Model name: model_name=MEAM_LAMMPS_EtesamiAsadi_2018_Cu__MO_227887284491_001
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=3.619999974966049
cohesive_energy=3.54027843854009
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: 0.013648112444082476
Energy: 0.013874009964248342
Energy: 0.013908154024736054
Energy: 0.013874009964248342
Energy: 0.013874009964248342
Energy: 0.7111516641919511
Energy: 0.013874009964248342
Energy: 0.7111516641919511
Energy: 0.013908154024736054
Energy: 0.013874009964248342
Energy: 0.013648112444082476
Energy: 0.013874009964248342
Energy: 0.013874009964248342
Energy: 0.7111516641919511
Energy: 0.013874009964248342
Energy: 0.7111516641919511

minimum gb energy = 0.013648112444082476 eV
minimum distance =  2.47369084366209 Angstroms
sigma value = 1


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

Energy: 0.8967506337463113
Energy: 0.9082329875858727
Energy: 0.8440535086054389
Energy: 0.9082329875858727
Energy: 0.8582549662226988
Energy: 0.897491692244995
Energy: 0.8583224266687267
Energy: 0.8974916922442364
Energy: 0.8267172325611212
Energy: 0.8990720160361735
Energy: 0.8828806730741796
Energy: 0.8990720160354148
Energy: 0.837351472923734
Energy: 0.9151318903010397
Energy: 0.8349865231707735
Energy: 0.9151318903010397
Energy: 0.8396172301704801
Energy: 0.9094956868564507
Energy: 0.840092186565704
Energy: 0.9094956868572094
Energy: 0.8169585785311969
Energy: 1.028795449668057
Energy: 0.7936649911819886
Energy: 1.028795449668057
Energy: 0.8608483806998695
Energy: 0.8989641802945069
Energy: 0.8183146584050381
Energy: 0.8989641802937484
Energy: 0.779210938220901
Energy: 0.909570999770296
Energy: 0.7976707583811047
Energy: 0.9095709997710546
Energy: 0.8359135572066153
Energy: 0.8449595335461146
Energy: 0.8702515623914557
Energy: 0.8449595335445976
Energy: 0.7936271078664464
Energy: 0.8993494963867055
Energy: 0.7747816651230752
Energy: 0.8993494963867055
Energy: 0.8691814517666577
Energy: 0.894927625887449
Energy: 0.8358858341992672
Energy: 0.8949276258882075
Energy: 0.8565010022272006
Energy: 0.9094680437586952
Energy: 0.802288026188739
Energy: 0.9094680437579367
Energy: 0.8568211783968304
Energy: 0.8983977822929202
Energy: 0.8606890542840432
Energy: 0.8983977822929202
Energy: 0.8443140885776464
Energy: 0.9017563810885924
Energy: 0.8187147626409513
Energy: 0.9017563810878338
Energy: 0.8763249646443038
Energy: 0.9080139514464319
Energy: 0.841518035657863
Energy: 0.9080139514464319
Energy: 0.8512086960259044
Energy: 0.9081690157569743
Energy: 0.8413806431331229
Energy: 0.9081690157562158
Energy: 0.8827637801184237
Energy: 0.8990335510167682
Energy: 0.8102065870031486
Energy: 0.8990335510175268
Energy: 0.858269956019152
Energy: 0.8968221325588458
Energy: 0.8594154994061851
Energy: 0.8968221325596045
Energy: 0.774193198324132
Energy: 0.9092399501989348
Energy: 0.8014318143122668
Energy: 0.9092399501989348
Energy: 0.8732640599301252
Energy: 0.8459915383721782
Energy: 0.8381116755847764
Energy: 0.8459915383721782
Energy: 0.7966944010253147
Energy: 0.8991181501669773
Energy: 0.7794955568615669
Energy: 0.8991181501669773
Energy: 0.8357472683778379
Energy: 0.8490710441045544
Energy: 0.8519476862557915
Energy: 0.8490710441075542
Energy: 0.9310518253608231
Energy: 0.9099727638527467
Energy: 0.8094569053131315
Energy: 0.9099727638527467
Energy: 0.9059093770210045
Energy: 0.8988438910427947
Energy: 0.816668733033807
Energy: 0.8988438910420361
Energy: 0.8182259587073227
Energy: 1.0265619961446812
Energy: 0.8611680266176852
Energy: 1.02656199614544
Energy: 0.8422202766056827
Energy: 0.9091097729902206
Energy: 0.8204475292624853
Energy: 0.9091097729894619
Energy: 0.8562112539158495
Energy: 1.0268565540130634
Energy: 0.8358007861618241
Energy: 1.0268565540130634
Energy: 0.92845252808219
Energy: 0.8986630739742604
Energy: 0.8840085915681287
Energy: 0.8986630739735019
Energy: 0.8576337189841926
Energy: 0.9238175480569493
Energy: 0.8564405931244183
Energy: 0.923817548057708
Energy: 0.8969163186464365
Energy: 0.9085390900405952
Energy: 0.8595941087692163
Energy: 0.9085390900405952
Energy: 0.8489262286231093
Energy: 0.9039425855978922
Energy: 0.8566619340856807
Energy: 0.9039425855971336
Energy: 0.8327087383598802
Energy: 0.8998339901599834
Energy: 0.8433263468306805
Energy: 0.8998339901607421
Energy: 0.839206104021534
Energy: 0.9149011878199064
Energy: 0.8266098343360497
Energy: 0.9149011878199064

minimum gb energy = 0.774193198324132 eV
minimum distance =  2.31101747426866 Angstroms
sigma value = 1


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

Energy: 0.9526280612408192
Energy: 0.9650074829517412
Energy: 0.8967533441600857
Energy: 0.9650074829508762
Energy: 0.8915190917747756
Energy: 0.9390307507711747
Energy: 0.8936946011278994
Energy: 0.9390307507694449
Energy: 0.8575237632262068
Energy: 0.9643542944565408
Energy: 0.8725680595794943
Energy: 0.9643542944582706
Energy: 0.8339361040306947
Energy: 0.8615748626860843
Energy: 0.8517276542734656
Energy: 0.8615748626826247
Energy: 0.8339445099198181
Energy: 0.9478077806957609
Energy: 0.9647445908966208
Energy: 0.9478077806974907
Energy: 0.9254388144206983
Energy: 0.9479253854726398
Energy: 0.965241952350107
Energy: 0.9479253854735047
Energy: 0.8810079540876626
Energy: 0.8663051403495815
Energy: 0.8547473425856881
Energy: 0.8663051403504464
Energy: 0.8056627427774964
Energy: 0.9622611573529231
Energy: 0.8278644853831233
Energy: 0.9622611573529231
Energy: 0.8674684885423033
Energy: 0.8882298566054713
Energy: 0.9104699164028799
Energy: 0.8882298566054713
Energy: 0.8338167306192364
Energy: 0.9639733379436303
Energy: 0.8875681719402737
Energy: 0.963973337944495
Energy: 0.8808576581289139
Energy: 0.9206308354352244
Energy: 0.8973757229893404
Energy: 0.9206308354343596
Energy: 0.8373528775599793
Energy: 0.9560340608915235
Energy: 0.8700106929468175
Energy: 0.9560340608889288
Energy: 0.8885107120155167
Energy: 0.9493770354090968
Energy: 0.8790907048956181
Energy: 0.9493770354099618
Energy: 0.8882237166906277
Energy: 0.9493789234756301
Energy: 0.8726336391663361
Energy: 0.949378923476495
Energy: 0.8372089526658694
Energy: 0.9560569649975367
Energy: 0.9169553230270742
Energy: 0.9560569649966717
Energy: 0.8811151203096761
Energy: 0.9205072223125724
Energy: 0.8936415737706411
Energy: 0.9205072223108426
Energy: 0.8339482349030376
Energy: 0.9636032861928094
Energy: 0.8194713643327506
Energy: 0.9636032861936744
Energy: 0.8674243275859065
Energy: 0.8885970053681884
Energy: 0.9104677911055109
Energy: 0.8885970053681884
Energy: 0.8056608462126502
Energy: 0.9622223999520775
Energy: 0.8210438148611114
Energy: 0.9622223999538072
Energy: 0.8810071325818511
Energy: 0.8650493064081616
Energy: 0.8518726302687776
Energy: 0.8650493128679156
Energy: 0.924826913722687
Energy: 0.9479315330039791
Energy: 0.8296569186179547
Energy: 0.9479315330048439
Energy: 0.8342772929518661
Energy: 0.9478023392842599
Energy: 0.8827014860975267
Energy: 0.9478023392816652
Energy: 0.834053820988772
Energy: 0.8617275770233288
Energy: 0.8478189358729641
Energy: 0.8617275770241938
Energy: 0.8576137696238326
Energy: 0.9638501168594243
Energy: 0.9367728446228866
Energy: 0.9638501168620192
Energy: 0.8915136871498391
Energy: 0.9391932675668182
Energy: 0.8935932299172079
Energy: 0.9391932675659533
Energy: 0.952628061242549
Energy: 0.9650074829517412
Energy: 0.9029187948879519
Energy: 0.9650074829517412
Energy: 0.8915190917747756
Energy: 0.9390307507720396
Energy: 0.8936946011287644
Energy: 0.9390307507694449
Energy: 0.8575237632270717
Energy: 0.9643542944565408
Energy: 0.872568059582954
Energy: 0.9643542944582706
Energy: 0.8339361040315597
Energy: 0.8615748626817599
Energy: 0.8517276542734656
Energy: 0.8615748626843546

minimum gb energy = 0.8056608462126502 eV
minimum distance =  2.28158950139673 Angstroms
sigma value = 25


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

Energy: 0.9036412570434545
Energy: 1.0103012889357688
Energy: 0.9339037984176776
Energy: 1.0103012889357688
Energy: 0.9432287419171133
Energy: 0.9561693083673225
Energy: 0.8828179441361593
Energy: 0.9561693083663171
Energy: 0.9019612627286329
Energy: 1.0341924332400325
Energy: 0.8826596358194198
Energy: 1.0341924332400325
Energy: 0.8776040786752267
Energy: 0.9065521322994197
Energy: 0.8835801398792728
Energy: 0.906552131937644
Energy: 0.884115721651699
Energy: 1.0113574502551372
Energy: 1.013778160429391
Energy: 1.0113574502551372
Energy: 0.9802628254821676
Energy: 1.0329974176075234
Energy: 1.037246053866145
Energy: 1.0329974176075234
Energy: 0.9348253511471399
Energy: 0.8980381036630365
Energy: 0.9046388571120882
Energy: 0.898038103664042
Energy: 1.0362994530500549
Energy: 1.0141743257776616
Energy: 0.8508530184832434
Energy: 1.0141743257776616
Energy: 0.904471673665377
Energy: 0.9730936927153018
Energy: 0.9349421147292327
Energy: 0.9730936927153018
Energy: 0.8843248407333791
Energy: 1.0331585939579897
Energy: 0.8770114771022299
Energy: 1.0331585939579897
Energy: 0.9229403535847094
Energy: 1.011130408499835
Energy: 0.9119314759349337
Energy: 1.011130408499835
Energy: 0.9114271454799029
Energy: 1.0110212074295761
Energy: 0.911863685354203
Energy: 1.0110212074295761
Energy: 0.8823681963419562
Energy: 0.9694377817996644
Energy: 0.8764791788068265
Energy: 0.969437781798659
Energy: 0.9041985471498417
Energy: 0.8829591114190044
Energy: 0.9334883988116504
Energy: 0.8829591114190044
Energy: 0.8388479950821032
Energy: 1.0111389681110712
Energy: 0.8488274339642196
Energy: 1.0111389681110712
Energy: 0.93298520495621
Energy: 0.9002861831863198
Energy: 0.8841451722034239
Energy: 0.9002861831863198
Energy: 0.8368121758606464
Energy: 1.0338039681650815
Energy: 0.8365575520156582
Energy: 1.0338039681650815
Energy: 0.8832037598116664
Energy: 1.0216652583512456
Energy: 0.9270448839620529
Energy: 1.0216652583512456
Energy: 0.8616407337332169
Energy: 0.9747377031575329
Energy: 0.8843897382609676
Energy: 0.9747377031575329
Energy: 0.934457296666925
Energy: 1.032689146638245
Energy: 0.9019351593544066
Energy: 1.032689146638245
Energy: 0.9071413169453035
Energy: 0.9564016610728043
Energy: 0.9010795403642832
Energy: 0.9564016610738098
Energy: 0.9054542576135053
Energy: 1.0115099458273271
Energy: 0.9667700947258657
Energy: 1.0115099458273271
Energy: 0.9421306588658637
Energy: 0.9712743699412902
Energy: 0.9125286659430547
Energy: 0.9712743699412902
Energy: 1.058679595617368
Energy: 1.0369204785264057
Energy: 0.8844877757091478
Energy: 1.0369204785264057
Energy: 0.9132041933602173
Energy: 0.9071807285266372
Energy: 0.8838000301531149
Energy: 0.9071807285266372

minimum gb energy = 0.8365575520156582 eV
minimum distance =  2.2896351615489 Angstroms
sigma value = 9


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

Energy: 0.9478147421816776
Energy: 0.947340354386764
Energy: 0.9815190691762157
Energy: 0.9473403543879635
Energy: 0.9398295208605754
Energy: 1.0211864338756536
Energy: 0.9578231882653059
Energy: 1.0211864338756536
Energy: 0.9433236452573749
Energy: 0.9553554653322393
Energy: 0.903133598422974
Energy: 0.9553554653322393
Energy: 1.1246993256102182
Energy: 1.0267766935036702
Energy: 0.8910045886658545
Energy: 1.0267766935060418
Energy: 1.0460271926546616
Energy: 1.0067268487625272
Energy: 0.9218756724839247
Energy: 1.0067268487637266
Energy: 0.8613128919233838
Energy: 0.9560461485888039
Energy: 0.9614313424381933
Energy: 0.9560461485876044
Energy: 0.9602262776200606
Energy: 0.8909687575152135
Energy: 0.8918331234906769
Energy: 0.8909687575152135
Energy: 0.981388571394317
Energy: 0.9556969786925603
Energy: 0.8822987821248897
Energy: 0.9556969786937597
Energy: 0.9606261801352792
Energy: 1.0210139869206065
Energy: 0.9846750201645311
Energy: 1.021013986919407
Energy: 0.9469786508678852
Energy: 0.9485231419327427
Energy: 0.9610308083683851
Energy: 0.9485231419315432
Energy: 0.9114794304613208
Energy: 1.006630916440889
Energy: 0.903567618806749
Energy: 1.0066309164420886
Energy: 0.9624758445598838
Energy: 0.9476392220901105
Energy: 0.8908314595237101
Energy: 0.9476392220889112
Energy: 0.8612047859323262
Energy: 0.9473312266883409
Energy: 0.8612712473497094
Energy: 0.9473312266871415
Energy: 0.9375767335875256
Energy: 0.956324678892562
Energy: 0.9572106609875656
Energy: 0.956324678892562
Energy: 0.8613513092414754
Energy: 0.9472997839768401
Energy: 0.9815853096271316
Energy: 0.9472997839768401
Energy: 0.9624938049914947
Energy: 0.9474926553789509
Energy: 0.8908090305973783
Energy: 0.9474926553789509
Energy: 0.9114208698574688
Energy: 1.0064412419110182
Energy: 0.903313516635897
Energy: 1.0064412419110182
Energy: 0.9469744623535595
Energy: 0.9480500274639188
Energy: 0.9610884469973321
Energy: 0.9480500274651182
Energy: 0.9611951991164027
Energy: 1.0211430420854584
Energy: 0.9218357361558721
Energy: 1.021143042084259
Energy: 0.9814803468726013
Energy: 0.9556855864239774
Energy: 0.8827397160884325
Energy: 0.9556855864251769
Energy: 0.9601199449416582
Energy: 0.8908669428130894
Energy: 0.891808681478303
Energy: 0.8908669428118899

minimum gb energy = 0.8612047859323262 eV
minimum distance =  2.37942968530894 Angstroms
sigma value = 25


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

Energy: 0.910458568224693
Energy: 1.0315557514514484
Energy: 1.032113493894132
Energy: 1.0315557514514484
Energy: 0.8938278113374842
Energy: 1.0881228113332793
Energy: 0.8813232951163242
Energy: 1.0881228113332793
Energy: 0.8820017162545286
Energy: 1.0951339373310982
Energy: 0.8805757035470014
Energy: 1.0951339373310982
Energy: 0.909209362006451
Energy: 1.0851626694624283
Energy: 1.044871828980613
Energy: 1.0851626694624283
Energy: 1.0436168847207332
Energy: 0.8929824983543934
Energy: 0.920167769891435
Energy: 0.8929824983543934
Energy: 0.8807592827226141
Energy: 1.0958193110400714
Energy: 0.8821780008334322
Energy: 1.0958193110415546
Energy: 0.9674782981103649
Energy: 1.0203204264827164
Energy: 0.881083337096692
Energy: 1.0203204264841998
Energy: 1.0311951575790044
Energy: 1.0316039600731621
Energy: 0.9085628682788255
Energy: 1.0316039600657454
Energy: 0.8808140310479181
Energy: 1.023620117749796
Energy: 0.8946116062609033
Energy: 1.023620117749796
Energy: 1.0753880476540256
Energy: 1.0981586105713153
Energy: 0.8825148892177429
Energy: 1.0981586105727985
Energy: 0.9514868648435785
Energy: 1.082182276360327
Energy: 1.1916751338193678
Energy: 1.0821822763588438
Energy: 0.880805207792285
Energy: 0.9772083092659897
Energy: 1.0762638572543062
Energy: 0.9772083092659897
Energy: 1.0323815552106386
Energy: 1.0990406327410267
Energy: 0.8808651168969597
Energy: 1.0990406327410267
Energy: 0.8807168943527239
Energy: 1.082573563455781
Energy: 0.909711494288351
Energy: 1.082573563455781
Energy: 0.9679639341933638
Energy: 1.081209411428404
Energy: 1.0313698393529256
Energy: 1.081209411428404
Energy: 0.8929082298260823
Energy: 0.9775514851085576
Energy: 0.8808344763378376
Energy: 0.9775514808310898
Energy: 0.8813408745849464
Energy: 0.9700606666066921
Energy: 1.07488588724175
Energy: 0.9700606666081754

minimum gb energy = 0.8805757035470014 eV
minimum distance =  2.36140807893219 Angstroms
sigma value = 17


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

Energy: 0.989721274016682
Energy: 0.9897281705193336
Energy: 1.2084934303145376
Energy: 0.9897281705184936
Energy: 1.0494726459869557
Energy: 1.0070493418105664
Energy: 0.8996892713145215
Energy: 1.0070493418097262
Energy: 1.0624416888203858
Energy: 0.9830995433961277
Energy: 0.8994280957221147
Energy: 0.9830995433894071
Energy: 0.9012445707311706
Energy: 0.9893466539748902
Energy: 1.0392527487915284
Energy: 0.9893466539757303
Energy: 1.0952752796085181
Energy: 0.9742321296989687
Energy: 0.9252885502923452
Energy: 0.9742321296989687
Energy: 0.9127130768119724
Energy: 1.0002783963764836
Energy: 1.0458388128715297
Energy: 1.0002783963764836
Energy: 0.9017810960428045
Energy: 1.0072140741053062
Energy: 0.9587069598890464
Energy: 1.007214074104466
Energy: 1.0563130295203882
Energy: 0.9997029524898914
Energy: 0.9100965460564445
Energy: 0.9997029524898914
Energy: 0.9148809699980327
Energy: 1.0390747925244062
Energy: 1.0900240988193977
Energy: 1.0390747925244062
Energy: 1.1589351407113777
Energy: 0.9700096820247046
Energy: 0.900524694809715
Energy: 0.9700096820347857
Energy: 0.9041674939540678
Energy: 0.9903172429879968
Energy: 1.0485511484548564
Energy: 0.9903172429896769
Energy: 0.9130401842060797
Energy: 1.0057025341699581
Energy: 0.912608753362162
Energy: 1.0057025341699581
Energy: 1.0459302449439227
Energy: 0.9903295546689759
Energy: 0.9938569400673328
Energy: 0.990329554669816
Energy: 0.899399249584348
Energy: 1.021114741792664
Energy: 1.0520055824263732
Energy: 1.0211147417893036
Energy: 1.0125332943423855
Energy: 1.0428668637585086
Energy: 0.9125257601355855
Energy: 1.0428668637593488
Energy: 1.0524606307666915
Energy: 0.9999952184953407
Energy: 1.0568862336879008
Energy: 0.9999952184961807
Energy: 0.9585435604573579
Energy: 1.0403173402825328
Energy: 1.164907638688313
Energy: 1.0403173402816925
Energy: 1.0420208527449717
Energy: 0.9823413135209702
Energy: 0.9129596042956095
Energy: 0.9823413135209702
Energy: 0.9824881266281038
Energy: 1.0409604169416464
Energy: 0.9730207877502993
Energy: 1.040960416940806
Energy: 1.0045189409717283
Energy: 0.989215956101487
Energy: 0.9016872963122998
Energy: 0.989215956100647
Energy: 0.9798872154273827
Energy: 0.9828935406959796
Energy: 1.063023046350345
Energy: 0.9828935406951395
Energy: 0.9596553072205282
Energy: 1.134740549845847
Energy: 1.1830697343221344
Energy: 1.134740549845847
Energy: 1.0770701921231944
Energy: 0.9892585169212372
Energy: 0.899429469977555
Energy: 0.9892585169220773
Energy: 0.968421392345316
Energy: 1.0439522277413058
Energy: 1.0452852028869577
Energy: 1.0439522277404656
Energy: 1.008534904942302
Energy: 0.9827553763859067
Energy: 1.0431443383723409
Energy: 0.9827553763808662
Energy: 1.127247414407994
Energy: 0.9889906825094344
Energy: 0.9006743557932979
Energy: 0.9889906825085942
Energy: 0.9248702758884322
Energy: 1.0462325172413438
Energy: 1.2063331562047337
Energy: 1.0462325172413438
Energy: 1.0484449845879713
Energy: 0.9995257413820352
Energy: 1.0640275156243564
Energy: 0.9995257413820352
Energy: 1.1296266968905515
Energy: 1.0732987826843574
Energy: 0.9018759150404626
Energy: 1.0732987826843574
Energy: 0.9099509907293338
Energy: 1.0392998729324647
Energy: 1.107640017827781
Energy: 1.0392998729333047

minimum gb energy = 0.899399249584348 eV
minimum distance =  2.27613021980748 Angstroms
sigma value = 53


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

Energy: 0.8496133762359557
Energy: 0.8489168711226052
Energy: 1.063306431982386
Energy: 0.8489168711226052
Energy: 1.093405460649623
Energy: 0.960723787099459
Energy: 1.006703714096418
Energy: 0.960723787099459
Energy: 0.866909586241712
Energy: 0.8489025978147979
Energy: 1.0628660028762136
Energy: 0.8489025978147979
Energy: 0.8668128421594474
Energy: 0.8488523224089174
Energy: 0.9055165673461233
Energy: 0.8488523224089174
Energy: 1.0932372894649467
Energy: 0.9608870037814206
Energy: 0.9954208170917752
Energy: 0.9608870037814206
Energy: 0.8496133762359557
Energy: 0.8489168711226052
Energy: 1.179902698954711
Energy: 0.8489168711226052
Energy: 1.093405460649623
Energy: 0.9607237871013932
Energy: 1.0258993980965345
Energy: 0.960723787099459
Energy: 0.866909586241712
Energy: 0.8489025978147979
Energy: 1.0628660028762136
Energy: 0.8489025978147979
Energy: 0.8668128421594474
Energy: 0.8488523224069834
Energy: 0.9662111064667582
Energy: 0.8488523224089174
Energy: 1.0932372894649467
Energy: 0.9608870037814206
Energy: 1.0468778885582675
Energy: 0.9608870037794865
Energy: 0.8496133762378897
Energy: 0.8489168711226052
Energy: 1.2475542072777495
Energy: 0.8489168711226052
Energy: 1.093405460649623
Energy: 0.9607237871013932
Energy: 1.0258993980965345
Energy: 0.960723787099459
Energy: 0.866909586241712
Energy: 0.8489025978147979
Energy: 1.0628660028781476
Energy: 0.8489025978147979

minimum gb energy = 0.8488523224069834 eV
minimum distance =  2.3429333962927 Angstroms
sigma value = 9


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

Energy: 0.9868781336219098
Energy: 1.0995518348604065
Energy: 1.3281651172624986
Energy: 1.0995518348604065
Energy: 1.1461679048638145
Energy: 1.025454653537651
Energy: 0.9725007878468322
Energy: 1.025454653537651
Energy: 0.9499999864239602
Energy: 0.9357063293529099
Energy: 0.9390455302983061
Energy: 0.9357063293521941
Energy: 1.090561535843658
Energy: 1.1288376059168308
Energy: 0.9538426399378434
Energy: 1.1288376059175467
Energy: 1.1401015585885637
Energy: 1.0025374806158374
Energy: 0.9601271476523516
Energy: 1.0025374806172689
Energy: 0.9739824709857084
Energy: 0.9750669062984756
Energy: 1.1024193659905512
Energy: 0.9750669063042019
Energy: 1.2721103200251065
Energy: 0.9889679506105141
Energy: 0.9786983737379054
Energy: 0.9889679506119458
Energy: 0.9572233015326423
Energy: 1.1426902316934846
Energy: 1.0664589988512698
Energy: 1.1426902316949161
Energy: 0.9528419103392026
Energy: 1.1359687969221122
Energy: 0.9791281115577366
Energy: 1.135968796922828
Energy: 0.9878575488991098
Energy: 1.0064671893009336
Energy: 0.9953164260741755
Energy: 1.006467189299502
Energy: 0.9563898958757722
Energy: 1.0833578646802693
Energy: 1.2324703988514116
Energy: 1.0833578646809854
Energy: 1.1119273670330287
Energy: 1.058804343140797
Energy: 0.9543978585806687
Energy: 1.0588043431400813
Energy: 0.9490129782704756
Energy: 1.012706701548661
Energy: 1.175318906964292
Energy: 1.012706700647168
Energy: 1.095645218303765
Energy: 1.1635239771928785
Energy: 0.9520632205888132
Energy: 1.1635239771921626
Energy: 0.9588293626473915
Energy: 1.040906522122758
Energy: 1.106576822393248
Energy: 1.0409065221220422
Energy: 0.952202665382631
Energy: 1.1353684105887925
Energy: 1.0616793777828266
Energy: 1.1353684105873607
Energy: 1.0415926148474266
Energy: 1.1043908675895393
Energy: 0.9597450330263524
Energy: 1.1043908675895393
Energy: 0.9588064707556381
Energy: 0.9889835696081224
Energy: 1.1742072573448252
Energy: 0.9889835696081224
Energy: 1.1243469926157867
Energy: 1.052790908761096
Energy: 0.9763788469549914
Energy: 1.0527909087625276
Energy: 0.9522536742243983
Energy: 1.0092227716554758
Energy: 1.0769598314164732
Energy: 1.0092227716554758
Energy: 1.063002973147582
Energy: 1.1284845011493219
Energy: 1.0604465309078783
Energy: 1.1284845011486064
Energy: 1.0443478917255493
Energy: 0.943202639400696
Energy: 0.9513390181722242
Energy: 0.9432026393992644
Energy: 0.9805252522292534
Energy: 1.0317298590682837
Energy: 0.9899280227738093
Energy: 1.0317298590668522
Energy: 1.2598122671111422
Energy: 1.0506201839317302
Energy: 0.9547117786544946
Energy: 1.0506201839324458
Energy: 0.9558317184678004
Energy: 1.147230625383918
Energy: 1.2064077749352409
Energy: 1.147230625383918
Energy: 0.9863928857146927
Energy: 0.9356217799395924
Energy: 0.9470941686709075
Energy: 0.9356217799381606
Energy: 1.0730237265898919
Energy: 1.112339285719052
Energy: 1.0897475449246434
Energy: 1.1123392857211998
Energy: 0.9838600431766199
Energy: 1.096808503679801
Energy: 1.0925716374068637
Energy: 1.0968085036783695
Energy: 1.0145100099988917
Energy: 0.936108189396241
Energy: 0.9462251005429229
Energy: 0.9361081893976725
Energy: 0.9556644791389715
Energy: 1.0746391179449408
Energy: 1.1906368313429692
Energy: 1.0746391179456565
Energy: 1.1410293648004781
Energy: 1.01873975234387
Energy: 0.9538328757895379
Energy: 1.0187397523453017
Energy: 0.9733889959886317
Energy: 1.027414187850041
Energy: 0.9874675268128758
Energy: 1.0274141878521883
Energy: 0.9945011006751245
Energy: 1.064537201870468
Energy: 0.9504485707963887
Energy: 1.064537201869752
Energy: 1.060399442453704
Energy: 1.1300965244502423
Energy: 1.0586090993718258
Energy: 1.1300965244495262
Energy: 0.9631313189772325
Energy: 1.15938312321754
Energy: 1.2270516274824617
Energy: 1.1593831232161085

minimum gb energy = 0.9356217799381606 eV
minimum distance =  2.24188565776534 Angstroms
sigma value = 73


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

Energy: 1.0112587804041693
Energy: 1.009350440928762
Energy: 1.2737123471846703
Energy: 1.009350440928762
Energy: 1.0447883180396786
Energy: 1.0344453092582004
Energy: 0.9410697554853111
Energy: 1.0344453092582004
Energy: 0.9726714862090609
Energy: 0.9409121005886771
Energy: 0.9487230261663127
Energy: 0.9409121005875415
Energy: 0.96801877496669
Energy: 1.0893164006466274
Energy: 0.9791106510256911
Energy: 1.0893164006466274
Energy: 1.0361590331397434
Energy: 1.0363754465640962
Energy: 0.9827713784578773
Energy: 1.0363754465640962
Energy: 0.9815445799456058
Energy: 0.9659468896672818
Energy: 1.186084457000644
Energy: 0.9659468896684175
Energy: 1.246013364738582
Energy: 1.094514732142128
Energy: 0.9751588551104489
Energy: 1.094514732142128
Energy: 0.9633649243894657
Energy: 0.9397737272425483
Energy: 1.155437021636539
Energy: 0.9397737272436839
Energy: 1.2269659715466241
Energy: 0.9405514249114063
Energy: 0.9394115474002714
Energy: 0.9405514249125421
Energy: 0.9729167899600288
Energy: 1.0461624351269052
Energy: 0.973113422381528
Energy: 1.0461624351257695
Energy: 0.9616954439929288
Energy: 0.9403060307001297
Energy: 1.1728554990933795
Energy: 0.9403060307001297
Energy: 1.0855953755230159
Energy: 1.0881498134124872
Energy: 0.9685010346914209
Energy: 1.0881498134113514
Energy: 0.9799193360288059
Energy: 1.0155878847052313
Energy: 1.1508434472436726
Energy: 1.0155878847040956
Energy: 1.182776635237207
Energy: 1.0796288582811822
Energy: 0.9812545574377155
Energy: 1.0796288582811822
Energy: 0.964777630296175
Energy: 1.1204853862773645
Energy: 1.1569374701305752
Energy: 1.1204853862773645
Energy: 1.159048292753522
Energy: 0.9404018775966876
Energy: 0.9627574214425418
Energy: 0.9404018775966876
Energy: 1.028520698774035
Energy: 1.0104888230259919
Energy: 0.9727787270563504
Energy: 1.0104888230259919
Energy: 1.0102701656254427
Energy: 1.087148114690031
Energy: 0.980658974679696
Energy: 1.0871481146911668
Energy: 1.0827000629690267
Energy: 0.9398999282102907
Energy: 0.9621453344217833
Energy: 0.9398999282102907
Energy: 0.9736428350060485
Energy: 1.0575803010088063
Energy: 1.2011716586147554
Energy: 1.0575803010088063
Energy: 1.1966889282489175
Energy: 1.0177428823309944
Energy: 0.9808730096702145
Energy: 1.0177428823309944
Energy: 0.999857232114647
Energy: 1.0357074121941332
Energy: 1.0871385315485727
Energy: 1.0357074121941332

minimum gb energy = 0.9394115474002714 eV
minimum distance =  2.28683906763198 Angstroms
sigma value = 7


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

Energy: 0.9668942121990758
Energy: 0.9675808252459567
Energy: 1.310794849420071
Energy: 0.9675808252443507
Energy: 1.2036934160614834
Energy: 1.0464323103944908
Energy: 0.9863375524557587
Energy: 1.0464323103936877
Energy: 0.968838722589958
Energy: 1.112507339757698
Energy: 0.9686502543142715
Energy: 1.112507339756895
Energy: 1.030224425834924
Energy: 1.0342044173220473
Energy: 0.9923402459734887
Energy: 1.0342044173228502
Energy: 0.9701788256294808
Energy: 1.029372032324729
Energy: 0.966537296716244
Energy: 1.0293720323263351
Energy: 0.971893285052652
Energy: 0.9662493467232217
Energy: 1.1926462433093885
Energy: 0.9662493467224186
Energy: 1.0717059579931123
Energy: 1.1080731066897942
Energy: 1.0159850297148343
Energy: 1.1080731066930067
Energy: 0.971968095856325
Energy: 1.0640578914286567
Energy: 1.2929581446864924
Energy: 1.0640578914278538
Energy: 1.113078798272426
Energy: 1.0240387417910837
Energy: 0.9809586735640197
Energy: 1.0240387417950991
Energy: 0.9841960157235085
Energy: 1.0643256506306442
Energy: 1.0678184142933718
Energy: 1.064325650629038
Energy: 0.9991410539146989
Energy: 1.1111407172693906
Energy: 1.0285898231925659
Energy: 1.1111407172685874
Energy: 0.9700765530331533
Energy: 1.029169561639349
Energy: 1.0288341229504923
Energy: 1.0291695616369396
Energy: 0.9658796476923082
Energy: 0.9674880574210978
Energy: 1.0320207664347159
Energy: 0.967488057423507
Energy: 0.9691661662172885
Energy: 0.9607720811225062
Energy: 1.0288236664629666
Energy: 0.960772081121703
Energy: 0.9773192527444176
Energy: 1.1395533377762292
Energy: 1.1005504793813143
Energy: 1.139553337777032
Energy: 1.3310785011775776
Energy: 0.9596895849278715
Energy: 0.9785556740417188
Energy: 0.959689584927105
Energy: 0.9867187028704807
Energy: 1.040096327189167
Energy: 1.1006516165512954
Energy: 1.0400963271883639
Energy: 0.9670406261541225
Energy: 1.0110035792039278
Energy: 1.0286090562504662
Energy: 1.0110035792031247
Energy: 0.9866741269121849
Energy: 1.1116153058662408
Energy: 1.0278397565633284
Energy: 1.1116153058678468
Energy: 0.9788652584168204
Energy: 1.0286748997009334
Energy: 1.028628147629612
Energy: 1.0286748997001305
Energy: 1.001951977699199
Energy: 1.1126218582228893
Energy: 0.9809108748178147
Energy: 1.1126218582236922
Energy: 0.9724100026263465
Energy: 1.1189325422915328
Energy: 1.062227558883735
Energy: 1.1189325422947451
Energy: 1.198673317932731
Energy: 1.053069634693042
Energy: 1.0155694341818988
Energy: 1.0530696346906327
Energy: 0.9706788164129029
Energy: 0.9667116710188914
Energy: 1.1927748490892323
Energy: 0.9667116710221036
Energy: 1.0122388302170744
Energy: 1.0283895386234139
Energy: 1.0008438985182877
Energy: 1.0283895386210047
Energy: 1.0286416294238232
Energy: 1.1099401229751034
Energy: 0.9960992744453975
Energy: 1.1099401229783155
Energy: 0.9697663234580294
Energy: 1.0352034763138702
Energy: 1.0525217017540127
Energy: 1.0352034763162794
Energy: 1.0292732861074154
Energy: 1.0397137432980814
Energy: 0.9924845393875764
Energy: 1.0397137432964756
Energy: 0.968250784362382
Energy: 0.9660196197767398
Energy: 1.1063758852495984
Energy: 0.9660196197735276
Energy: 0.9702886003719946
Energy: 0.9994764791078119
Energy: 0.9862093714103768
Energy: 0.9994764791054026
Energy: 0.9681746028570484
Energy: 0.9681416638766613
Energy: 1.2042365752250448
Energy: 0.9681416638782675

minimum gb energy = 0.959689584927105 eV
minimum distance =  2.28614834883437 Angstroms
sigma value = 29


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

Energy: 0.9270855385460202
Energy: 0.9105801021895032
Energy: 0.8919919660415807
Energy: 0.9105801021897829
Energy: 0.8920712891207507
Energy: 0.9281704389786821
Energy: 0.9246615636254841
Energy: 0.9281704389792418
Energy: 0.8913248531469102
Energy: 0.9767356574097736
Energy: 0.8928205925359425
Energy: 0.9767356574100533
Energy: 0.9250685922458048
Energy: 0.8919963956368419
Energy: 0.9249931659033267
Energy: 0.8919963956557078
Energy: 0.9272936800413987
Energy: 0.9564081728660104
Energy: 0.8917197658926455
Energy: 0.9564081728660104
Energy: 0.9108020036673805
Energy: 0.9785879216440662
Energy: 0.910785851528805
Energy: 0.9785879216440662
Energy: 0.8914326790285395
Energy: 0.9561851968637788
Energy: 0.9272746933606886
Energy: 0.9561851968637788
Energy: 0.9247969940504045
Energy: 0.8921771362500149
Energy: 0.9249063678104389
Energy: 0.8921771362497353
Energy: 0.8926084920729012
Energy: 0.9768828456357758
Energy: 0.891324715452124
Energy: 0.9768828456357758

minimum gb energy = 0.891324715452124 eV
minimum distance =  2.32742240608609 Angstroms
sigma value = 5


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

Energy: 0.9167346416878549
Energy: 0.9268083516637118
Energy: 1.120826448923893
Energy: 0.9268083516629532
Energy: 1.0692649795684805
Energy: 0.9046497170222787
Energy: 0.9187161090561738
Energy: 0.9046497170237959
Energy: 0.8978016994451229
Energy: 1.0095563275980746
Energy: 1.060365513466422
Energy: 1.0095563275980746
Energy: 0.9218501775831703
Energy: 0.972720492950256
Energy: 0.9021646047053712
Energy: 0.972720492950256
Energy: 0.9036825731230675
Energy: 0.9763704477973908
Energy: 1.0508572223188988
Energy: 0.9763704477973908
Energy: 0.9649531145514962
Energy: 0.9290634678407806
Energy: 0.8964920380168142
Energy: 0.9290634678400221
Energy: 0.8983527414097723
Energy: 0.9751728304620435
Energy: 0.8936221802586387
Energy: 0.9751728304612849
Energy: 0.8973344172604261
Energy: 0.9289648844329634
Energy: 0.9001628641108028
Energy: 0.9289648844329634
Energy: 0.9022166398165504
Energy: 0.9753567354974954
Energy: 0.8988730392065513
Energy: 0.9753567354967367
Energy: 0.9009437512402992
Energy: 0.9756377801756055
Energy: 0.8949508739898477
Energy: 0.9756377801756055
Energy: 0.9535424126384097
Energy: 0.9721470756971776
Energy: 0.8990415060056357
Energy: 0.9721470756964189
Energy: 0.9152136533743933
Energy: 0.9138505260303309
Energy: 0.9277780963165466
Energy: 0.9138505260546053
Energy: 0.9650509606119969
Energy: 0.928294040174393
Energy: 0.9228701800178831
Energy: 0.9282940401751515
Energy: 0.9109359218672011
Energy: 0.9276739615996975
Energy: 1.0030653686342603
Energy: 0.9276739615989388
Energy: 1.0957079517254702
Energy: 0.9972097845409774
Energy: 0.8994888910804969
Energy: 0.9972097845409774
Energy: 0.9012418189050383
Energy: 0.9217704994833673
Energy: 0.9212614168565196
Energy: 0.9217704994841259
Energy: 1.0461439498459937
Energy: 0.9146184459526607
Energy: 0.9239870355998892
Energy: 0.9146184459534195
Energy: 0.9040764366765311
Energy: 1.0135605794933837
Energy: 1.003832989961903
Energy: 1.013560579492625
Energy: 0.9143410018362025
Energy: 0.9773185790959084
Energy: 0.8931517586125639
Energy: 0.9773185790959084
Energy: 0.898479664307025
Energy: 1.0230936916270248
Energy: 0.9093258427459676
Energy: 1.023093691626266
Energy: 0.9187254051671224
Energy: 0.9701016733301385
Energy: 0.9053571443951215
Energy: 0.9701016733301385
Energy: 0.9028675500025628
Energy: 0.9753998365724438
Energy: 0.8964800965752218
Energy: 0.9753998365724438
Energy: 0.9165918939709934
Energy: 0.9285284263317982
Energy: 0.9194514047950499
Energy: 0.9285284263317982
Energy: 0.9266601896155937
Energy: 0.9305546424615598
Energy: 0.8989498685850004
Energy: 0.9305546424615598
Energy: 0.9339824390110102
Energy: 0.9201939603396668
Energy: 0.9168722193919115
Energy: 0.9201939603396668
Energy: 0.9151761392010693
Energy: 0.9274529969308735
Energy: 0.9046543633216618
Energy: 0.9274529969323906
Energy: 0.9000594913370649
Energy: 0.893430758899712
Energy: 0.952248992843361
Energy: 0.8934307589004362
Energy: 0.9394474154425474
Energy: 0.977408690679327
Energy: 0.9009881310802701
Energy: 0.9774086906778098
Energy: 0.905066920116019
Energy: 0.9042356092428722
Energy: 1.2015978137273873
Energy: 0.9042356092443893
Energy: 1.0491966705271007
Energy: 1.0147415449989663
Energy: 0.9042613093334347
Energy: 1.0147415449989663
Energy: 0.8967921022592972
Energy: 0.9102580271411289
Energy: 1.0477260355460958
Energy: 0.9102580271403703
Energy: 1.0442268351781345
Energy: 0.9694977515468348
Energy: 0.8989998587577656
Energy: 0.9694977515468348
Energy: 0.9031733146395191
Energy: 0.9731454889442883
Energy: 0.8960257248631799
Energy: 0.9731454889442883

minimum gb energy = 0.8931517586125639 eV
minimum distance =  2.29240705932073 Angstroms
sigma value = 1


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

Energy: 0.9864471037188345
Energy: 0.9861939753159493
Energy: 1.1082887079350043
Energy: 0.9861939753159493
Energy: 0.9640690207969786
Energy: 0.8551338369526877
Energy: 0.8705257223887384
Energy: 0.8551338369526877
Energy: 0.8647369648727943
Energy: 1.0121533252777566
Energy: 1.0053122875232243
Energy: 1.0121533252767074
Energy: 0.8806160304786759
Energy: 0.9498177444315321
Energy: 0.8759406664459375
Energy: 0.9498177444304833
Energy: 0.8586926812905622
Energy: 0.8853811337316014
Energy: 1.0667067285888436
Energy: 0.8853811337316014
Energy: 0.8556486478615083
Energy: 1.054130230500279
Energy: 0.8760427852536863
Energy: 1.0541302304992304
Energy: 0.8626560790725646
Energy: 0.983285152459518
Energy: 0.9248065623575809
Energy: 0.983285152459518
Energy: 0.8625256720483565
Energy: 0.8937053665622252
Energy: 0.9093474167724527
Energy: 0.8937053665622252
Energy: 0.8896830836820199
Energy: 0.8946721641742535
Energy: 0.8931932170908982
Energy: 0.8946721641742535
Energy: 0.8898869603856301
Energy: 0.8896052627472899
Energy: 0.8775223013007999
Energy: 0.8896052627483387
Energy: 0.8629595197514768
Energy: 0.8937173599054958
Energy: 0.9071517724765976
Energy: 0.8937173599054958
Energy: 0.8626892706991249
Energy: 0.9763520842720932
Energy: 0.8826733782318427
Energy: 0.9763520842710443
Energy: 0.8543283138791747
Energy: 0.9525115902058388
Energy: 0.8780474907653373
Energy: 0.9525115902058388
Energy: 0.8543619237218093
Energy: 0.8917400410822723
Energy: 0.8901865368828134
Energy: 0.8917400410822723
Energy: 0.9020856595974325
Energy: 0.9495237832566876
Energy: 0.8782218823078533
Energy: 0.9495237832566876
Energy: 0.8647709935857061
Energy: 0.9534797600854794
Energy: 0.9045422365497624
Energy: 0.9534797600854794
Energy: 1.1980715410199185
Energy: 0.8556520855573777
Energy: 0.8699651577876141
Energy: 0.8556520855563287
Energy: 0.9864471037188345
Energy: 0.9861939753159493
Energy: 1.1150671709327304
Energy: 0.986193975316998
Energy: 0.964069020777074
Energy: 0.8551338369526877
Energy: 0.8705257223887384
Energy: 0.8551338369526877
Energy: 0.8647369648727943
Energy: 1.0121533252777566
Energy: 1.0053122875232243
Energy: 1.0121533252777566
Energy: 0.8806160304786759
Energy: 0.9498177444315321
Energy: 0.8759406664459375
Energy: 0.9498177444304833
Energy: 0.858692681291611
Energy: 0.8853811337326505
Energy: 1.0667067285888436
Energy: 0.8853811337316014
Energy: 0.8556486478625573
Energy: 1.054130230500279
Energy: 0.8760427852526373
Energy: 1.0541302304992304
Energy: 0.8626560790725646
Energy: 0.983285152459518
Energy: 0.9416033913216539
Energy: 0.983285152459518

minimum gb energy = 0.8543283138791747 eV
minimum distance =  2.29666742709884 Angstroms
sigma value = 17


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

Energy: 0.8867115680812306
Energy: 0.8863827620156131
Energy: 1.176412845213142
Energy: 0.8863827620149648
Energy: 0.9979074494664977
Energy: 0.8757735297579324
Energy: 0.8625476285088782
Energy: 0.8757735297579324
Energy: 0.8603586465283147
Energy: 0.9550348036671664
Energy: 1.0528344463353252
Energy: 0.9550348036678147
Energy: 0.9454449265775399
Energy: 0.8535680577915917
Energy: 0.8591457494224434
Energy: 0.8535680577922401
Energy: 0.8556545512643655
Energy: 0.882707082288964
Energy: 1.0754039836362859
Energy: 0.8827070822883156
Energy: 0.8557378988732998
Energy: 0.9895440898768109
Energy: 0.8695632556517285
Energy: 0.9895440885361106
Energy: 0.8728934991851273
Energy: 0.9312629332713214
Energy: 0.8771222073098514
Energy: 0.9312629332726179
Energy: 0.8533815338962829
Energy: 0.9237779126806204
Energy: 0.8579356152393156
Energy: 0.9237779126806204
Energy: 0.8863319976142064
Energy: 0.9223528589854254
Energy: 0.8943540122747377
Energy: 0.9223528589854254
Energy: 0.8890624860356625
Energy: 0.9196082025025845
Energy: 0.8632788892144299
Energy: 0.9196082025045292
Energy: 0.8622699368118417
Energy: 0.9044075700263101
Energy: 0.8595979370022658
Energy: 0.9044075700263101
Energy: 0.8598825829471385
Energy: 0.9247440230467432
Energy: 0.8619703624259855
Energy: 0.9247440230486879
Energy: 0.8549395345996946
Energy: 0.9144702943384891
Energy: 0.8613843603539157
Energy: 0.9144702943410823
Energy: 0.8666241366486187
Energy: 0.9431046381589656
Energy: 0.8859118038852977
Energy: 0.9431046381589656
Energy: 0.8616845007789058
Energy: 0.8575124380069226
Energy: 0.893792095223235
Energy: 0.8575124380088675
Energy: 0.8643388234954407
Energy: 0.8777832423456208
Energy: 1.0731717398847558
Energy: 0.8777832423443243
Energy: 0.8920374379232291
Energy: 0.8577115187118444
Energy: 0.8611193419131568
Energy: 0.8577115187098995
Energy: 0.8554403864748954
Energy: 0.9633241535051431
Energy: 1.0206361337419683
Energy: 0.9633241535044949
Energy: 0.9876334173894901
Energy: 0.8624294614570267
Energy: 0.8624776665728309
Energy: 0.8624294614563784
Energy: 0.8655815242267372
Energy: 0.8770824588861349
Energy: 0.9107815577511886
Energy: 0.8770824588867832
Energy: 0.963788159787257
Energy: 0.8710608384949056
Energy: 0.8718908685920781
Energy: 0.8710608384962022
Energy: 0.8722850349904787
Energy: 0.964930216429203
Energy: 1.0194558019487048
Energy: 0.9649302164298512
Energy: 0.8895319012397601
Energy: 0.862826897321489
Energy: 0.8667951544978036
Energy: 0.8628268973201924
Energy: 0.8624791865465498
Energy: 0.8712231805641898
Energy: 0.9970935993841565
Energy: 0.8712231805654864
Energy: 0.9129212935046181
Energy: 0.9637082361533428
Energy: 0.856947804359527
Energy: 0.9637082361546394
Energy: 0.8634065481885694
Energy: 0.944478626852152
Energy: 0.9063659038039976
Energy: 0.9444786268528004
Energy: 0.9852241544686287
Energy: 0.9148301346350275
Energy: 0.859126776133619
Energy: 0.9148301346363241
Energy: 0.8973139712895667
Energy: 1.0456401994982103
Energy: 0.8612214035398162
Energy: 1.0456401994969138
Energy: 0.9011122155793344
Energy: 0.942407141053448
Energy: 0.8704839091996727
Energy: 0.9424071410540963
Energy: 0.8645835920559057
Energy: 0.9132291893317368
Energy: 0.9102512995203655
Energy: 0.9132291893317368
Energy: 0.8593767441217842
Energy: 0.9420290017905171
Energy: 0.8625798592207661
Energy: 0.9420290017918137
Energy: 0.8614894006624542
Energy: 0.9061586526441411
Energy: 0.8611303412349653
Energy: 0.9061586526447893
Energy: 0.8598713496123638
Energy: 0.9197276038455752
Energy: 1.002959777148716
Energy: 0.9197276038449268
Energy: 0.9339256838364149
Energy: 1.0555998361361671
Energy: 0.8699268413632336
Energy: 1.0555998361368155
Energy: 0.8572109240386714
Energy: 0.8877575441825758
Energy: 0.8880232184022732
Energy: 0.887757544183224
Energy: 0.9075657758311603
Energy: 0.9326418274329308
Energy: 0.8749255343983405
Energy: 0.9326418274335792
Energy: 0.8667670129920194
Energy: 0.9843463781793919
Energy: 0.8584432349423263
Energy: 0.9843463781748538
Energy: 1.0776294388754826
Energy: 0.8827372921252575
Energy: 0.8644997243659355
Energy: 0.8827372921252575

minimum gb energy = 0.8533815338962829 eV
minimum distance =  2.29277705866849 Angstroms
sigma value = 89


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

Energy: 0.7876438359576804
Energy: 0.7877679592323366
Energy: 1.1018368523083655
Energy: 0.7877679592306401
Energy: 0.796866433321843
Energy: 0.8096976441390153
Energy: 0.7983295356014121
Energy: 0.8096976441390153
Energy: 0.7965983159040305
Energy: 0.8443631044681302
Energy: 1.3340223072758004
Energy: 0.8443631044681302
Energy: 0.7882658732748763
Energy: 0.809649019516176
Energy: 0.7981622637817033
Energy: 0.809649019516176
Energy: 0.7961035703139615
Energy: 0.7870653402774143
Energy: 1.2557649026292956
Energy: 0.7870653402774143
Energy: 0.7959514160932758
Energy: 0.7880769113695012
Energy: 0.7898581912113676
Energy: 0.7880769113695012
Energy: 0.7965722407425393
Energy: 0.9285235080807864
Energy: 0.7873406582297701
Energy: 0.9285235080807864
Energy: 0.8057000993403538
Energy: 0.9283713097589833
Energy: 0.7980749096416166
Energy: 0.9283713097589833
Energy: 0.7960467452272629
Energy: 0.8717897853208171
Energy: 0.7898479348686803
Energy: 0.8717897853208171
Energy: 0.8097892581861974
Energy: 0.7883956583008896
Energy: 0.7962071222192303
Energy: 0.7883956583076747
Energy: 0.7870987262931667
Energy: 0.8104089622762254
Energy: 0.7961758899131655
Energy: 0.8104089622762254
Energy: 0.7873884584478428
Energy: 0.9287921870600095
Energy: 0.7982969791768879
Energy: 0.9287921870600095
Energy: 0.7959759075312137
Energy: 0.8703500117059298
Energy: 0.8030579875546018
Energy: 0.8703500117059298
Energy: 0.7959441901129717
Energy: 0.8694086248840035
Energy: 0.7958969893638271
Energy: 0.8694086248840035
Energy: 0.7902010593830584
Energy: 0.8703716549234225
Energy: 0.795986938006078
Energy: 0.8703716549234225

minimum gb energy = 0.7870653402774143 eV
minimum distance =  2.31587037470452 Angstroms
sigma value = 13


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

Energy: 0.7832703399387565
Energy: 0.9890046844894548
Energy: 0.9104997345115681
Energy: 0.9890046844894548
Energy: 0.8835430659000723
Energy: 1.0038243055879028
Energy: 0.7560449203517535
Energy: 1.003824305582926
Energy: 0.7594100586888175
Energy: 1.013243176229667
Energy: 1.160456167778448
Energy: 1.0132431762289558
Energy: 0.7704718829227353
Energy: 0.88805880998553
Energy: 0.7519627632170641
Energy: 0.8880588099954188
Energy: 0.767615499465478
Energy: 0.934132915640721
Energy: 0.7887988674582735
Energy: 0.9341329156400102
Energy: 0.7691981166635209
Energy: 0.7746476083048315
Energy: 0.7675624582077696
Energy: 0.7746476083041204
Energy: 0.7665736061368089
Energy: 0.7701696686880809
Energy: 0.9860387639621034
Energy: 0.7701696686880809
Energy: 0.7572468217662911
Energy: 0.8890192644113478
Energy: 0.7676462810566357
Energy: 0.8890192644043028
Energy: 0.7633785378320471
Energy: 0.9339361492003927
Energy: 0.8764320605457433
Energy: 0.9339361492011038
Energy: 0.9171340306484342
Energy: 0.9466305232084278
Energy: 0.7523067312176
Energy: 0.9466305232062949
Energy: 0.7632259250206349
Energy: 0.8353544460019617
Energy: 0.7783342889141498
Energy: 0.8353544460048056
Energy: 0.9864599109434411
Energy: 1.043392762719555
Energy: 0.7573126479121147
Energy: 1.0433927627216877
Energy: 0.7918097050591203
Energy: 0.7700944508793232
Energy: 0.7705301722101765
Energy: 0.7700944508793232
Energy: 1.0153727734148776
Energy: 0.8344634544145199
Energy: 0.7574194752726633
Energy: 0.834463454412387
Energy: 0.7672279588662986
Energy: 0.7584745679390582
Energy: 0.7774066589677493
Energy: 0.7584745679390582
Energy: 0.7569433580569717
Energy: 0.8346747594905214
Energy: 0.7593858795291587
Energy: 0.8346747594912324
Energy: 0.766300308681703
Energy: 0.81489143689906
Energy: 0.7595041462483682
Energy: 0.814891436896927
Energy: 0.7815949231703747
Energy: 0.8181387575142742
Energy: 0.7759567771202979
Energy: 0.8181387575149852
Energy: 0.7660886014280525
Energy: 0.7705553152874566
Energy: 0.7756071732921898
Energy: 0.7705553152888786
Energy: 0.7659705925929281
Energy: 0.7704667571837845
Energy: 0.7756230024141372
Energy: 0.7704667571809407
Energy: 0.7817287734023165
Energy: 0.8180570844179877
Energy: 0.7759185826542552
Energy: 0.8180570844165659
Energy: 0.7659898296951205
Energy: 0.8147190863390068
Energy: 0.7593562583590875
Energy: 0.814719086336874
Energy: 0.755957904656191
Energy: 0.8349280423673489
Energy: 0.7594590218583867
Energy: 0.8349280423701925
Energy: 0.7633484196134043
Energy: 0.7583178851854825
Energy: 0.7728366974748795
Energy: 0.7583178851840605
Energy: 1.0158955067886086
Energy: 0.8345340919423013
Energy: 0.7574177974049101
Energy: 0.8345340919408795
Energy: 0.7917038023535293
Energy: 0.7703748245077
Energy: 0.7724496167302243
Energy: 0.7703748245098329
Energy: 0.9865900251718743
Energy: 1.0433968144850945
Energy: 0.7574437059585452
Energy: 1.0433968144829617
Energy: 0.7630457200223897
Energy: 0.8350318223615398
Energy: 0.7521560561137299
Energy: 0.8350318223608288
Energy: 0.917168444243406
Energy: 0.9465703021977984
Energy: 0.7522825341157378
Energy: 0.9465703021992202
Energy: 0.7648117537487144
Energy: 0.9333420275839873
Energy: 0.8767485213012571
Energy: 0.9333420275861202
Energy: 0.7572923506918309
Energy: 0.8889017927459673
Energy: 0.7676443549055129
Energy: 0.8889017927466781
Energy: 0.762986485360674
Energy: 0.8837652952402254
Energy: 1.0182554932453776
Energy: 0.8837652952423583
Energy: 0.7688482555247439
Energy: 0.7746348194556064
Energy: 0.7675832138626097
Energy: 0.7746348194584503
Energy: 0.7673973643058957
Energy: 0.9334699917592368
Energy: 0.9978767640401851
Energy: 0.9334699917613697
Energy: 0.7697066755330697
Energy: 0.888052303782875
Energy: 0.75198139988073
Energy: 0.8880523037864297

minimum gb energy = 0.7519627632170641 eV
minimum distance =  2.28689306674338 Angstroms
sigma value = 37


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

Energy: 0.822694906083987
Energy: 0.8214917722177046
Energy: 0.7112379393224323
Energy: 0.8214917722177046
Energy: 0.8567012055806961
Energy: 0.7141879365846138
Energy: 0.6950250919340798
Energy: 0.7141879365846138
Energy: 0.7104652320641389
Energy: 0.9935774581806243
Energy: 0.9850481828690804
Energy: 0.9935774581818475
Energy: 0.7908505290387055
Energy: 0.8083320100018642
Energy: 0.698398927773714
Energy: 0.8083320100018642
Energy: 0.6972556572615363
Energy: 0.7140999559944495
Energy: 0.7479887181690108
Energy: 0.7140999559956727
Energy: 0.7147224947720424
Energy: 0.8080284982642566
Energy: 0.7883869583456136
Energy: 0.8080284982642566
Energy: 0.7052966593607806
Energy: 1.1147075761219483
Energy: 0.9990499555249229
Energy: 1.1147075761207255
Energy: 0.6873541582363774
Energy: 0.7149150886407628
Energy: 0.7160851606033545
Energy: 0.7149150886407628
Energy: 0.69563549819956
Energy: 0.7140791542023036
Energy: 0.8946472961145876
Energy: 0.7140791542023036
Energy: 0.9859762262303747
Energy: 0.9920877513721003
Energy: 0.7883121704175878
Energy: 0.9920877513721003
Energy: 0.7089241543029039
Energy: 0.8631713857223464
Energy: 0.7865528281502262
Energy: 0.8631713857223464
Energy: 0.9377856184355616
Energy: 0.7146267478267743
Energy: 0.697814619698386
Energy: 0.7146267478255511
Energy: 0.7911705166909584
Energy: 0.8087314398842825
Energy: 0.7841775869595444
Energy: 0.8087314398830593
Energy: 0.996117748336855
Energy: 0.7462357595638986
Energy: 0.6871577881345088
Energy: 0.7462357595638986
Energy: 0.8209636973771754
Energy: 0.8373269865352575
Energy: 0.6874870733446151
Energy: 0.8373269865352575
Energy: 0.8214577220213959
Energy: 0.7144695491961639
Energy: 0.6942464453628063
Energy: 0.7144695491961639
Energy: 0.7911241180690488
Energy: 0.8074764143335758
Energy: 0.6954170726294164
Energy: 0.8074764143323526
Energy: 0.7861205626749171
Energy: 0.7713443112895768
Energy: 0.6964122569580922
Energy: 0.7713443112895768
Energy: 0.6973111917157969
Energy: 0.7160437880100745
Energy: 0.6968018672011473
Energy: 0.7160437880100745
Energy: 0.6939092919491018
Energy: 0.7142627033257127
Energy: 0.7858402944866055
Energy: 0.7142627033269359

minimum gb energy = 0.6871577881345088 eV
minimum distance =  2.33306123082507 Angstroms
sigma value = 25


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

Energy: 0.7396207349117097
Energy: 0.6367160605161187
Energy: 0.7877624978102457
Energy: 0.6367160605170739
Energy: 1.0067738606934205
Energy: 0.78010980068172
Energy: 0.6283775880328198
Energy: 0.7801098006798096
Energy: 0.701999457409879
Energy: 0.7028952872864792
Energy: 0.8512930288875346
Energy: 0.7028952872864792
Energy: 0.8522046296352991
Energy: 0.8648508453643174
Energy: 0.6295748267768907
Energy: 0.8648508453643174
Energy: 0.6367507291064025
Energy: 0.7806719574609081
Energy: 0.6552791444601123
Energy: 0.7806719574618632
Energy: 0.6884111221222383
Energy: 0.7757189187053224
Energy: 0.6365496348271138
Energy: 0.7757189187043674
Energy: 0.6282563114880222
Energy: 0.6229914583867103
Energy: 0.7369607689654137
Energy: 0.6229914583867103
Energy: 0.6253178650105412
Energy: 0.8686997045397354
Energy: 0.7031136313112284
Energy: 0.8686997045387804
Energy: 0.6273459411650305
Energy: 0.8536520572034704
Energy: 0.9956961827827647
Energy: 0.8536520572053805
Energy: 0.6143133520920795
Energy: 0.6962961323735853
Energy: 0.6601961202593594
Energy: 0.6962961323716751
Energy: 0.627894592398582
Energy: 0.6229992960609241
Energy: 0.936635098868129
Energy: 0.6229992960609241
Energy: 0.8509227154804827
Energy: 0.975494426429252
Energy: 0.703320749146422
Energy: 0.9754944264302071
Energy: 0.631033019289486
Energy: 0.6508252923661182
Energy: 0.8520726723173293
Energy: 0.6508252923642078
Energy: 0.8326792540320106
Energy: 0.6971016950900796
Energy: 0.6365711830378541
Energy: 0.6971016950919897
Energy: 0.6387544783618153
Energy: 0.6235180175341629
Energy: 0.6888433854094632
Energy: 0.6235180175351179
Energy: 0.9046633938374611
Energy: 0.8693039059268435
Energy: 0.6272190559715689
Energy: 0.8693039059277986
Energy: 0.7064664538628813
Energy: 0.7282920842106813
Energy: 0.6913385154546712
Energy: 0.7282920842106813
Energy: 0.8586955407853107
Energy: 0.6393954582520768
Energy: 0.6288439802805482
Energy: 0.6393954582520768
Energy: 0.7442735377414884
Energy: 0.6335170562109189
Energy: 0.6122505428908378
Energy: 0.6335170562109189
Energy: 1.0087637036009234
Energy: 0.8706708645038969
Energy: 0.627033313748613
Energy: 0.8706708645038969
Energy: 0.7066322992972299
Energy: 0.8692745231599736
Energy: 0.6156434086167375
Energy: 0.8692745231561531
Energy: 0.7017928061986203
Energy: 0.6513061630182657
Energy: 0.6319773968424913
Energy: 0.6513061630192208
Energy: 0.6392802288903775
Energy: 0.6950451266044095
Energy: 0.8354758031886503
Energy: 0.6950451266053647
Energy: 0.6853622723191816
Energy: 0.8030434230398948
Energy: 0.6351933358095805
Energy: 0.8030434230408501
Energy: 0.6265563207582776
Energy: 0.8015372837350071
Energy: 0.9037747273642346
Energy: 0.8015372837330967
Energy: 0.613560641563453
Energy: 0.7287155361504395
Energy: 0.7074611178342384
Energy: 0.7287155361418433

minimum gb energy = 0.6122505428908378 eV
minimum distance =  2.29661657831246 Angstroms
sigma value = 41


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

Energy: 0.8089789341148724
Energy: 0.8100902052338741
Energy: 1.021263056704304
Energy: 0.8100902052338741
Energy: 1.0701933245084794
Energy: 0.6856892749291458
Energy: 0.5626674275803057
Energy: 0.6856892750590973
Energy: 0.5791014492676244
Energy: 0.5610432272194535
Energy: 1.0269391090110436
Energy: 0.5610432272202367
Energy: 0.8173887952664896
Energy: 0.6856616587765064
Energy: 0.562622851269003
Energy: 0.6856616587765064
Energy: 0.559181279834364
Energy: 0.8213071505937576
Energy: 0.5618780815429467
Energy: 0.8213071505929744
Energy: 0.6873945579083908
Energy: 0.6844040172529962
Energy: 0.5627534215125825
Energy: 0.6844040172529962
Energy: 0.5620051508246482
Energy: 0.6878355168780071
Energy: 0.591461792411524
Energy: 0.6878355168772241
Energy: 0.5540911312720965
Energy: 0.6975956161337608
Energy: 0.559885423280567
Energy: 0.6975956161282795
Energy: 0.564650519417576
Energy: 0.69466068326394
Energy: 0.7130775076660011
Energy: 0.69466068326394
Energy: 0.5530790884886785
Energy: 0.5609953301935832
Energy: 0.5800485158942273
Energy: 0.5609953301928
Energy: 0.5622251702866933
Energy: 0.5690017317836825
Energy: 0.9500766968761538
Energy: 0.5690017317836825
Energy: 0.5541654480515409
Energy: 0.6943981267720457
Energy: 0.8096007449274325
Energy: 0.6943981267704797
Energy: 0.5647016002117082
Energy: 0.6970153736172096
Energy: 0.9397533125355241
Energy: 0.6970153728689296
Energy: 0.7507814480214277
Energy: 0.6450354936521995
Energy: 0.5798673823652486
Energy: 0.6450354936521995
Energy: 0.5620600853748612
Energy: 0.5695044295780614
Energy: 0.8279126235590325
Energy: 0.5695044295780614
Energy: 0.7342604458167287
Energy: 0.6941586290058273
Energy: 0.5599886500149686
Energy: 0.694158629002695
Energy: 0.5645707213929196
Energy: 0.6967257021501616
Energy: 0.6875735247883985
Energy: 0.6967257003053201
Energy: 0.7328493019918216
Energy: 0.6421664019275372
Energy: 0.5627104416654264
Energy: 0.6421664019267542
Energy: 0.5618680582955612
Energy: 0.5799454097350913
Energy: 0.551511731666198
Energy: 0.5799454097366574
Energy: 0.7339981454375124
Energy: 0.6950654373047261
Energy: 0.564790272383646
Energy: 0.6950654373047261
Energy: 0.5819920025681803
Energy: 0.5819373338197726
Energy: 0.5531947610803445
Energy: 0.5819373338182064
Energy: 0.9385470576246825
Energy: 0.5938938092892642
Energy: 0.5626542629740838
Energy: 0.593893809288481
Energy: 0.811280022634792
Energy: 0.6949491568181708
Energy: 0.5544191089046115
Energy: 0.6949491568173879
Energy: 0.8121568635235467
Energy: 0.6947026701524609
Energy: 0.5642435881025134
Energy: 0.6947026701493287
Energy: 0.5818947138809073
Energy: 0.6420687586246404
Energy: 0.5530453873434938
Energy: 0.6420687586230743
Energy: 0.8091679600190039
Energy: 0.5931795783315486
Energy: 0.5626244383508371
Energy: 0.5931795783315486
Energy: 0.562007637099902
Energy: 0.695056426701865
Energy: 0.7382086574168564
Energy: 0.6950564267112616
Energy: 0.5594981245889785
Energy: 0.5816127579613373
Energy: 0.5645415829149009
Energy: 0.5816127579644694
Energy: 0.5648035673739616
Energy: 0.6420996494538533
Energy: 0.7352120763159392
Energy: 0.6420996494530703
Energy: 0.5513276945397105
Energy: 0.7226112001003336
Energy: 0.5654455437372541
Energy: 0.7226112001699899
Energy: 0.5666781352719035
Energy: 0.6949882482462605
Energy: 0.7339929610637244
Energy: 0.6949882482454776
Energy: 0.5542784241273331
Energy: 0.5794372734892279
Energy: 0.5850799721147681
Energy: 0.5794372734892279

minimum gb energy = 0.5513276945397105 eV
minimum distance =  2.3224368116836 Angstroms
sigma value = 15


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

Energy: 0.7341852152706008
Energy: 0.5271541733788295
Energy: 0.95993827665956
Energy: 0.5271541733808196
Energy: 0.9633957978270925
Energy: 0.5258681338735266
Energy: 0.5258375362516214
Energy: 0.5258681338715365
Energy: 0.5430616193294328
Energy: 0.6221076591879836
Energy: 0.9603128711479932
Energy: 0.6221076591926271
Energy: 0.8357689006140976
Energy: 0.5259948486501703
Energy: 0.5259119256714911
Energy: 0.5259948489717781
Energy: 0.5237508623687377
Energy: 0.5290384269789745
Energy: 0.5178959292287155
Energy: 0.5290384269789745
Energy: 0.7467149236464079
Energy: 0.623797000901318
Energy: 0.5259904408727353
Energy: 0.623797000905298
Energy: 0.5255482327848234
Energy: 0.7284157072897116
Energy: 0.540104848405936
Energy: 0.7284157072917017
Energy: 0.62055109215667
Energy: 0.6306843518093121
Energy: 0.5261216845863275
Energy: 0.6306843518298761
Energy: 0.5271244422442362
Energy: 0.5350722314619106
Energy: 0.6437886807291113
Energy: 0.5350722314612474
Energy: 0.510241311311969
Energy: 0.5247491660291218
Energy: 0.5242052542681847
Energy: 0.5247491660171815
Energy: 0.5255212145334945
Energy: 0.6233888425461396
Energy: 0.8544057832776676
Energy: 0.6233888425468029
Energy: 0.5088057256712643
Energy: 0.6278250564779873
Energy: 0.5435009427702882
Energy: 0.6278250564806407
Energy: 0.5274062726065637
Energy: 0.5353976638337239
Energy: 0.9479008452233589
Energy: 0.5353976638357141
Energy: 0.5097134880509037
Energy: 0.527593230865174
Energy: 0.7348811224860111
Energy: 0.5275932308645107
Energy: 0.5257066937925414
Energy: 0.6221298145925575
Energy: 0.9603724569802181
Energy: 0.6221298156813079
Energy: 0.6906601942028067
Energy: 0.6227836511176458
Energy: 0.543687882337839
Energy: 0.6227836511295863
Energy: 0.527222930142519
Energy: 0.5350138465478415
Energy: 0.8495170905174018
Energy: 0.5350138465504949
Energy: 0.678660339363972
Energy: 0.5760558636442021
Energy: 0.5242775377319944
Energy: 0.5760558636136877
Energy: 0.5256507008480057
Energy: 0.5259901271266414
Energy: 0.7241903431411316
Energy: 0.5259901271809763
Energy: 0.6765651998158222
Energy: 0.6229930078159208
Energy: 0.5261860139644613
Energy: 0.6229930078298513
Energy: 0.5271630756842018
Energy: 0.6386979579495713
Energy: 0.620978072403583
Energy: 0.6386979100466044
Energy: 0.6649871424427106
Energy: 0.533388742829311
Energy: 0.5291496154097041
Energy: 0.5333887428266576
Energy: 0.5255158755353182
Energy: 0.5242713818714886
Energy: 0.5097933696715798
Energy: 0.5242713818714886
Energy: 0.8823982843676829
Energy: 0.6227565451941699
Energy: 0.5259660789832441
Energy: 0.622756545115954
Energy: 0.5446274221463714
Energy: 0.5431023611257267
Energy: 0.5084787909852878
Energy: 0.5431023611257267
Energy: 0.8570581603595925
Energy: 0.5336146580071225
Energy: 0.5291324065403903
Energy: 0.5336146580071225
Energy: 0.7357724139475408
Energy: 0.5249065198750245
Energy: 0.5098044283687981
Energy: 0.5249065198763512
Energy: 0.9590129299604557
Energy: 0.5253245960329177
Energy: 0.5262634000896979
Energy: 0.5253245960329177
Energy: 0.5448657563949937
Energy: 0.5958175502897384
Energy: 0.523699305676253
Energy: 0.5958175502937185
Energy: 0.7308547366488796
Energy: 0.5340409927351706
Energy: 0.5294969087629345
Energy: 0.5340409927338439
Energy: 0.5254716006861113
Energy: 0.5757180941368895
Energy: 0.6751862972262658
Energy: 0.5757180941395428
Energy: 0.7382818395570399
Energy: 0.5238883843952326
Energy: 0.5261080788219142
Energy: 0.5238883843932425
Energy: 0.5272158316526708
Energy: 0.5955535883950486
Energy: 0.666028694613227
Energy: 0.5955535883937219
Energy: 0.5117765167376698
Energy: 0.6386121053820357
Energy: 0.5294517981143538
Energy: 0.6386121053919861
Energy: 0.5222671324315314
Energy: 0.5756248751211731
Energy: 0.6637799326081071
Energy: 0.5756248751198464
Energy: 0.507407014013951
Energy: 0.5240218829648584
Energy: 0.5278392467104689
Energy: 0.5240218829675118
Energy: 0.5273765517998418
Energy: 0.5954710514476134
Energy: 0.8794137054730011
Energy: 0.5954710510968179

minimum gb energy = 0.507407014013951 eV
minimum distance =  2.32494492516609 Angstroms
sigma value = 85


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

Energy: 0.7454524243044152
Energy: 0.5167928826367107
Energy: 0.6244249560698213
Energy: 0.5167928826367107
Energy: 1.0831322332465974
Energy: 0.5862183879380697
Energy: 0.47846717082820633
Energy: 0.586218387936919
Energy: 0.7160944625859382
Energy: 0.6303192764561644
Energy: 0.6017703650375571
Energy: 0.6303192764550137
Energy: 0.8927198220981253
Energy: 0.5814452782531999
Energy: 0.47837771472619356
Energy: 0.5814452782526245
Energy: 0.549427815865324
Energy: 0.48447352672046673
Energy: 0.5049875603608738
Energy: 0.4844735267210421
Energy: 0.7952808240877447
Energy: 0.6299730648869718
Energy: 0.478500463730917
Energy: 0.6299730648869718
Energy: 0.5224338491593035
Energy: 0.6740983952620127
Energy: 0.5531272244993903
Energy: 0.6740983952614372
Energy: 0.6956766185919332
Energy: 0.5422133742026263
Energy: 0.4853099800353475
Energy: 0.5422133741893936
Energy: 0.4844434017868564
Energy: 0.5688548104356554
Energy: 0.6380750963435212
Energy: 0.5688548104350801
Energy: 0.595214588630229
Energy: 0.668168089228482
Energy: 0.5228373206930663
Energy: 0.6681680892290573
Energy: 0.47889920623844245
Energy: 0.5815665883847825
Energy: 0.732175702297974
Energy: 0.5815665883847825
Energy: 0.5051690255751942
Energy: 0.5084615301519471
Energy: 0.5496946436812903
Energy: 0.5084615301548236
Energy: 0.4781369527404742
Energy: 0.56905773859048
Energy: 0.8270253477589243
Energy: 0.5690577385916307
Energy: 0.45965550728320503
Energy: 0.63047340211271
Energy: 0.7165120593495413
Energy: 0.63047340211271
Energy: 0.4789517605449968
Energy: 0.581023702541983
Energy: 0.9849865307574033
Energy: 0.5810237025425584
Energy: 0.45526036352439303
Energy: 0.5064644568758175
Energy: 0.6897664284256401
Energy: 0.5064644568746669
Energy: 0.47811822136140547
Energy: 0.48991153985505187
Energy: 0.9379738387419191
Energy: 0.48991153984699715
Energy: 0.6017001185940871
Energy: 0.5527689780288476
Energy: 0.7167426882866423
Energy: 0.5527689778925725
Energy: 0.479358344060199
Energy: 0.5811305597622006
Energy: 0.8924686789186944
Energy: 0.5811305597622006
Energy: 0.5912753582810113
Energy: 0.5065461148190581
Energy: 0.5498469992223157
Energy: 0.5065461148196334
Energy: 0.4789875515399338
Energy: 0.4962912988802522
Energy: 0.7960403522201486
Energy: 0.4962912988802522
Energy: 0.6367374383617133
Energy: 0.5810657806339081
Energy: 0.5228906958355164
Energy: 0.5810657806327574
Energy: 0.48541252204803115
Energy: 0.5421228574685147
Energy: 0.6944716852249884
Energy: 0.5421228574685147
Energy: 0.6381177564631394
Energy: 0.5208147668020047
Energy: 0.48522542671577296
Energy: 0.5208147668014294
Energy: 0.5241845839334341
Energy: 0.5424149245286078
Energy: 0.5950744092210152
Energy: 0.5424149245297586
Energy: 0.8261552492442954
Energy: 0.5811828445468965
Energy: 0.4800080192165786
Energy: 0.5811828445497733
Energy: 0.5511253769408292
Energy: 0.5026125929188391
Energy: 0.504592774153343
Energy: 0.5026125929199899
Energy: 0.83715714577556
Energy: 0.5186744821017661
Energy: 0.4786699278353549
Energy: 0.5186744821011908
Energy: 0.7178277823710509
Energy: 0.5513943563837752
Energy: 0.4555377786199018
Energy: 0.5513943563774467
Energy: 0.983606937154598
Energy: 0.5811832202932509
Energy: 0.47943620937113723
Energy: 0.5811832202869225
Energy: 0.7472978388983471
Energy: 0.5119021373325722
Energy: 0.4554372806531233
Energy: 0.5119021373302709
Energy: 0.9096471206630296
Energy: 0.5187612120509262
Energy: 0.47878508814971715
Energy: 0.5187612120520769
Energy: 0.717866253700862
Energy: 0.5515556751361911
Energy: 0.4552534268783631
Energy: 0.5515556754127945
Energy: 0.8926484587111413
Energy: 0.5424527939353858
Energy: 0.4801346515372843
Energy: 0.5424527879729948
Energy: 0.5510883840936096
Energy: 0.5029205193527387
Energy: 0.5910908599568884
Energy: 0.5029205193487115
Energy: 0.7071579566975035
Energy: 0.5665834072624363
Energy: 0.4802079172933859
Energy: 0.5665834072520802
Energy: 0.5243740156737063
Energy: 0.5811693869568341
Energy: 0.6386458058070847
Energy: 0.5811693869562587
Energy: 0.6945391097925486
Energy: 0.5024186267659807
Energy: 0.48708481694858186
Energy: 0.5024186267648301
Energy: 0.48568320713306956
Energy: 0.5025515168197453
Energy: 0.6401791537394871
Energy: 0.50255151681917
Energy: 0.5047407934142887
Energy: 0.5742188446818108
Energy: 0.5251821571125268
Energy: 0.57421884468929
Energy: 0.47775570544212687
Energy: 0.5812178172811197
Energy: 0.8258216307568573
Energy: 0.5812178172799689
Energy: 0.4992582925479414
Energy: 0.5025435773608704
Energy: 0.552820091397764
Energy: 0.5025435773597197
Energy: 0.4788908992452793
Energy: 0.5024177328218794
Energy: 0.8353142400070998
Energy: 0.5024177328213041

minimum gb energy = 0.4552534268783631 eV
minimum distance =  2.33702560978132 Angstroms
sigma value = 113


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

Energy: 0.015444061447314427
Energy: 0.016936685892334363
Energy: 0.6117652771114728
Energy: 0.016936685892334363
Energy: 0.6111914249824186
Energy: 0.25878002777094444
Energy: 0.2586542176335277
Energy: 0.2587800277718044
Energy: 0.015444061447314427
Energy: 0.016936685891892074
Energy: 0.6117652771127504
Energy: 0.016936685892334363
Energy: 0.6111914249824186
Energy: 0.25878002777094444
Energy: 0.25865421763396995
Energy: 0.2587800277713867
Energy: 0.015444061447314427
Energy: 0.016936685892334363
Energy: 0.6117652771114728
Energy: 0.016936685892334363
Energy: 0.6111914249824186
Energy: 0.25878002777094444
Energy: 0.25865421763396995
Energy: 0.2587800277718044

minimum gb energy = 0.015444061447314427 eV
minimum distance =  2.54740360325176 Angstroms
sigma value = 1