090645306018
Energy: 0.91889637851534
Energy: 0.8710090645306018

minimum gb energy = 0.8636365981141709 eV
minimum distance =  2.53161097200071 Angstroms
sigma value = 1


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

Energy: 1.3749610602155322
Energy: 0.9021385811437769
Energy: 0.9482495279050823
Energy: 0.9420641196761729
Energy: 0.9005622700527132
Energy: 1.0000730215875255
Energy: 0.9009837360332829
Energy: 1.0000730215875255
Energy: 0.9398617732228209
Energy: 0.9517387223504954
Energy: 1.2637547257630533
Energy: 0.9517387223504954
Energy: 0.9044301703368601
Energy: 0.9016161146117372
Energy: 0.8996586385720562
Energy: 0.9016161146117372
Energy: 0.8995655145668013
Energy: 0.9011017814582856
Energy: 0.8998452425925075
Energy: 0.9011017814590223
Energy: 0.9565905239719517
Energy: 0.9850753326147523
Energy: 0.9008576680702838
Energy: 0.9850753326147523
Energy: 0.9467035604363173
Energy: 0.9540049079988484
Energy: 1.072273399415759
Energy: 0.9540049079995854
Energy: 0.962171649474584
Energy: 0.9563602976982768
Energy: 0.9514594351721091
Energy: 0.9563602976982768
Energy: 1.0732799056224227
Energy: 0.9795326089088203
Energy: 0.9925197483388306
Energy: 0.9795326089088203
Energy: 0.9623525375228049
Energy: 0.9845199173331591
Energy: 0.9591950469324411
Energy: 0.9845199173331591
Energy: 0.9019454406393965
Energy: 0.9507575393004001
Energy: 0.9477625091141801
Energy: 0.9507575393004001
Energy: 0.9013556922112277
Energy: 0.9540083034434215
Energy: 0.9563107874088946
Energy: 0.9540083034434215
Energy: 0.9006326611211158
Energy: 0.9022821480384818
Energy: 0.898583530083548
Energy: 0.9022821480384818
Energy: 0.900742578810998
Energy: 0.9022114917161159
Energy: 0.8987173234592774
Energy: 0.9022114917168529
Energy: 0.946229295603074
Energy: 0.9425649498555556
Energy: 0.9476012057292829
Energy: 0.9425649498562926
Energy: 0.8997526675813168
Energy: 0.9019646482785292
Energy: 0.8996911997635304
Energy: 0.9019646482785292
Energy: 0.942075582449889
Energy: 0.9510352734000842
Energy: 0.946554502230466
Energy: 0.9510352734000842
Energy: 0.9433041337203005
Energy: 0.9015195284977532
Energy: 0.9834386770080394
Energy: 0.9015195284977532
Energy: 0.9416352062944946
Energy: 0.9040374143664882
Energy: 0.9037752586826518
Energy: 0.9040374143664882
Energy: 0.9553279749074512
Energy: 0.9020059178614116
Energy: 0.9013781327533265
Energy: 0.9020059178606746
Energy: 0.9471181373275728
Energy: 0.9544509536261814
Energy: 1.0717417555625737
Energy: 0.9544509536261814
Energy: 0.9572849502792032
Energy: 0.9552497465453536
Energy: 0.9496361791469916
Energy: 0.9552497465453536
Energy: 0.9562871560026875
Energy: 0.9796844685924205
Energy: 0.9924107849191093
Energy: 0.9796844685924205
Energy: 0.9639551550696005
Energy: 0.9814673971145057
Energy: 0.9585966735300973
Energy: 0.9814673971145057
Energy: 0.9022416389231398
Energy: 0.9505841897327665
Energy: 0.949060942253208
Energy: 0.9505841897327665
Energy: 0.9033605360606127
Energy: 0.9528532216579204
Energy: 0.9572919357404969
Energy: 0.9528532216579204
Energy: 0.9015503397548507
Energy: 0.9025783213611924
Energy: 0.8993854002099038
Energy: 0.9025783213611924
Energy: 0.90073663971024
Energy: 0.9021115605290679
Energy: 0.897992553070034
Energy: 0.9021115605290679
Energy: 0.8959796498093897
Energy: 0.9032903883826767
Energy: 0.9498094309151313
Energy: 0.9032903883826767

minimum gb energy = 0.8959796498093897 eV
minimum distance =  2.52683329461013 Angstroms
sigma value = 25


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

Energy: 1.3183477292428456
Energy: 0.926865295087384
Energy: 0.9848149967741155
Energy: 0.9811114117961947
Energy: 0.9439157229716539
Energy: 1.0356242429533218
Energy: 0.9379545374530073
Energy: 1.0356242429533218
Energy: 0.9801462603541387
Energy: 0.9866597639008071
Energy: 1.196348846905225
Energy: 0.9866597639008071
Energy: 0.9433691568243179
Energy: 0.940022862830382
Energy: 0.9384868053798883
Energy: 0.9400228628312386
Energy: 0.9376612698351593
Energy: 0.9375431714997452
Energy: 0.9378251277227823
Energy: 0.9375431714997452
Energy: 0.9808620060303564
Energy: 0.9394862737148093
Energy: 0.9388553104077365
Energy: 0.9394862737156661
Energy: 0.9824973601747452
Energy: 1.005624552666699
Energy: 1.0103949330284823
Energy: 1.005624552666699
Energy: 0.9856926743010002
Energy: 1.007075013415209
Energy: 0.9641611199959947
Energy: 1.007075013415209
Energy: 1.0163052479701005
Energy: 1.0033958351192527
Energy: 0.9476554931069404
Energy: 1.0033958351192527
Energy: 0.9866419694710304
Energy: 1.0037180588798054
Energy: 0.9383160760547962
Energy: 1.0037180588798054
Energy: 0.9253932663095106
Energy: 0.9375087207756446
Energy: 0.9344244169465438
Energy: 0.9375087207756446
Energy: 0.9235929961410987
Energy: 0.9386774478887916
Energy: 0.9360213481066219
Energy: 0.9386774478887916
Energy: 0.9852498037965738
Energy: 0.9806807468568781
Energy: 0.9243113554946946
Energy: 0.9806807468568781
Energy: 0.9369427403032851
Energy: 0.9373393582736371
Energy: 0.9427317464084435
Energy: 0.9373393582736371
Energy: 0.9302848562599512
Energy: 0.986609769370513
Energy: 0.9836514806002062
Energy: 0.986609769370513
Energy: 0.9716534381293145
Energy: 0.9391352077638291
Energy: 0.9884095244412019
Energy: 0.9391352077646856
Energy: 0.9371587898030785
Energy: 0.9425018564445431
Energy: 0.934712336999352
Energy: 0.9425018564453997
Energy: 0.9382535497849981
Energy: 0.940358882206434
Energy: 0.940493366012691
Energy: 0.940358882206434
Energy: 1.0126045785427487
Energy: 1.0071287240983098
Energy: 0.9867368217360044
Energy: 1.0071287240983098
Energy: 0.9380660998337021
Energy: 1.00760604474203
Energy: 0.9856828893596894
Energy: 1.00760604474203
Energy: 0.9521008893728985
Energy: 1.003633117073182
Energy: 1.0158106312349486
Energy: 1.003633117073182
Energy: 0.9472224617333791
Energy: 1.0048627711668077
Energy: 0.9864419308882757
Energy: 1.0048627711668077
Energy: 0.935191168291832
Energy: 0.937222560860468
Energy: 0.9253614921076331
Energy: 0.937222560860468
Energy: 0.9365985480497242
Energy: 0.939086443170285
Energy: 0.9242640390847091
Energy: 0.939086443170285
Energy: 0.9222764708611216
Energy: 0.9412534684034801
Energy: 0.9884628713218504
Energy: 0.9412534684034801

minimum gb energy = 0.9222764708611216 eV
minimum distance =  2.52242197308934 Angstroms
sigma value = 9


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

Energy: 1.229941044720992
Energy: 0.9504692114616058
Energy: 1.0195140429185785
Energy: 1.0196851613869078
Energy: 1.0587068250886968
Energy: 1.0656064449746545
Energy: 0.9829594035103828
Energy: 1.0656064449746545
Energy: 1.0194867134100272
Energy: 1.0206244622799319
Energy: 0.9901170190898863
Energy: 1.0206244622799319
Energy: 0.9863853619625824
Energy: 0.9826614033047817
Energy: 0.9825597589049382
Energy: 0.9826614033047817
Energy: 1.0104036290129852
Energy: 0.983100152593991
Energy: 0.9813500770369253
Energy: 0.983100152593991
Energy: 0.986828850900325
Energy: 0.9898637178783825
Energy: 0.9878243566028376
Energy: 0.9898637178783825
Energy: 1.0069025549314037
Energy: 1.060610066966508
Energy: 1.0206494303048241
Energy: 1.060610066966508
Energy: 0.9878808874896855
Energy: 1.060289346826867
Energy: 0.9860716282405467
Energy: 1.060289346826867
Energy: 0.9781301249196611
Energy: 0.9848126332496423
Energy: 0.9462752971517294
Energy: 0.9848126332496423
Energy: 0.9831587915385579
Energy: 0.9822809589451723
Energy: 0.9450324773036337
Energy: 0.9822809589451723
Energy: 0.9405648147993375
Energy: 1.0206891442700992
Energy: 1.0188663218111873
Energy: 1.0206891442700992
Energy: 1.0126632483780929
Energy: 0.9871064643052069
Energy: 0.9834454846068352
Energy: 0.9871064643052069
Energy: 1.0209345433846917
Energy: 1.0212647692993384
Energy: 0.9848182466991392
Energy: 1.0212647692993384
Energy: 1.0235254644882483
Energy: 0.9830653003738099
Energy: 1.008018318875313
Energy: 0.9830653003687003
Energy: 1.116286909736489
Energy: 0.9903152356104685
Energy: 0.9872612992859213
Energy: 0.9903152356104685
Energy: 0.988890220142504
Energy: 0.984193879860615
Energy: 0.9897931094212868
Energy: 0.984193879860615
Energy: 1.0120508414460982
Energy: 1.068334810106978
Energy: 0.987710450881685
Energy: 1.068334810106978
Energy: 1.0126447153083018
Energy: 1.053661506490497
Energy: 0.9848493650954177
Energy: 1.053661506490497
Energy: 0.9798086053097317
Energy: 0.9845406658133434
Energy: 0.9464051142660533
Energy: 0.9845406658133434
Energy: 0.985439202490058
Energy: 0.9814885574935326
Energy: 0.9446551393990197
Energy: 0.9814885574935326
Energy: 0.941163153928172
Energy: 0.9897368920224553
Energy: 1.0219442740215565
Energy: 0.9897368920234773

minimum gb energy = 0.9405648147993375 eV
minimum distance =  2.51968927235128 Angstroms
sigma value = 25


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

Energy: 1.0986321384311688
Energy: 0.9658728368839362
Energy: 1.0469281250858402
Energy: 1.0479744322600117
Energy: 1.0563249981480722
Energy: 1.043395717520162
Energy: 0.993031283606033
Energy: 1.043395717520162
Energy: 1.0471250197779747
Energy: 1.048475791021037
Energy: 1.0423878622782752
Energy: 1.0484757910197733
Energy: 1.0507570407464162
Energy: 1.0438404929295
Energy: 0.9945281086737505
Energy: 1.0438404929295
Energy: 1.020656568238394
Energy: 1.0489101098741649
Energy: 1.0004593360950773
Energy: 1.0489101098741649
Energy: 0.9688239768818465
Energy: 1.0001691504649348
Energy: 0.9991085250202782
Energy: 1.0001691504649348
Energy: 0.9598973139466802
Energy: 1.0479443309831427
Energy: 0.9934121893736774
Energy: 1.0479443309831427
Energy: 0.9585052078017767
Energy: 1.0448872786921033
Energy: 1.0012851344037768
Energy: 1.0448872786921033
Energy: 1.0453391734585717
Energy: 1.0486414498040646
Energy: 0.9589093837361101
Energy: 1.0486414498040646
Energy: 1.0492481568096537
Energy: 1.0447015670091615
Energy: 0.9584896491665515
Energy: 1.0447015670078978
Energy: 0.9589426243921175
Energy: 1.0490975517971894
Energy: 1.0477582921599837
Energy: 1.0490975517971894
Energy: 1.0349957381402732
Energy: 1.0472931093328441
Energy: 1.0506789262220795
Energy: 1.0472931093328441
Energy: 0.9936916043325139
Energy: 1.0494507811959366
Energy: 1.0286080008534342
Energy: 1.0494507811959366
Energy: 1.0027705415937478
Energy: 1.0487741596707136
Energy: 0.9710796520003668
Energy: 1.0487741596707136
Energy: 1.00208283489288
Energy: 1.047309040097672
Energy: 0.9585031540204274
Energy: 1.0473090400951441
Energy: 0.9993626734897508
Energy: 1.0547243511588953
Energy: 0.9591414887722435
Energy: 1.0547243511626865
Energy: 0.9569852772390045
Energy: 1.0493953868326464
Energy: 1.0508188338549755
Energy: 1.0493953868301187

minimum gb energy = 0.9569852772390045 eV
minimum distance =  2.51318779786374 Angstroms
sigma value = 17


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

Energy: 1.576555696728886
Energy: 1.0638803713815992
Energy: 1.1124060425802598
Energy: 1.1161500394867374
Energy: 1.0385100861257603
Energy: 1.0550723330837188
Energy: 1.1217439051329263
Energy: 1.0550723330837188
Energy: 1.0247402591701191
Energy: 1.027361194137495
Energy: 1.1158528562431476
Energy: 1.0273611941382106
Energy: 1.0279196250940092
Energy: 1.0824142447755483
Energy: 1.0502237432418846
Energy: 1.0824142447755483
Energy: 1.0998237286478676
Energy: 1.1051272982934868
Energy: 1.0311420558578248
Energy: 1.1051272982927711
Energy: 1.0550402107492505
Energy: 1.0905356245032922
Energy: 1.054233586290882
Energy: 1.0905356245032922
Energy: 1.1026407036344872
Energy: 1.0253082984644013
Energy: 1.0223961172916447
Energy: 1.0253082984644013
Energy: 1.1174808375049567
Energy: 1.0524600043858454
Energy: 1.0258385591112824
Energy: 1.0524600043858454
Energy: 1.1179994608302604
Energy: 1.1175369035333842
Energy: 1.1093516372088146
Energy: 1.1175369035341003
Energy: 1.1180317258412016
Energy: 1.0875701544262601
Energy: 1.098303124604926
Energy: 1.0875701544262601
Energy: 1.0441984175661179
Energy: 1.0345668236163
Energy: 1.0053629870367216
Energy: 1.034566823618447
Energy: 1.1166253855385477
Energy: 1.0359998716869876
Energy: 1.0142077675612609
Energy: 1.035999871686272
Energy: 1.107988310378316
Energy: 1.0345718652401517
Energy: 1.0227734378062152
Energy: 1.0345718652401517
Energy: 1.1090497414053957
Energy: 1.051144707029901
Energy: 1.0057626387625824
Energy: 1.051144707029185
Energy: 1.118305964785342
Energy: 1.1120231388098178
Energy: 1.115913685825947
Energy: 1.1120231388105337
Energy: 1.1164972923410088
Energy: 1.112866892192838
Energy: 1.1151796992931535
Energy: 1.112866892192122
Energy: 1.1120721508703078
Energy: 1.051854598598531
Energy: 1.0271035799074562
Energy: 1.051854598599247
Energy: 1.1237421504622291
Energy: 1.0524353610468422
Energy: 1.0223020670233849
Energy: 1.052435361047558
Energy: 1.0502730615618485
Energy: 1.1105760733629648
Energy: 1.050102200120221
Energy: 1.1105760733629648
Energy: 1.0598626167052299
Energy: 1.1069870655201706
Energy: 1.0518829979938191
Energy: 1.1069870655201706
Energy: 1.027745897215279
Energy: 1.0528185176278029
Energy: 1.1182833786994604
Energy: 1.0528185176278029
Energy: 1.0248972212042144
Energy: 1.02502046096047
Energy: 1.1059297751838162
Energy: 1.0250204609611857
Energy: 1.0600872895124318
Energy: 1.0853242995184909
Energy: 1.1167608359975247
Energy: 1.0853242995184909
Energy: 1.1906965805374
Energy: 1.117242434085395
Energy: 1.1156064175151053
Energy: 1.117242434085395
Energy: 1.0088827759683363
Energy: 1.0526739052578051
Energy: 1.130494865718952
Energy: 1.0526739052578051
Energy: 1.0195793339900494
Energy: 1.0302557753269943
Energy: 1.0883655450031835
Energy: 1.0302557753269943
Energy: 1.0105655579544717
Energy: 1.0112405056466414
Energy: 1.1174799727054006
Energy: 1.0112405056466414
Energy: 1.0218541199484497
Energy: 1.0300657876854096
Energy: 1.1094028584693973
Energy: 1.0300657876854096
Energy: 1.0088343854376736
Energy: 1.052885920049904
Energy: 1.0584083137791354
Energy: 1.0528859200491885
Energy: 1.1077447899552555
Energy: 1.11606026498468
Energy: 1.1114914633072603
Energy: 1.11606026498468

minimum gb energy = 1.0053629870367216 eV
minimum distance =  2.55184548018938 Angstroms
sigma value = 53


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

Energy: 1.4268338529359739
Energy: 0.9418680933289943
Energy: 1.0346344292701384
Energy: 1.0467171819058094
Energy: 1.2325650491643836
Energy: 0.9783022411987712
Energy: 1.0386394373646488
Energy: 0.9783022411987712
Energy: 1.0322328014654323
Energy: 1.0468824008597437
Energy: 1.135029824680049
Energy: 1.0468824008597437
Energy: 1.0565353142985205
Energy: 0.9785073576232702
Energy: 1.130058997000126
Energy: 0.9785073576232702
Energy: 1.0512051330567598
Energy: 0.9909326620619484
Energy: 0.9243433390600688
Energy: 0.9909326620619484
Energy: 1.1252288705628262
Energy: 0.9806485798106658
Energy: 0.9125318744225528
Energy: 0.9806485798106658
Energy: 1.1343772125591778
Energy: 1.0464894902379447
Energy: 1.0417657878133366
Energy: 1.0464894902379447
Energy: 1.1343245612373003
Energy: 0.979436828978573
Energy: 1.0434402991027707
Energy: 0.979436828978573
Energy: 1.0333144811476982
Energy: 1.0469209507233144
Energy: 1.1247184950694658
Energy: 1.0469209507249622
Energy: 1.0517802608208775
Energy: 0.9795263555370699
Energy: 1.0359600333799195
Energy: 0.9795263555370699
Energy: 1.0491311292113068
Energy: 0.9968553585603434
Energy: 0.9136709587495796
Energy: 0.9968553585603434
Energy: 1.1269468968948615
Energy: 0.9867656686655524
Energy: 0.9208555681888859
Energy: 0.9867656686655524
Energy: 1.1358940887386022
Energy: 0.9803898523103833
Energy: 1.0468887065454395
Energy: 0.9803898523103833

minimum gb energy = 0.9125318744225528 eV
minimum distance =  2.57341507492565 Angstroms
sigma value = 9


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

Energy: 1.4042206443270793
Energy: 1.1080574106957153
Energy: 1.1580053829726382
Energy: 1.1514283127881495
Energy: 1.0841997216223758
Energy: 1.0223462054680168
Energy: 1.1569941335526241
Energy: 1.0223462054643577
Energy: 1.009148509852665
Energy: 1.015919310585024
Energy: 1.2759154140007614
Energy: 1.015919310585024
Energy: 1.0153094995138285
Energy: 1.0194816945108038
Energy: 1.3288932782953498
Energy: 1.0194816945114136
Energy: 1.0158362540899368
Energy: 1.0227552139058478
Energy: 1.2506024453289026
Energy: 1.0227552139058478
Energy: 1.0181155176774646
Energy: 1.0225286574769348
Energy: 1.2500063807037631
Energy: 1.0225286574769348
Energy: 1.2329031468363925
Energy: 1.1510993860919656
Energy: 1.1606909728503512
Energy: 1.1510993860919656
Energy: 1.1862141972494133
Energy: 1.0186358619647808
Energy: 1.157120577166314
Energy: 1.0186358619647808
Energy: 1.0704678463479789
Energy: 1.1056975336060595
Energy: 1.1069976167848021
Energy: 1.1056975336066692
Energy: 1.023366567442691
Energy: 1.0218029554172643
Energy: 1.213691048131789
Energy: 1.0218029554172643
Energy: 1.0627388642545077
Energy: 1.060017542210678
Energy: 1.1493359975866067
Energy: 1.060017542210678
Energy: 1.0640320706492217
Energy: 1.055789674141589
Energy: 1.2982289234811586
Energy: 1.055789674160495
Energy: 1.1942443040281274
Energy: 1.0606719781483576
Energy: 1.0610421064816382
Energy: 1.0606719781483576
Energy: 1.2058752959419836
Energy: 1.058849721279106
Energy: 1.0482682048319647
Energy: 1.0588497212797159
Energy: 1.2364774435854362
Energy: 1.0619956520556173
Energy: 1.0875543537340355
Energy: 1.0619956520556173
Energy: 1.1856216125730354
Energy: 1.1119216835175507
Energy: 1.0880236085538373
Energy: 1.1119216835175507
Energy: 1.1591479971900576
Energy: 1.0222689101206583
Energy: 1.0849565885758565
Energy: 1.0222689101346853
Energy: 1.1539328141739333
Energy: 1.1513517713100136
Energy: 1.291658062680059
Energy: 1.1513517713094037
Energy: 1.1575556720229916
Energy: 1.022064148878875
Energy: 1.0843539954457724
Energy: 1.0220641488234326
Energy: 1.3016840750141028
Energy: 1.0163247907116417
Energy: 1.010424575624013
Energy: 1.0163247907116417
Energy: 1.2464343352118712
Energy: 1.0194574724380232
Energy: 1.0167960388724697
Energy: 1.0194574724368035
Energy: 1.2506332823451611
Energy: 1.0224655429943053
Energy: 1.0187093706744166
Energy: 1.022465542993695
Energy: 1.2501481668277417
Energy: 1.0217867736165855
Energy: 1.0158774226034981
Energy: 1.0217867736866644
Energy: 1.1637797222122055
Energy: 1.1548829786274768
Energy: 1.1882093813737895
Energy: 1.1548829786274768
Energy: 1.1598601092243108
Energy: 1.0186437879489252
Energy: 1.2004488320382507
Energy: 1.0186437879489252
Energy: 1.1048814654812087
Energy: 1.0299819155564716
Energy: 1.0680547465635792
Energy: 1.0299819155540322
Energy: 1.215380878102882
Energy: 1.022504770604132
Energy: 1.0243287215920238
Energy: 1.022504770594374
Energy: 1.153977598521137
Energy: 1.059606843967614
Energy: 1.070842925202968
Energy: 1.059606843968224
Energy: 1.316197191725982
Energy: 1.0565465390394373
Energy: 1.0616708445624616
Energy: 1.0565465390394373
Energy: 1.06021004005813
Energy: 1.0602766816035236
Energy: 1.1974329114997952
Energy: 1.0602766816035236
Energy: 1.0478210916938007
Energy: 1.054999807036403
Energy: 1.2501338748111472
Energy: 1.054999807035793
Energy: 1.079132188285638
Energy: 1.060866015022818
Energy: 1.2367408565816889
Energy: 1.060866015022818
Energy: 1.0878618727400895
Energy: 1.1088513543744303
Energy: 1.165106187295427
Energy: 1.1088513543744303
Energy: 1.083795983384172
Energy: 1.0227812197003912
Energy: 1.14056434775107
Energy: 1.022781219699781
Energy: 1.2923241994829078
Energy: 1.1513785236975926
Energy: 1.1471796245648822
Energy: 1.1513785236975926

minimum gb energy = 1.009148509852665 eV
minimum distance =  2.54667748843217 Angstroms
sigma value = 73


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

Energy: 1.330008492859861
Energy: 1.01045464366504
Energy: 1.1058471316439589
Energy: 1.106929943441702
Energy: 1.1448475412265477
Energy: 1.0239956325926558
Energy: 1.1084664418600252
Energy: 1.0239956325916881
Energy: 1.0102105935165877
Energy: 1.0150488675739193
Energy: 1.164661694601846
Energy: 1.0150488675739193
Energy: 1.013270477007951
Energy: 1.0269009622982814
Energy: 1.2468604371871599
Energy: 1.0269009622982814
Energy: 1.0226059420174545
Energy: 1.0251399844459839
Energy: 1.2495562670819038
Energy: 1.0251399844469513
Energy: 1.0149042004474462
Energy: 1.021958180344956
Energy: 1.2506382111087928
Energy: 1.0219581803333446
Energy: 1.1523038522880171
Energy: 1.1063632391738594
Energy: 1.1091427942709797
Energy: 1.1063632391728917
Energy: 1.1507408950920703
Energy: 1.0284903334455189
Energy: 1.1089441340110386
Energy: 1.0284903334513242
Energy: 1.1260669957241107
Energy: 1.0599923431462301
Energy: 1.1243370478702677
Energy: 1.0599923431462301
Energy: 1.0273594396659764
Energy: 1.0641651355714006
Energy: 1.149492224268273
Energy: 1.0641651355714006
Energy: 1.1198387111340424
Energy: 1.027692435147476
Energy: 1.0002524040799328
Energy: 1.027692435147476
Energy: 1.1088161918217783
Energy: 1.105314780178014
Energy: 1.2304587098308606
Energy: 1.1053147801789818
Energy: 1.140512372041561
Energy: 1.023647891728119
Energy: 1.0230570740303002
Energy: 1.0236478917581149
Energy: 1.1453382984134577
Energy: 1.0272789949236605
Energy: 1.0095309389948528
Energy: 1.0272789949236605
Energy: 1.2909939226100753
Energy: 1.021946610543461
Energy: 1.0122367051000314
Energy: 1.021946610543461
Energy: 1.2863520332955294
Energy: 1.0182885034901408
Energy: 1.0098346970834016
Energy: 1.0182885034901408
Energy: 1.2490016406520086
Energy: 1.0219191469584403
Energy: 1.025065673321102
Energy: 1.0219191469516673
Energy: 1.1077986908910802
Energy: 1.106293353657335
Energy: 1.2714085143298537
Energy: 1.106293353657335
Energy: 1.123486040499692
Energy: 1.0202524278646632
Energy: 1.1529209787156813
Energy: 1.0202524278646632
Energy: 1.1247709113523752
Energy: 1.0701933194475606
Energy: 1.1279961899346767
Energy: 1.0701933194475606
Energy: 1.1519500816204242
Energy: 1.1364141438115356
Energy: 1.0249750529895019
Energy: 1.1364141438115356
Energy: 1.2324773503677193
Energy: 1.0209322203495064
Energy: 1.1065924113342973
Energy: 1.0209322203495064

minimum gb energy = 1.0002524040799328 eV
minimum distance =  2.52937179154582 Angstroms
sigma value = 7


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

Energy: 1.500227829883681
Energy: 1.0533281084902826
Energy: 1.1275524404976138
Energy: 1.1242434233333105
Energy: 1.1442307954875661
Energy: 1.0535350984233016
Energy: 1.1289196467871578
Energy: 1.0535350984246699
Energy: 1.0371857882381637
Energy: 1.0551018914554304
Energy: 1.1602272393608324
Energy: 1.0551018914554304
Energy: 1.0364080330444645
Energy: 1.046643570768748
Energy: 1.2390804506883333
Energy: 1.046643570768748
Energy: 1.0280310282249716
Energy: 1.0622956653355402
Energy: 1.234163751643525
Energy: 1.0622956653355402
Energy: 1.0334557298844202
Energy: 1.062618682098466
Energy: 1.232333554659874
Energy: 1.0626186820991501
Energy: 1.1636074381913148
Energy: 1.033091102241014
Energy: 1.0327947166726352
Energy: 1.033091102241014
Energy: 1.1694594998743275
Energy: 1.0591505911590096
Energy: 1.033711763021827
Energy: 1.0591505911590096
Energy: 1.174984689077953
Energy: 1.0453556626436034
Energy: 1.0393991010920254
Energy: 1.0453556626436034
Energy: 1.2792618568451064
Energy: 1.0581080881981615
Energy: 1.0385499326351904
Energy: 1.0581080881981615
Energy: 1.1419479484851864
Energy: 1.046072551704259
Energy: 1.028966047011414
Energy: 1.0460725517049434
Energy: 1.1233467815388827
Energy: 1.122285306183574
Energy: 1.1537742493277199
Energy: 1.122285306183574
Energy: 1.140194961912149
Energy: 1.0540366898998808
Energy: 1.152707921250303
Energy: 1.0540366899457219
Energy: 1.149874666251877
Energy: 1.091542345170414
Energy: 1.0610472972440292
Energy: 1.091542345170414
Energy: 1.1456328286238606
Energy: 1.0559053502760463
Energy: 1.0474175637427263
Energy: 1.0559053502733096
Energy: 1.0394958857178114
Energy: 1.127042048891569
Energy: 1.1193793693263627
Energy: 1.127042048888832
Energy: 1.1462986134317272
Energy: 1.0446441933897166
Energy: 1.1412684134570732
Energy: 1.0446441933897166
Energy: 1.0412003325974808
Energy: 1.0588714163442077
Energy: 1.1590105361659273
Energy: 1.0588714163442077
Energy: 1.0392255343043106
Energy: 1.0531502347021944
Energy: 1.127362444889486
Energy: 1.0531502347015098
Energy: 1.0348110040119785
Energy: 1.0588519339515459
Energy: 1.040217889976641
Energy: 1.0588519339508617
Energy: 1.0331823124958623
Energy: 1.0982691726116227
Energy: 1.2360279732890354
Energy: 1.0982691726116227
Energy: 1.1245989869368598
Energy: 1.0612255206474293
Energy: 1.0345002681992177
Energy: 1.0612255206481134
Energy: 1.1703744266870495
Energy: 1.039829262872927
Energy: 1.0306580234558416
Energy: 1.039829262872927
Energy: 1.1684805017394166
Energy: 1.0472351000289237
Energy: 1.0353470550271653
Energy: 1.0472351000282396
Energy: 1.2541971172957567
Energy: 1.0542406694715376
Energy: 1.0351584131389107
Energy: 1.0542406694715376
Energy: 1.230510586046654
Energy: 1.0396553404402606
Energy: 1.0426330361544593
Energy: 1.0396553404395763
Energy: 1.1249148440372705
Energy: 1.1268809112304017
Energy: 1.3887871521674313
Energy: 1.1268809112304017
Energy: 1.1333839561358248
Energy: 1.04056678417064
Energy: 1.1495842955639277
Energy: 1.0405667844476154
Energy: 1.158280453395486
Energy: 1.0820235316550344
Energy: 1.1385525633291373
Energy: 1.08202353165435
Energy: 1.149002339772558
Energy: 1.1229341738088714
Energy: 1.0495083781787733
Energy: 1.1229341738088714
Energy: 1.0428895610044093
Energy: 1.1359672919099126
Energy: 1.118474346207682
Energy: 1.1359672919105968

minimum gb energy = 1.0280310282249716 eV
minimum distance =  2.51507527141048 Angstroms
sigma value = 29


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

Energy: 0.9755491709460042
Energy: 0.9586912846100875
Energy: 1.0338855155344013
Energy: 0.991078744519953
Energy: 0.9715294193193575
Energy: 0.973200364821509
Energy: 1.0212760878587428
Energy: 0.973200364821509
Energy: 0.998850146322304
Energy: 0.9944102939560131
Energy: 0.9768277072615131
Energy: 0.9944102939560131
Energy: 0.9805028059879051
Energy: 0.9690132991889052
Energy: 0.995021532341857
Energy: 0.969013299186575
Energy: 0.9948191542147043
Energy: 0.9890610815000883
Energy: 0.9684140932911554
Energy: 0.9890610815000883
Energy: 0.995469356196539
Energy: 0.9897138157859693
Energy: 0.9689526096613663
Energy: 0.9897138159024308
Energy: 0.9667447234327244
Energy: 0.9867992553014885
Energy: 0.9958500784134454
Energy: 0.9867992559327323
Energy: 1.020018615911791
Energy: 0.973683896238027
Energy: 0.9779221802984235
Energy: 0.973683896238027
Energy: 0.9714151783883094
Energy: 0.971984212680531
Energy: 0.9907455444910529
Energy: 0.971984212680531

minimum gb energy = 0.9586912846100875 eV
minimum distance =  2.5882455034122 Angstroms
sigma value = 5


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

Energy: 1.2696934428832691
Energy: 1.0293178277450468
Energy: 1.0173344187631599
Energy: 1.1128840886853668
Energy: 0.9884013821598693
Energy: 1.0102420930629843
Energy: 1.1161786609094857
Energy: 1.0102420930629843
Energy: 1.1179631595540556
Energy: 1.0879737107256222
Energy: 1.1212345316372605
Energy: 1.0879737107256222
Energy: 1.0377706645166533
Energy: 1.085626651144042
Energy: 1.0817723264435088
Energy: 1.085626651144042
Energy: 1.076371628160587
Energy: 1.0219166641242445
Energy: 1.1068094919888722
Energy: 1.0219166641242445
Energy: 1.024566626828388
Energy: 1.0113860093791116
Energy: 1.105761221397379
Energy: 1.0113860093791116
Energy: 1.009703580815914
Energy: 1.0130860725020159
Energy: 1.0752509146812341
Energy: 1.0130860725020159
Energy: 1.0148341093954352
Energy: 1.0106548158599928
Energy: 0.9775143915316339
Energy: 1.0106548158599928
Energy: 1.015923718283525
Energy: 1.039018337061546
Energy: 0.9814804381719512
Energy: 1.0390183370608999
Energy: 1.1525354212084764
Energy: 0.9856311940152306
Energy: 0.9892945227318146
Energy: 0.9856311940152306
Energy: 1.0183371996667274
Energy: 0.9801694792022613
Energy: 0.9799067272227088
Energy: 0.9801694792022613
Energy: 0.9761828863469753
Energy: 0.983017021154299
Energy: 0.9781794197977056
Energy: 0.9830170211549454
Energy: 0.9746788241614213
Energy: 0.994725256171343
Energy: 0.9844770632864229
Energy: 0.9947252561719891
Energy: 1.021826914692332
Energy: 1.0406439646809247
Energy: 1.1151122829345959
Energy: 1.0406439646809247
Energy: 1.0062610765997286
Energy: 1.0143189082476691
Energy: 1.1143312826665364
Energy: 1.0143189082463764
Energy: 1.0077456560598337
Energy: 1.0098179193955874
Energy: 0.9839413741005952
Energy: 1.0098179193955874
Energy: 1.0121911812868927
Energy: 1.0311717586155544
Energy: 1.0357892204438888
Energy: 1.0311717586220177
Energy: 1.0655816968042007
Energy: 1.010480770504693
Energy: 0.983240012170231
Energy: 1.010480770504693
Energy: 1.1519000908833052
Energy: 1.0889614396952128
Energy: 1.1164810425161722
Energy: 1.0889614396952128
Energy: 1.0892814980912584
Energy: 1.092837917654038
Energy: 1.0387506445011676
Energy: 1.0928379176508063
Energy: 1.1059723368428465
Energy: 1.0109403775483634
Energy: 1.0796709600813845
Energy: 1.0109403775477173
Energy: 1.1067323354558298
Energy: 1.02582638505257
Energy: 1.028023173430575
Energy: 1.0258263850558014
Energy: 1.0627655185888591
Energy: 1.0113539947352586
Energy: 1.0076895910321888
Energy: 1.0113539947352586
Energy: 0.9780284827645838
Energy: 1.00997433550987
Energy: 1.0108084305663498
Energy: 1.00997433550987
Energy: 0.9812955213590784
Energy: 1.0349101498329552
Energy: 1.014695179178899
Energy: 1.0349101498329552
Energy: 0.9903163038514775
Energy: 0.9858341725854494
Energy: 1.1523179745506984
Energy: 0.9858341725848032
Energy: 0.9829257175885151
Energy: 0.9805489036704057
Energy: 1.0151548602679998
Energy: 0.9805489036704057
Energy: 0.9894212909495733
Energy: 0.9817066767576021
Energy: 1.0431828453849754
Energy: 0.9817066767576021
Energy: 0.9845502445589358
Energy: 1.011050919488525
Energy: 0.9750449753529122
Energy: 1.0110509194891715
Energy: 1.1126795952137718
Energy: 1.0364222028099135
Energy: 1.0795246022110334
Energy: 1.0364222028099135
Energy: 1.1169670589527971
Energy: 1.0145249835690988
Energy: 1.0072056898332158
Energy: 1.0145249835684527
Energy: 1.0750867873028953
Energy: 1.0093420951741947
Energy: 1.0078377732565964
Energy: 1.0093420951754872
Energy: 1.0351867971177082
Energy: 1.0293953975328454
Energy: 1.011876703559898
Energy: 1.0293953975328454

minimum gb energy = 0.9746788241614213 eV
minimum distance =  2.53374065752847 Angstroms
sigma value = 1


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

Energy: 1.3189848756551494
Energy: 0.9487053599743109
Energy: 0.976114648354923
Energy: 0.9769848531448536
Energy: 0.9983548618365737
Energy: 0.9701366723040544
Energy: 0.9897626743531385
Energy: 0.9701366723040544
Energy: 1.0134296180239286
Energy: 1.06783289026939
Energy: 1.0141864378332288
Energy: 1.06783289026939
Energy: 0.9978378404440637
Energy: 1.068583800599063
Energy: 1.0109115496845793
Energy: 1.0685838005981692
Energy: 1.0109874757293975
Energy: 0.9764486858110863
Energy: 1.032641520204956
Energy: 0.9764486858110863
Energy: 0.9781129280109228
Energy: 0.9763916061337643
Energy: 1.0379354420369284
Energy: 0.9763916061337643
Energy: 0.9656466272245715
Energy: 0.9705730446613934
Energy: 1.0107688571279068
Energy: 0.9705730446613934
Energy: 0.970330881280169
Energy: 0.972746290799621
Energy: 0.9417561523695214
Energy: 0.972746290799621
Energy: 1.011566735811237
Energy: 1.0132542163078986
Energy: 0.9305654589341997
Energy: 1.0132542163078986
Energy: 1.0062005235792209
Energy: 0.9719356743157728
Energy: 0.9723688566180002
Energy: 0.9719356743157728
Energy: 1.011731292500967
Energy: 0.9706185732668826
Energy: 0.9677055905656823
Energy: 0.9706185732668826
Energy: 0.9318027633264285
Energy: 0.9736937874982653
Energy: 0.994817546308431
Energy: 0.9736937874982653
Energy: 0.9302988874538708
Energy: 0.9705952824508287
Energy: 1.0050791217107857
Energy: 0.9705952823686559
Energy: 1.0087483473079817
Energy: 1.0679900617439657
Energy: 0.9903964121519426
Energy: 1.0679900617439657
Energy: 0.997438983851559
Energy: 1.0664714592772127
Energy: 0.9898726979234327
Energy: 1.0664714592772127
Energy: 1.0001373647861729
Energy: 0.9716471847632683
Energy: 0.9702974683645853
Energy: 0.9716471847641619
Energy: 1.0105003650897688
Energy: 0.9768481869566349
Energy: 1.002546942426006
Energy: 0.9768481869584221
Energy: 0.973884899003347
Energy: 0.9713145246873968
Energy: 1.031888662271124
Energy: 0.9713145246873968
Energy: 0.9687302569900508
Energy: 0.9721993550169704
Energy: 0.9313549898563229
Energy: 0.9721993550169704
Energy: 0.971066240624393
Energy: 0.987874631691991
Energy: 0.9356483552529476
Energy: 0.987874631691991
Energy: 1.0023757097180253
Energy: 1.0168641336879172
Energy: 0.9909390904629322
Energy: 1.0168641336879172
Energy: 1.005593293842375
Energy: 0.9758427124166835
Energy: 0.9692076539670449
Energy: 0.9758427124166835
Energy: 0.9699431264860249
Energy: 0.9692155742191122
Energy: 0.9660472984909769
Energy: 0.9692155742182186
Energy: 0.9292263898176255
Energy: 0.9708740999580202
Energy: 0.9849084497424386
Energy: 0.9708740999580202

minimum gb energy = 0.9292263898176255 eV
minimum distance =  2.51603609725481 Angstroms
sigma value = 17


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

Energy: 1.3863201446757416
Energy: 0.9890164283930438
Energy: 1.0991841947689076
Energy: 0.9803968357789096
Energy: 1.0047546286521833
Energy: 0.9704247959788783
Energy: 1.0752646260264522
Energy: 0.9704247959794807
Energy: 1.1518750211865665
Energy: 1.0861047245506565
Energy: 1.0796683286562074
Energy: 1.0861047245501545
Energy: 1.1704228671117625
Energy: 1.1394058930035598
Energy: 1.0256022584465572
Energy: 1.1394058930040618
Energy: 1.0658610570120426
Energy: 0.9505672835427674
Energy: 1.072897989877984
Energy: 0.9505672835432695
Energy: 0.9561259813397943
Energy: 0.949859636139542
Energy: 1.067603292560731
Energy: 0.9498596361401447
Energy: 0.9472501699189037
Energy: 0.947157773657706
Energy: 1.0200458412187055
Energy: 0.9471577736571034
Energy: 0.9641131735950279
Energy: 0.9602757561903208
Energy: 0.9421940731838042
Energy: 0.960275756187509
Energy: 1.0735689870513865
Energy: 0.9500545375963528
Energy: 1.1564415416541634
Energy: 0.9500545375963528
Energy: 1.0817187521563854
Energy: 0.9711526987442212
Energy: 1.0759027758851594
Energy: 0.9711526987442212
Energy: 1.0698940609031788
Energy: 1.0351343430746602
Energy: 0.988042783250329
Energy: 1.0351343430746602
Energy: 1.0780516725154088
Energy: 0.9713730422961995
Energy: 1.0781068963816367
Energy: 0.9713730422961995
Energy: 0.982093523907933
Energy: 0.9821095364723523
Energy: 0.9989969110523507
Energy: 0.9821095364723523
Energy: 0.9697724491413865
Energy: 0.9676326789679855
Energy: 0.9682648211906014
Energy: 0.9676326789679855
Energy: 1.16386135643174
Energy: 0.9683369048245227
Energy: 0.9728250716572706
Energy: 0.9683369048245227
Energy: 0.9431704529893608
Energy: 0.9757500257606261
Energy: 0.9690999914503553
Energy: 0.9757500257606261
Energy: 0.9714345499596998
Energy: 0.9727194565817461
Energy: 1.0721226243945803
Energy: 0.9727194565773275
Energy: 0.9729501466183152
Energy: 0.9703610997780374
Energy: 1.0730269548126952
Energy: 0.9703610997780374
Energy: 0.9757029394333899
Energy: 0.9699429974473721
Energy: 1.1492606955894935
Energy: 0.9699429974473721
Energy: 1.0067398436106068
Energy: 1.0836237078202555
Energy: 0.9584780505707919
Energy: 1.0836237078197535
Energy: 1.0758370629297003
Energy: 0.9691356396373115
Energy: 0.9873634314677201
Energy: 0.9691356396373115
Energy: 1.0787785248010973
Energy: 1.087348183140696
Energy: 1.1551885840468215
Energy: 1.087348183140696
Energy: 1.0181604008953724
Energy: 1.013904588937713
Energy: 1.1674125280535372
Energy: 1.0139045889383154
Energy: 1.0748750539569958
Energy: 0.952549718271377
Energy: 1.0614357441880178
Energy: 0.952549718271377
Energy: 1.06909126676858
Energy: 0.9495939153636214
Energy: 0.9527312697706081
Energy: 0.9495939153642239
Energy: 1.0246831091602004
Energy: 0.9481208952599457
Energy: 0.9502250282821808
Energy: 0.9481208952605482
Energy: 0.9477318315657182
Energy: 0.9555116333622946
Energy: 0.9787155819916987
Energy: 0.9555116333622946
Energy: 1.1508699758412904
Energy: 0.9499035364485305
Energy: 1.0771214910885987
Energy: 0.9499035364485305
Energy: 1.0747005812653656
Energy: 0.9719699284895478
Energy: 1.0787790893667477
Energy: 0.9719699284884431
Energy: 0.9873516090745235
Energy: 1.0912547512530657
Energy: 1.0698092762287386
Energy: 1.0912547512530657
Energy: 1.0846558550941883
Energy: 0.9722552845294917
Energy: 0.9778174833373842
Energy: 0.9722552845294917
Energy: 0.9943660824168458
Energy: 0.9787454978332704
Energy: 0.9688231089790336
Energy: 0.9787454978316636
Energy: 0.9675072497754669
Energy: 0.9680956714866532
Energy: 0.9711265660582573
Energy: 0.9680956714861512
Energy: 0.9756048785833583
Energy: 0.9697430902369599
Energy: 1.167347043694152
Energy: 0.9697430902364578
Energy: 0.9698522802415132
Energy: 0.9971061766797061
Energy: 0.9425379731061289
Energy: 0.9971061766797061
Energy: 1.283482636329048
Energy: 0.971319799478146
Energy: 0.9703002491616205
Energy: 0.971319799478146
Energy: 0.9855144685615395
Energy: 0.969376451891474
Energy: 0.9701402991209793
Energy: 0.9693764518908715
Energy: 1.1541081710819834
Energy: 0.9706637229081854
Energy: 0.9867685272188305
Energy: 0.9706637229081854

minimum gb energy = 0.9421940731838042 eV
minimum distance =  2.51410895002706 Angstroms
sigma value = 89


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

Energy: 1.4097221843261853
Energy: 0.918902976055103
Energy: 0.9005169106228647
Energy: 0.897484575795452
Energy: 0.8859965209252234
Energy: 0.9713006798801234
Energy: 0.9118727101860559
Energy: 0.9713006798815687
Energy: 0.882671451887491
Energy: 0.9711313305831646
Energy: 0.9123941299195619
Energy: 0.9711313305831646
Energy: 0.8831464442541294
Energy: 0.9727547531848278
Energy: 0.9097632459982502
Energy: 0.9727547531848278
Energy: 0.9118643839679365
Energy: 0.8974360802501758
Energy: 0.9321070610627945
Energy: 0.8974360802501758
Energy: 0.8941854522405274
Energy: 0.8965271900666867
Energy: 0.9319379998164188
Energy: 0.8965271900666867
Energy: 0.8893825257840666
Energy: 0.8894434853287067
Energy: 0.9134229331595279
Energy: 0.8894434853287067
Energy: 0.8942008134069301
Energy: 0.8936936852364714
Energy: 0.8935395458273562
Energy: 0.8936936852364714
Energy: 0.8928662957166198
Energy: 0.8925778624645062
Energy: 0.8829341777738157
Energy: 0.8925778624645062
Energy: 0.9155218753687114
Energy: 0.9760927077828806
Energy: 0.9119677552184482
Energy: 0.9760927077828806
Energy: 0.9126915624299161
Energy: 0.9751646348797194
Energy: 0.8800551785609253
Energy: 0.9751646348797194
Energy: 0.932189039592806
Energy: 0.894700878395516
Energy: 0.9126670905241134
Energy: 0.894700878395516
Energy: 0.9325910918694573
Energy: 0.8920345731971405
Energy: 0.8951717565068105
Energy: 0.8920345731956952
Energy: 0.9552900899055261
Energy: 0.8889633333861843
Energy: 0.8879180439219612
Energy: 0.8889633333861843
Energy: 0.8844148338923127
Energy: 0.8925934549918204
Energy: 0.8949138789695225
Energy: 0.8925934549918204

minimum gb energy = 0.8800551785609253 eV
minimum distance =  2.53410339208733 Angstroms
sigma value = 13


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

Energy: 1.2684011970607636
Energy: 0.8760187025070622
Energy: 1.032944786716512
Energy: 0.879924800342643
Energy: 1.210658267057615
Energy: 0.8620529960651622
Energy: 0.9645663402859731
Energy: 0.8620529960651622
Energy: 0.8827330936416449
Energy: 0.8592965127230165
Energy: 0.9605511714177799
Energy: 0.8592965127254395
Energy: 1.0472259415845382
Energy: 0.8743677545451893
Energy: 0.962255131473197
Energy: 0.8743677497511656
Energy: 0.9609837639635855
Energy: 0.8621304118861061
Energy: 1.0030513022929752
Energy: 0.8621304118855002
Energy: 0.962504221229518
Energy: 0.8610253277216033
Energy: 0.9960310868293876
Energy: 0.8610253277216033
Energy: 0.9572396281081307
Energy: 0.8590326824186771
Energy: 1.1389991741230598
Energy: 0.8590326824192828
Energy: 0.8954338436516126
Energy: 0.8754986160693671
Energy: 0.9624801320291523
Energy: 0.8754986160699728
Energy: 0.8664309461046954
Energy: 0.8622259518951481
Energy: 0.963228545226393
Energy: 0.8622259518951481
Energy: 0.8658204660704718
Energy: 0.861532791652709
Energy: 0.9764463921803292
Energy: 0.861532791652709
Energy: 0.881791038032374
Energy: 0.8670084877260263
Energy: 1.2707609327196054
Energy: 0.8670084876515216
Energy: 0.9744489104585838
Energy: 0.8591449824535822
Energy: 0.96849476714157
Energy: 0.8591449824535822
Energy: 0.9767035585834836
Energy: 0.9053064880466686
Energy: 0.9958256595389834
Energy: 0.9053064880472743
Energy: 1.1461364731696555
Energy: 1.0036011073658797
Energy: 1.0498529607116887
Energy: 1.003601107313181
Energy: 0.9642932282124134
Energy: 0.8656683629892342
Energy: 0.9885342393186652
Energy: 0.8656683629892342
Energy: 0.9679714707873683
Energy: 0.8624353435678196
Energy: 0.8656124971244497
Energy: 0.8624353435678196
Energy: 1.1387725144364762
Energy: 0.8611138971614996
Energy: 0.8606708825270808
Energy: 0.8611138971621053
Energy: 0.8732463031818966
Energy: 0.8634805508788506
Energy: 0.88339239404098
Energy: 0.8634805508643131
Energy: 1.0513313378967628
Energy: 0.8628673055136786
Energy: 0.9720418950915442
Energy: 0.8628673055136786
Energy: 0.9770456879483531
Energy: 0.8589685402888523
Energy: 0.9583862596424562
Energy: 0.858968540289458
Energy: 1.0487991964769388
Energy: 0.8663376055207279
Energy: 0.9814214734845866
Energy: 0.8663376055213337
Energy: 0.9713066136334423
Energy: 0.9191629941360927
Energy: 0.9954545800363492
Energy: 0.9191629941360927
Energy: 0.9675440394814144
Energy: 0.8630382492440538
Energy: 0.97581639180898
Energy: 0.8630382492440538
Energy: 0.865580117248228
Energy: 0.8594417716548459
Energy: 0.9850442216833886
Energy: 0.8594417716548459
Energy: 0.9856508191115587
Energy: 0.8713728880604454
Energy: 0.9561396030355697
Energy: 0.8713728880604454
Energy: 0.8777225312186511
Energy: 0.8633490806586064
Energy: 0.9626193843781148
Energy: 0.8633490806580005
Energy: 0.8600474549225025
Energy: 0.8596408677555036
Energy: 0.985530031516581
Energy: 0.8596408677555036
Energy: 0.8736407562325613
Energy: 0.8652814268563794
Energy: 0.8841973703311211
Energy: 0.8652814268563794
Energy: 0.996509244473883
Energy: 0.8615773881191695
Energy: 1.060078904658443
Energy: 0.8615773881197752
Energy: 0.9563346598951296
Energy: 0.9085844731139114
Energy: 0.9949745537463792
Energy: 0.9085844731139114
Energy: 0.9898780068389562
Energy: 0.9125038599218065
Energy: 1.0513360233319449
Energy: 0.9125038599218065
Energy: 0.9670875178315401
Energy: 0.8634734521511359
Energy: 0.9699116044754528
Energy: 0.8634734521517416
Energy: 0.9641809810512527
Energy: 0.8650346513145767
Energy: 0.868717378620763
Energy: 0.8650346513145767
Energy: 1.14054330031533
Energy: 0.8599008667986714
Energy: 0.8598714799692242
Energy: 0.8599008667980657
Energy: 1.0463874552961396
Energy: 0.8639751709545352
Energy: 0.8623757691658762
Energy: 0.8639751709545352

minimum gb energy = 0.8589685402888523 eV
minimum distance =  2.52789145580334 Angstroms
sigma value = 37


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

Energy: 1.1086164089755575
Energy: 0.8415239418123345
Energy: 0.7940879113264557
Energy: 0.7944230232128692
Energy: 0.7930035556504847
Energy: 0.7912861251761408
Energy: 0.9640468120891157
Energy: 0.7912861251761408
Energy: 1.106165683458549
Energy: 0.8790926566587406
Energy: 0.9567239815120583
Energy: 0.8790926566587406
Energy: 1.1115698818792046
Energy: 0.7925185027646222
Energy: 0.9526518209435421
Energy: 0.7925185027646222
Energy: 0.804402150866286
Energy: 0.8826082323502503
Energy: 0.9449066100262132
Energy: 0.8826082323502503
Energy: 0.8973331538061379
Energy: 0.7926311236815726
Energy: 0.7848749670531344
Energy: 0.7926311236815726
Energy: 0.7904266914158874
Energy: 0.790587216561651
Energy: 0.9550787918153667
Energy: 0.790587216561651
Energy: 0.8019244476029305
Energy: 0.7923635535129697
Energy: 0.9530825395488876
Energy: 0.7923635535129697
Energy: 0.7922226314927595
Energy: 0.7949858887164382
Energy: 0.9533669717493086
Energy: 0.7949858887164382
Energy: 0.8033521639082619
Energy: 0.7927580398059755
Energy: 0.8889259411030421
Energy: 0.7927580398059755
Energy: 0.7940879113295822
Energy: 0.8415239418123345
Energy: 1.1086164089755575
Energy: 0.8415239418123345
Energy: 0.9640468120891157
Energy: 0.7912861251761408
Energy: 0.8876658395012753
Energy: 0.7912861251761408
Energy: 0.9567239815120583
Energy: 0.8790926566587406
Energy: 1.106165683458549
Energy: 0.8790926566587406
Energy: 0.9526518209435421
Energy: 0.79251850276358
Energy: 1.1115698818792046
Energy: 0.7925185027646222
Energy: 0.9449066100262132
Energy: 0.8826082323502503
Energy: 0.804402150866286
Energy: 0.8826082323502503
Energy: 0.8951055371703738
Energy: 0.7926311236815726
Energy: 0.7855483660301027
Energy: 0.7926311236815726
Energy: 0.9550787918174509
Energy: 0.790587216561651
Energy: 0.7904266914158874
Energy: 0.790587216561651
Energy: 0.9530825395468032
Energy: 0.7923635535129697
Energy: 0.8019244476029305
Energy: 0.7923635535129697
Energy: 0.9533669717493086
Energy: 0.7949858887164382
Energy: 0.7922226314927595
Energy: 0.7949858887164382
Energy: 0.7930037311695665
Energy: 0.7927580398059755
Energy: 0.8033521639082619
Energy: 0.7927580398059755

minimum gb energy = 0.7848749670531344 eV
minimum distance =  2.53699887920831 Angstroms
sigma value = 25


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

Energy: 1.2531203033474505
Energy: 0.722378590282658
Energy: 0.7235311596966049
Energy: 0.7211069796171132
Energy: 0.9581532153931354
Energy: 0.7155036939680082
Energy: 0.8489367323900743
Energy: 0.7155036939680082
Energy: 0.9597881856639149
Energy: 0.7147255633654095
Energy: 0.8427164749722771
Energy: 0.7147255633654095
Energy: 0.9511756368329591
Energy: 0.7155690597057844
Energy: 0.8402668853719272
Energy: 0.7155690597065981
Energy: 0.9974758705562994
Energy: 0.788802890122861
Energy: 1.006309790243297
Energy: 0.788802890122861
Energy: 0.9647199028670157
Energy: 0.7847422419323563
Energy: 1.0084595458347054
Energy: 0.7847422419323563
Energy: 0.9597173855756865
Energy: 0.7857968991335312
Energy: 0.9943573982008226
Energy: 0.7857968991327174
Energy: 0.8398446368044626
Energy: 0.7198404243408277
Energy: 1.000687443160268
Energy: 0.7198404243416415
Energy: 0.8403820327403495
Energy: 0.7156709407951416
Energy: 0.999912033865714
Energy: 0.7156709407951416
Energy: 0.8442775073657862
Energy: 0.7158741069628718
Energy: 1.0002376174072138
Energy: 0.7158741069628718
Energy: 0.7236239806557111
Energy: 0.7182061209217602
Energy: 1.100573387407975
Energy: 0.7182061209217602
Energy: 0.7189393311185406
Energy: 0.7159389970477583
Energy: 1.000892279085449
Energy: 0.7159389970477583
Energy: 0.7163767403341548
Energy: 0.7181924755124228
Energy: 0.9561648372163166
Energy: 0.7181924755124228
Energy: 0.7301294617247656
Energy: 0.7214353494229578
Energy: 0.971190220780713
Energy: 0.7214353494229578
Energy: 0.8407042103720455
Energy: 0.7138493137883318
Energy: 0.998240810959777
Energy: 0.7138493137883318
Energy: 0.8498082962236438
Energy: 0.7161193480346004
Energy: 0.9606059070502114
Energy: 0.7161193480346004
Energy: 0.9991100852541295
Energy: 0.7167077921372362
Energy: 0.9596291785309969
Energy: 0.7167077921356088
Energy: 0.8323069945745092
Energy: 0.7901481977805555
Energy: 0.997518414599344
Energy: 0.7901481977829968
Energy: 1.0047821424100694
Energy: 0.7856998885069496
Energy: 0.9614995890857967
Energy: 0.7856998885069496
Energy: 0.9986792333715013
Energy: 0.7866401767866188
Energy: 0.9634807077942193
Energy: 0.7866401767866188
Energy: 1.103678158926871
Energy: 0.7182493608456018
Energy: 0.847139982329533
Energy: 0.7182493608456018
Energy: 0.9986575048228009
Energy: 0.714777440306479
Energy: 0.7142660043267982
Energy: 0.714777440306479
Energy: 0.9915905877065521
Energy: 0.7181650426249742
Energy: 0.8517721250580795
Energy: 0.7181650426241604
Energy: 0.9940910014558196
Energy: 0.72492593383685
Energy: 0.717710573810236
Energy: 0.7249259338376638
Energy: 0.9983757607869986
Energy: 0.7146015279691235
Energy: 0.7139526278133344
Energy: 0.7146015279691235
Energy: 0.9559654460516641
Energy: 0.7161228293679668
Energy: 0.7219507010219056
Energy: 0.7161228293679668

minimum gb energy = 0.7138493137883318 eV
minimum distance =  2.53540285393619 Angstroms
sigma value = 41


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

Energy: 1.3395100855321955
Energy: 0.6735247938921337
Energy: 0.6655323192810043
Energy: 0.6646114912304126
Energy: 1.0634964105402476
Energy: 0.6569768083535011
Energy: 0.7641705676154852
Energy: 0.6569768083541683
Energy: 1.0641421093527417
Energy: 0.6559354003633858
Energy: 0.7606761303134305
Energy: 0.6559354003640532
Energy: 1.0755216368357399
Energy: 0.658820766487224
Energy: 0.8877129405497104
Energy: 0.658820766487224
Energy: 1.0746252733305033
Energy: 0.6541235835303186
Energy: 0.9624447867444919
Energy: 0.6541235835309859
Energy: 1.0605408580567328
Energy: 0.6560191506875769
Energy: 0.9653676200116473
Energy: 0.6560191506942484
Energy: 1.0681967619000579
Energy: 0.7182292338238886
Energy: 1.073344681474582
Energy: 0.7182292338238886
Energy: 0.9713646654216482
Energy: 0.7157679579409978
Energy: 0.9606202707826254
Energy: 0.7157679579403305
Energy: 0.8531701279271942
Energy: 0.7144200138094108
Energy: 1.0798685535868857
Energy: 0.7144200138087436
Energy: 0.8556263660939635
Energy: 0.6541929213315948
Energy: 1.072716492987801
Energy: 0.6541929213315948
Energy: 0.7669254357761232
Energy: 0.6623171346906016
Energy: 1.2106469794036823
Energy: 0.6623171346912686
Energy: 0.7512811016583165
Energy: 0.6549159933344549
Energy: 1.0720990214517763
Energy: 0.6549159933344549
Energy: 0.766072090489849
Energy: 0.6587429447060362
Energy: 1.0707050177806365
Energy: 0.6587429447053692
Energy: 0.6607057972498411
Energy: 0.6649303658664444
Energy: 1.0705446939884133
Energy: 0.6649303658664444
Energy: 0.6558750070142992
Energy: 0.6568660659037142
Energy: 1.0761350428624237
Energy: 0.6568660659037142
Energy: 0.6638616740983729
Energy: 0.661324312582758
Energy: 1.056183445123724
Energy: 0.661324312582758
Energy: 0.7697123748572311
Energy: 0.6609626802991927
Energy: 1.079124291090882
Energy: 0.66096268024582
Energy: 0.7527261388811561
Energy: 0.7503959803288034
Energy: 1.0702309673182442
Energy: 0.7503959803301379
Energy: 0.7601080352523486
Energy: 0.6597391392278261
Energy: 1.0616850034209389
Energy: 0.659739139227159
Energy: 0.9678476680483142
Energy: 0.6567543964429449
Energy: 1.058158059645541
Energy: 0.6567543964502834
Energy: 0.9642255229240788
Energy: 0.7212614926784798
Energy: 1.0717138895814862
Energy: 0.721261492616434
Energy: 0.968543685226408
Energy: 0.663838283794674
Energy: 1.0667750359948496
Energy: 0.663838283794674
Energy: 1.0777904036440036
Energy: 0.7133900537896223
Energy: 1.0595084803601882
Energy: 0.7133900537896223
Energy: 0.9611162373686543
Energy: 0.6626282606989522
Energy: 0.9714371910389176
Energy: 0.6626282606882776
Energy: 1.0753227788903776
Energy: 0.7232016612982924
Energy: 0.8465156076525782
Energy: 0.7232016612982924
Energy: 1.0775180051637834
Energy: 0.6567099588415487
Energy: 0.965764000426008
Energy: 0.6567099588408816
Energy: 1.075398479634314
Energy: 0.6605590279422708
Energy: 0.7722255656435121
Energy: 0.660559027942938
Energy: 1.07578980611128
Energy: 0.7517803863242186
Energy: 0.7491259259545088
Energy: 0.7517803863235515
Energy: 1.070759554762416
Energy: 0.6629385802953532
Energy: 0.753664266109625
Energy: 0.6629385802953532
Energy: 1.0748558944605617
Energy: 0.66086707042214
Energy: 0.666369496120665
Energy: 0.660867070421473
Energy: 1.0739012357819113
Energy: 0.6566013559236041
Energy: 0.6555179971079051
Energy: 0.6566013559236041
Energy: 1.0756886829270076
Energy: 0.6630898894537112
Energy: 0.659911545181225
Energy: 0.6630898894537112

minimum gb energy = 0.6541235835303186 eV
minimum distance =  2.53764020982104 Angstroms
sigma value = 15


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

Energy: 1.1684676870020585
Energy: 0.6287924794840563
Energy: 0.8612508329319426
Energy: 0.6179383260554155
Energy: 1.1086729166647828
Energy: 0.6101170639166255
Energy: 0.7009906184429875
Energy: 0.6101170639166255
Energy: 1.1311698995724693
Energy: 0.610845080582654
Energy: 0.6980180642118783
Energy: 0.610845080582654
Energy: 1.1220410764406337
Energy: 0.6136087632696045
Energy: 0.8901245120416441
Energy: 0.6136087632696045
Energy: 1.1166637288372387
Energy: 0.6093392680859013
Energy: 0.8663720470082243
Energy: 0.6093392680870316
Energy: 1.1118220565785595
Energy: 0.6082571836783375
Energy: 0.8737637254326713
Energy: 0.6082571836755116
Energy: 0.9565527917156558
Energy: 0.6146096149785397
Energy: 1.0388691399847532
Energy: 0.614609614979105
Energy: 1.0494739476100983
Energy: 0.6628686660449414
Energy: 0.8630385586775607
Energy: 0.6628686660455066
Energy: 0.9592701677272648
Energy: 0.6591133987630324
Energy: 1.036658318891724
Energy: 0.6591133987624672
Energy: 0.9588505427241502
Energy: 0.7740265585162742
Energy: 1.117428839959952
Energy: 0.7740265585168393
Energy: 0.8878088999362698
Energy: 0.6147078998522764
Energy: 1.0654724954402188
Energy: 0.6147078998601887
Energy: 0.7717776044172051
Energy: 0.6073634280634239
Energy: 1.1174975796361826
Energy: 0.6073634280634239
Energy: 0.869924242786805
Energy: 0.6125657238513236
Energy: 1.1194766856406477
Energy: 0.6125657238016393
Energy: 0.7095325388679365
Energy: 0.6185876993160854
Energy: 1.039224088229863
Energy: 0.6185876993160854
Energy: 0.6874645280744971
Energy: 0.6095196787392189
Energy: 1.1168807252712263
Energy: 0.6095196787392189
Energy: 0.7080645332563131
Energy: 0.6145056323260762
Energy: 1.1209398181522854
Energy: 0.6145056323260762
Energy: 0.6254388146543179
Energy: 0.6164870070316301
Energy: 1.117971233755591
Energy: 0.6164870070321952
Energy: 0.6097633129875634
Energy: 0.6092332177167918
Energy: 1.11715482418693
Energy: 0.6092332177173572
Energy: 0.6252464023774206
Energy: 0.6153968760924783
Energy: 1.1130031257436555
Energy: 0.6153968760924783
Energy: 0.7048148920446107
Energy: 0.6134930891432483
Energy: 1.1214743732592711
Energy: 0.6134930891432483
Energy: 0.6877307685184522
Energy: 0.6094356650294922
Energy: 1.1172813348908122
Energy: 0.6094356650294922
Energy: 0.7046561828509954
Energy: 0.6136198923361215
Energy: 1.1194082011335962
Energy: 0.6136198923355564
Energy: 0.8764559662064022
Energy: 0.6103414930291491
Energy: 1.1071070988213556
Energy: 0.6103414930280187
Energy: 0.8650828338641339
Energy: 0.6075475387292633
Energy: 1.117145240670594
Energy: 0.6075475387292633
Energy: 0.8883895645426345
Energy: 0.6120258446641167
Energy: 0.9583327855295881
Energy: 0.6120258446635514
Energy: 1.0369151097845666
Energy: 0.7734384799796268
Energy: 1.1193064719993706
Energy: 0.7734384799796268
Energy: 0.8672194109060638
Energy: 0.6593221359459321
Energy: 1.0377226694866568
Energy: 0.6593221359459321
Energy: 1.0485143912447632
Energy: 0.6629421009750178
Energy: 0.9595495945506811
Energy: 0.6629421009806695
Energy: 1.038198332814462
Energy: 0.6099261913129783
Energy: 1.037413135537425
Energy: 0.6099261913135435
Energy: 1.0365249933783098
Energy: 0.6084245755899269
Energy: 0.8702727126338567
Energy: 0.6084245755899269
Energy: 1.114573047016426
Energy: 0.6885746461758889
Energy: 0.7712057079610855
Energy: 0.6885746461792801
Energy: 1.0386129493863316
Energy: 0.6159726993366584
Energy: 0.8868661335389019
Energy: 0.6159726993366584
Energy: 1.118867121709397
Energy: 0.6104999554534212
Energy: 0.6955497807718174
Energy: 0.6104999554534212
Energy: 1.117188300169336
Energy: 0.609667125562661
Energy: 0.6924087802569249
Energy: 0.609667125562661
Energy: 1.1177696686676386
Energy: 0.617915767082673
Energy: 0.625936867774504
Energy: 0.6179157671143231
Energy: 1.116451665305539
Energy: 0.6113650165590307
Energy: 0.6150065926146948
Energy: 0.6113650165590307
Energy: 1.1255348753698817
Energy: 0.6114104383682367
Energy: 0.6179676144961557
Energy: 0.6114104383688018

minimum gb energy = 0.6073634280634239 eV
minimum distance =  2.53557553149312 Angstroms
sigma value = 85


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

Energy: 1.2163026489236861
Energy: 0.5742312413954807
Energy: 0.5503212102329136
Energy: 0.5511122834657609
Energy: 1.1254136584331846
Energy: 0.5520123567348717
Energy: 0.6282519397829167
Energy: 0.5520123567353619
Energy: 1.1232175931674846
Energy: 0.5522759199701295
Energy: 0.6285208077967082
Energy: 0.5522759199691492
Energy: 0.9925731583969238
Energy: 0.5550420189552787
Energy: 0.7868358811378668
Energy: 0.5550420189557689
Energy: 1.1324467969323602
Energy: 0.550344383813005
Energy: 0.7771150684842081
Energy: 0.5503443838134952
Energy: 0.9959317113849102
Energy: 0.551191122627321
Energy: 0.7866083438874697
Energy: 0.5511911226258505
Energy: 1.0020681206241018
Energy: 0.5514835174568748
Energy: 0.9417000708023996
Energy: 0.5514835174617765
Energy: 1.0754731074205903
Energy: 0.5513835878575124
Energy: 0.7684124292993176
Energy: 0.5513835878570222
Energy: 1.0027558604039544
Energy: 0.552382304233058
Energy: 0.9357660529550302
Energy: 0.552382304233058
Energy: 1.000526213609079
Energy: 0.6345427032544437
Energy: 1.0633321093185688
Energy: 0.6345427032544437
Energy: 0.9334957993180296
Energy: 0.5507231484051013
Energy: 0.9406432283253338
Energy: 0.5507231476485748
Energy: 0.8557175035402168
Energy: 0.5508057743728317
Energy: 1.0651084498486476
Energy: 0.5508057743811647
Energy: 0.9329565854273516
Energy: 0.5515161313232182
Energy: 1.0608770900064486
Energy: 0.551516131325179
Energy: 0.7868717613387465
Energy: 0.5523120825281719
Energy: 0.9281975539350208
Energy: 0.5523120825252309
Energy: 0.6864723857343278
Energy: 0.5504404873489064
Energy: 1.1341388287620597
Energy: 0.5504404873489064
Energy: 0.7785092392925299
Energy: 0.553102332804529
Energy: 1.0619463594778455
Energy: 0.553102332804529
Energy: 0.6274753466822199
Energy: 0.5524437791448424
Energy: 1.0583817559209518
Energy: 0.5524437791443523
Energy: 0.6197180536254283
Energy: 0.5527081156377024
Energy: 1.1319836187643888
Energy: 0.5527081156377024
Energy: 0.6255003168740327
Energy: 0.5561637310712729
Energy: 1.1261821759599604
Energy: 0.5561637310717631
Energy: 0.5523396048555419
Energy: 0.5550062521033741
Energy: 1.1262357473053355
Energy: 0.5550062521033741
Energy: 0.5514276998860547
Energy: 0.5510934782504975
Energy: 1.1310067960650103
Energy: 0.5510934782504975
Energy: 0.5578064662347202
Energy: 0.5526512205699351
Energy: 1.119486772952622
Energy: 0.5526512205694449
Energy: 0.6236600432978698
Energy: 0.5553826629256761
Energy: 1.129828529426598
Energy: 0.5553826629261662
Energy: 0.6225866438302082
Energy: 0.5508026538261978
Energy: 1.1321060345262537
Energy: 0.5508026538261978
Energy: 0.6277269338805336
Energy: 0.552668953560675
Energy: 1.0242130070956033
Energy: 0.552668953560675
Energy: 0.7838851655126775
Energy: 0.5508797145924178
Energy: 1.1318266259449263
Energy: 0.5508797145919276
Energy: 0.7793404609251074
Energy: 0.5511293267360896
Energy: 1.1243275830399573
Energy: 0.5511293267390307
Energy: 0.8909012997850249
Energy: 0.5519735752441931
Energy: 0.9961101360377641
Energy: 0.5519735752437029
Energy: 0.9331596866368425
Energy: 0.5525993284196223
Energy: 1.13225719528739
Energy: 0.5525993284181517
Energy: 0.9324385192133167
Energy: 0.5514889092047527
Energy: 0.9983086134042654
Energy: 0.5514889093331353
Energy: 1.0159162373830755
Energy: 0.6359114180038972
Energy: 0.8506568940519103
Energy: 0.6359114180019364
Energy: 0.9325068881238351
Energy: 0.6339055306185565
Energy: 1.0145465774809823
Energy: 0.6339055306180663
Energy: 1.0647046181109467
Energy: 0.5512364455652204
Energy: 0.859834136142645
Energy: 0.5512364456504674
Energy: 1.1330874865999603
Energy: 0.5518293494819843
Energy: 0.8583002116728579
Energy: 0.5518293494819843
Energy: 0.9374623565144377
Energy: 0.5519560221226546
Energy: 0.7875847758102753
Energy: 0.5519560219741745
Energy: 1.1342725151234512
Energy: 0.5508142366367818
Energy: 0.7783426187664315
Energy: 0.5508142366362916
Energy: 1.1295583166481833
Energy: 0.5511724974204699
Energy: 0.7848330482801654
Energy: 0.5511724974209602
Energy: 1.0579972891406293
Energy: 0.5570327757516313
Energy: 0.6215625538643923
Energy: 0.5570327757516313
Energy: 1.1322893918981123
Energy: 0.5502706979722501
Energy: 0.6218243801781064
Energy: 0.5502706979722501
Energy: 1.1263850867121779
Energy: 0.5585230617457021
Energy: 0.6242569101864257
Energy: 0.5585230617452118
Energy: 1.055908211284768
Energy: 0.55234645519481
Energy: 0.5549497960038969
Energy: 0.55234645519481
Energy: 1.131864867224411
Energy: 0.5509460498543278
Energy: 0.5506433512156035
Energy: 0.5509460498543278
Energy: 1.1188179962271956
Energy: 0.555439060626501
Energy: 0.5516711965217148
Energy: 0.555439060626501

minimum gb energy = 0.5502706979722501 eV
minimum distance =  2.54672411494288 Angstroms
sigma value = 113


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

Energy: 0.021689197619399157
Energy: 0.02291423745639324
Energy: 0.8888428217742755
Energy: 0.42949310913065547
Energy: 0.025459845984664182
Energy: 0.12504300964949144
Energy: 0.5822740408543632
Energy: 0.12504300964949144
Energy: 0.0226238781639172
Energy: 0.12470313974868831
Energy: 0.5794036454300947
Energy: 0.12470313974868831
Energy: 0.023900601866371125
Energy: 0.12790685391793388
Energy: 0.5827460453805957
Energy: 0.1279068539183107
Energy: 0.5849609757162516
Energy: 0.12722662889464634
Energy: 0.5843648689448403
Energy: 0.12722662889464634
Energy: 0.022338653578082825
Energy: 0.12431264856632254
Energy: 0.5789188265754797
Energy: 0.1243126485659457

minimum gb energy = 0.021689197619399157 eV
minimum distance =  2.74024880689654 Angstroms
sigma value = 1