Model name: model_name=MEAM_LAMMPS_KangSaLee_2009_ZrAgCu__MO_813575892799_002
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ag
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.072935052216053
cohesive_energy=2.8502241669002406
mass=107.8682
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.210969960922952e-19, 1.69180239490596e-19, 2.06962768873584e-19, 2.38701887993124e-19, 2.66212862975538e-19, 2.90473021567566e-19, 3.1208318000695797e-19, 3.3144708680548195e-19, 3.4884992940399e-19, 3.64509603824706e-19, 3.7858953208429793e-19, 3.9122269484338795e-19, 4.0251483575982e-19, 4.12557278901732e-19, 4.21422122217654e-19, 4.2917505494958e-19, 4.35870551103066e-19, 4.41558278153766e-19, 4.46281494870798e-19, 4.500770513167439e-19, 4.52978593200918e-19, 4.55018164056e-19, 4.562230008847679e-19, 4.5662034069e-19, 4.5618775299882e-19, 4.54774633207632e-19, 4.5218391359045395e-19, 4.481704611222839e-19, 4.424442818323679e-19, 4.3464648815469e-19, 4.2433808369153395e-19, 4.10972726210706e-19, 3.9387910370255997e-19, 3.72212869080978e-19, 3.4491017706098392e-19, 3.1062199491674996e-19, 2.6761957406018996e-19, 2.1366627591023998e-19, 1.4584469703404937e-19, 6.02895863020932e-20, -4.8170401807190393e-20, -1.8655904943959397e-19, -3.64573690890066e-19, -5.95847888007966e-19, -8.99952228377604e-19, -1.305634567342842e-18, -1.8563138916850798e-18, -2.6196709489543796e-18, -3.7052737926201e-18, -5.29878265103016e-18, -7.73263315397322e-18, -1.164554903835972e-17, -1.83808112159016e-17, -3.11322146105808e-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: 0.0 eV

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

Energy: 0.008660185756729864
Energy: 0.45135445133519175
Energy: 0.009222876601305637
Energy: 0.008765557454633317
Energy: 0.4525185300107048
Energy: 0.008915797362948608
Energy: 0.45135445133954266
Energy: 0.46344385267337773
Energy: 0.2624991570760878
Energy: 0.26276922128633495
Energy: 0.46390363585392963
Energy: 0.26228140866400257
Energy: 0.009222876601072308
Energy: 0.2624991570765682
Energy: 0.07223933137944925
Energy: 0.009075225331923604
Energy: 0.26243582571669716
Energy: 0.07258633749833049
Energy: 0.008765557454866643
Energy: 0.26276922128633495
Energy: 0.009075225331923604
Energy: 0.008832246302430123
Energy: 0.2625767168421901
Energy: 0.008908125201456276
Energy: 0.4525185300068343
Energy: 0.4639036358534493
Energy: 0.26243582571645013
Energy: 0.2625767168426704
Energy: 0.4678609596668148
Energy: 0.2634047376228227
Energy: 0.008915797362701556
Energy: 0.26228140866473
Energy: 0.07258633749929126
Energy: 0.008908125201456276
Energy: 0.26340473762234223
Energy: 0.008904904876915492

minimum gb energy = 0.008660185756729864 eV
minimum distance =  2.87644683723216 Angstroms
sigma value = 1


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

Energy: 0.8690078677929717
Energy: 1.038149610792633
Energy: 0.828890328767731
Energy: 0.8702293468596058
Energy: 1.0406530047882587
Energy: 0.8199503906787967
Energy: 0.878897397666996
Energy: 0.5972244130801225
Energy: 0.5971860211746874
Energy: 0.8281142085293741
Energy: 0.5971091657461588
Energy: 0.5861620189948673
Energy: 0.8950785738387239
Energy: 0.6095868021527023
Energy: 0.609317024303473
Energy: 0.8963148980504474
Energy: 0.6450330519041332
Energy: 0.5766986818188721
Energy: 0.9487620204319159
Energy: 0.9178786409793926
Energy: 0.7854221163700258
Energy: 0.94955522670944
Energy: 0.8973892508807583
Energy: 0.780786465813861
Energy: 0.8222842845857297
Energy: 0.6734250408762126
Energy: 0.6702424596373003
Energy: 0.7952206481777105
Energy: 0.6805938426493674
Energy: 0.6526515590752767
Energy: 0.7986801303656723
Energy: 0.6475894781186223
Energy: 0.6393118519615842
Energy: 0.7970766531843735
Energy: 0.6731064250758346
Energy: 0.621786104208984
Energy: 0.7970363587657648
Energy: 0.7619976687297395
Energy: 0.7240886452012221
Energy: 0.797659781209272
Energy: 0.8372055411563731
Energy: 0.6712354032641589
Energy: 0.7613761427785141
Energy: 0.6826731726488412
Energy: 0.6848989029025077
Energy: 0.7582573288052509
Energy: 0.7417563109669525
Energy: 0.7115694853202557
Energy: 0.6524882872283966
Energy: 0.6283395948769523
Energy: 0.6280636818965508
Energy: 0.6527931875166529
Energy: 0.7869789627632421
Energy: 0.6278850408645632
Energy: 0.6824282449487907
Energy: 0.6537357262323924
Energy: 0.6869597515010556
Energy: 0.6805816157061195
Energy: 0.7210059313604446
Energy: 0.6721661293708744
Energy: 0.9332069424739965
Energy: 0.7382440997636911
Energy: 0.7377859345157965
Energy: 0.9343410557470606
Energy: 0.8716345899320339
Energy: 0.8205346536430941
Energy: 0.6180854367440357
Energy: 0.5924709719744602
Energy: 0.5721915177122334
Energy: 0.6182160909993519
Energy: 0.623906475800998
Energy: 0.5850492764139363
Energy: 0.5971814792965247
Energy: 0.5833778967895066
Energy: 0.6009780024303955
Energy: 0.5975149400327436
Energy: 0.8429734987567695
Energy: 0.5891290859411978
Energy: 1.052583981576693
Energy: 0.7801966545650205
Energy: 0.7804465745469618
Energy: 1.0531321071275188
Energy: 0.9502375231084021
Energy: 0.8918739174875138
Energy: 0.6253066952048542
Energy: 0.6310160957113622
Energy: 0.6035823296756883
Energy: 0.6257109856149031
Energy: 0.6775172159889858
Energy: 0.6230855954064342
Energy: 0.6744809600702916
Energy: 0.6177931264466148
Energy: 0.617150151371153
Energy: 0.6737543758571443
Energy: 0.7197124558874056
Energy: 0.6156070379399643
Energy: 0.8385244925645672
Energy: 0.7100380031894247
Energy: 0.7107727224184784
Energy: 0.8393037541525937
Energy: 0.8061463418322137
Energy: 0.7250158806282335
Energy: 0.7042147825943879
Energy: 0.661989381719291
Energy: 0.6753457966221892
Energy: 0.704925818196373
Energy: 0.7832032393239693
Energy: 0.6587319803819119
Energy: 0.7442579130272243
Energy: 0.6557179849761304
Energy: 0.6485867515917485
Energy: 0.7479280864618363
Energy: 0.729441218014088
Energy: 0.6473978454679195
Energy: 0.8133728957256404
Energy: 0.7037792754541569
Energy: 0.6827312018175778
Energy: 0.7798736737019472
Energy: 0.7390797152801231
Energy: 0.7050948047949004
Energy: 0.8710809751970618
Energy: 0.8277004502634163
Energy: 0.7395372869353319
Energy: 0.8724564206832904
Energy: 0.8068615186771735
Energy: 0.7424445130600227
Energy: 0.8352826734939185
Energy: 0.641714918044237
Energy: 0.6250636372201616
Energy: 0.8368538240362398
Energy: 0.6536727405611976
Energy: 0.5884326966455824
Energy: 0.8695601620407722
Energy: 0.6234358047674143
Energy: 0.6230397805322857
Energy: 0.8506768595484429
Energy: 0.6247816047680311
Energy: 0.6229329080335255

minimum gb energy = 0.5721915177122334 eV
minimum distance =  2.6239065934753 Angstroms
sigma value = 33


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

Energy: 1.0222511829000656
Energy: 0.949878508760216
Energy: 0.8317553321581529
Energy: 1.0235833909849879
Energy: 0.9840707543267676
Energy: 0.8287136145495906
Energy: 0.9223075651104777
Energy: 0.6336222678109172
Energy: 0.6332191037210527
Energy: 0.8335362066741996
Energy: 0.6190376353309339
Energy: 0.6059547373522013
Energy: 0.8816369404312806
Energy: 0.6372221416198514
Energy: 0.6372058811006744
Energy: 0.8827383892963593
Energy: 0.6376065909518066
Energy: 0.6195497172277373
Energy: 0.8470713453528018
Energy: 0.9873433359236987
Energy: 0.9873424810376916
Energy: 0.8478794862229079
Energy: 0.9616703755608378
Energy: 0.7400237151921936
Energy: 0.8801811744349638
Energy: 0.6726143598719715
Energy: 0.6652440656270028
Energy: 0.8803070818843088
Energy: 0.6800437071473573
Energy: 0.6793125169025892
Energy: 0.8370124504427224
Energy: 0.6863816844940394
Energy: 0.66830928231518
Energy: 0.8375642899205347
Energy: 0.692162354350222
Energy: 0.6355515533616232
Energy: 0.834845649744118
Energy: 0.8138648103863996
Energy: 0.6534771309893025
Energy: 0.8351000657731658
Energy: 0.8450181716123907
Energy: 0.7370279956872847
Energy: 0.809867968466563
Energy: 0.6687525727260696
Energy: 0.6739352216957122
Energy: 0.7585040502157013
Energy: 0.6974894250421394
Energy: 0.6785670480960855
Energy: 0.6488880168145044
Energy: 0.7052633376845965
Energy: 0.6367455335359412
Energy: 0.649016947952425
Energy: 0.7586554550612792
Energy: 0.6378513618270719
Energy: 0.6831548168966765
Energy: 0.6938980411744048
Energy: 0.6863397394768291
Energy: 0.6836395269378021
Energy: 0.7376492908130912
Energy: 0.6764314462647774
Energy: 0.8080908885994109
Energy: 0.7843256700802758
Energy: 0.7838752328685276
Energy: 0.8092805782198814
Energy: 0.9577819257045374
Energy: 0.7842943219674695
Energy: 0.6332098485132865
Energy: 0.6989332613915751
Energy: 0.5795975910414066
Energy: 0.6189223381012439
Energy: 0.9004906802776367
Energy: 0.6380949550662823
Energy: 0.6190269347030893
Energy: 0.6564160773203711
Energy: 0.6012434502602293
Energy: 0.6190336934381064
Energy: 0.7118111144375316
Energy: 0.6097448265945633
Energy: 0.9859871710157286
Energy: 0.742350997921533
Energy: 0.7399325925628601
Energy: 0.9857507825021166
Energy: 0.847379453905294
Energy: 0.7568927274267682
Energy: 0.6746628173715203
Energy: 0.7240642263046159
Energy: 0.6658754607030861
Energy: 0.6745639022769641
Energy: 0.8461997984549131
Energy: 0.6524423544902973
Energy: 0.73607957090178
Energy: 0.6819470017371407
Energy: 0.6339314045933753
Energy: 0.7363945343381872
Energy: 0.850326919645131
Energy: 0.666915459997616
Energy: 0.8381292392682257
Energy: 0.836429614196377
Energy: 0.7480990943382634
Energy: 0.8384982348425003
Energy: 0.8695986418031271
Energy: 0.7475680779621062
Energy: 0.6975030937055396
Energy: 0.6608672057517442
Energy: 0.6512480474065647
Energy: 0.6975541915818051
Energy: 0.6814604038361709
Energy: 0.6766746372969383
Energy: 0.7550665131438142
Energy: 0.6467351794324804
Energy: 0.6327915903189392
Energy: 0.7567138063727369
Energy: 0.699714796894193
Energy: 0.6327245624654617
Energy: 0.8751554059103978
Energy: 0.6771057270743256
Energy: 0.6804325877672233
Energy: 0.7023885108753485
Energy: 0.691936418160654
Energy: 0.6847084142585318
Energy: 0.9570228877314556
Energy: 0.8052378938047837
Energy: 0.7843585729318906
Energy: 0.9580923402706747
Energy: 0.810416136566088
Energy: 0.7840163476624135
Energy: 0.8978345660015221
Energy: 0.6419448676562662
Energy: 0.6411915062832252
Energy: 0.8995980682224142
Energy: 0.6467044795655384
Energy: 0.5814555383079448
Energy: 0.8896073066296151
Energy: 0.6211579229224752
Energy: 0.621143998194477
Energy: 0.8237638851467558
Energy: 0.6199245553208548
Energy: 0.599760994904992
Energy: 0.8455197213504093
Energy: 0.9925266832882336
Energy: 0.9931002579440964
Energy: 0.8465358974290467
Energy: 0.9867668190293527
Energy: 0.7392349257470877
Energy: 0.8825891739907747
Energy: 0.6573349125302492
Energy: 0.6204310864919886
Energy: 0.8828701763013078
Energy: 0.674211815257428
Energy: 0.6096607087414292
Energy: 0.8474236241917492
Energy: 0.664569342223137
Energy: 0.6636277916712661
Energy: 0.8482970841688153
Energy: 0.6803747975174346
Energy: 0.6295242723927179
Energy: 0.852141523523702
Energy: 0.8150234424240701
Energy: 0.7519094426285567
Energy: 0.8503074247808584
Energy: 0.8303532266403321
Energy: 0.7475037416130426
Energy: 0.8315529885750688
Energy: 0.709527332238784
Energy: 0.7043638687293676
Energy: 0.7157459448256327
Energy: 0.7453115795583055
Energy: 0.6567361749816988
Energy: 0.6906155704916206
Energy: 0.7440358015349371
Energy: 0.6882970497800207
Energy: 0.6904411286494256
Energy: 0.7582353789622629
Energy: 0.645840337280685
Energy: 0.6489952073900636
Energy: 0.6597569692054026
Energy: 0.6400654596770045
Energy: 0.6489972183697768
Energy: 0.6499651635745283
Energy: 0.6432378078809099
Energy: 0.7864105851013566
Energy: 0.7846231430617064
Energy: 0.784168094826916
Energy: 0.7863225411503313
Energy: 0.9554500009492782
Energy: 0.78410988399072
Energy: 0.7034516374739159
Energy: 0.6455001117712517
Energy: 0.6121433217898191
Energy: 0.7035096839891645
Energy: 0.8961857376506692
Energy: 0.617877052505674
Energy: 0.6196855933473674
Energy: 0.6429014864307377
Energy: 0.604116910750034
Energy: 0.6199388104400793
Energy: 0.8372512413754594
Energy: 0.6204834654400172
Energy: 0.985625318086974
Energy: 0.7386792962030889
Energy: 0.7400071294091508
Energy: 0.9873905817534231
Energy: 0.8472553129403047
Energy: 0.7447700105961186
Energy: 0.6750799771410269
Energy: 0.6986405469895439
Energy: 0.6264708992849802
Energy: 0.6750198637445204
Energy: 0.8518254516109013
Energy: 0.6280605307834234
Energy: 0.672744457119972
Energy: 0.6870255175599895
Energy: 0.6424063601281543
Energy: 0.6727429615978215
Energy: 0.8418200473750433
Energy: 0.6598312189435966
Energy: 0.8249223909259515
Energy: 0.745178168767618
Energy: 0.7402950031423885
Energy: 0.8257087764061383
Energy: 0.83077579420983
Energy: 0.7395580505413792
Energy: 0.7563871835783423
Energy: 0.7041991194141708
Energy: 0.6932025819465856
Energy: 0.7580005878021665
Energy: 0.7343001463884893
Energy: 0.6900764982676821
Energy: 0.6973559585997237
Energy: 0.6834588505111505
Energy: 0.6680469033180767
Energy: 0.6973049136557705
Energy: 0.711932632068496
Energy: 0.6794082092838676
Energy: 0.8222735428919196
Energy: 0.656775462687055
Energy: 0.6567660065635879
Energy: 0.7602817791634694
Energy: 0.6594939200789411
Energy: 0.6567285036851059
Energy: 0.9117756724238036
Energy: 0.7661756022233925
Energy: 0.7220551965878411
Energy: 0.9427869464369275
Energy: 0.7663560974502379
Energy: 0.7298673345442792

minimum gb energy = 0.5795975910414066 eV
minimum distance =  2.623432348524 Angstroms
sigma value = 51


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

Energy: 0.8912119553731759
Energy: 1.0638339737571427
Energy: 0.953965871836184
Energy: 0.8927047086195816
Energy: 1.05074873904683
Energy: 0.7666696350419154
Energy: 0.8987941658522615
Energy: 0.6328057872387504
Energy: 0.632915953412722
Energy: 0.8380962755960049
Energy: 0.6328557801141417
Energy: 0.6232880181947954
Energy: 0.8472602111372336
Energy: 0.6238270940292642
Energy: 0.6230732212753857
Energy: 0.8664066396719031
Energy: 0.6234316486459244
Energy: 0.5697720105066241
Energy: 0.8047258017365289
Energy: 0.9113729972706689
Energy: 0.8643593477338588
Energy: 0.8044283709632629
Energy: 0.876229499361092
Energy: 0.7269237042986442
Energy: 0.8055663375938915
Energy: 0.711960123000731
Energy: 0.6848572896412561
Energy: 0.8040043756640217
Energy: 0.7309570805041982
Energy: 0.7064709519367449
Energy: 0.7413326652099044
Energy: 0.7029665486246783
Energy: 0.7027744265989928
Energy: 0.7423284473809405
Energy: 0.7198913384667307
Energy: 0.6856368694037797
Energy: 0.7327216698414832
Energy: 0.6568656314337781
Energy: 0.689512500873299
Energy: 0.7328816481728482
Energy: 0.7632228657575634
Energy: 0.71037710839165
Energy: 0.8185186816475073
Energy: 0.7568945589137392
Energy: 0.7680304165885622
Energy: 0.7719769581178741
Energy: 0.9278372755915296
Energy: 0.7680720370018761
Energy: 0.6518443986890411
Energy: 0.7341398262488167
Energy: 0.6037309773945485
Energy: 0.6514903558075165
Energy: 0.9071634005186947
Energy: 0.5956173412062788
Energy: 0.6240312782645298
Energy: 0.5685254465807464
Energy: 0.5940563132366431
Energy: 0.6233220331711158
Energy: 0.8020302452798932
Energy: 0.6233860253298148
Energy: 1.0462769659488618
Energy: 0.861101582520848
Energy: 0.8613234099292161
Energy: 1.0476554615240643
Energy: 1.0493029957675237
Energy: 0.8610819647248812
Energy: 0.6552686667848896
Energy: 0.5694581884356342
Energy: 0.5966067155898929
Energy: 0.6551704288039308
Energy: 0.7921889136711728
Energy: 0.5938755681462741
Energy: 0.660899530599577
Energy: 0.6926449537019144
Energy: 0.5902429586946322
Energy: 0.6425000245946205
Energy: 0.8292546714315979
Energy: 0.6343903407753748
Energy: 0.7315204688365267
Energy: 0.7280478837212635
Energy: 0.7279356008977308
Energy: 0.7319758000557843
Energy: 0.8063424207842895
Energy: 0.7276964863061938
Energy: 0.7777821120413242
Energy: 0.7414366366180904
Energy: 0.7498245073330901
Energy: 0.7794398775402571
Energy: 0.7654941117636073
Energy: 0.6921774274409415
Energy: 0.7157673609374302
Energy: 0.6857383276997477
Energy: 0.6775479638976666
Energy: 0.7157715950833566
Energy: 0.6902851034498626
Energy: 0.6871046574087509
Energy: 0.8512228643448734
Energy: 0.6428063289519351
Energy: 0.6425536402773891
Energy: 0.7763775212399798
Energy: 0.6426987716039827
Energy: 0.642749289509419
Energy: 0.9217345398254383
Energy: 0.682258199498565
Energy: 0.5883393946645373
Energy: 0.9231394889206739
Energy: 0.6822993358778766
Energy: 0.5587461699239055

minimum gb energy = 0.5587461699239055 eV
minimum distance =  2.69579566711632 Angstroms
sigma value = 19


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

Energy: 0.7301093770669453
Energy: 0.9516440897112106
Energy: 0.6657608559035693
Energy: 0.7320713117951648
Energy: 0.9515500671584421
Energy: 0.6662463321865066
Energy: 0.8335068711790969
Energy: 0.5723209014253342
Energy: 0.5723896526911479
Energy: 0.747656033567365
Energy: 0.572300479115791
Energy: 0.5724861925994993
Energy: 0.8032612720689501
Energy: 0.5864344834937275
Energy: 0.5866161758492353
Energy: 0.8032822835343709
Energy: 0.5865698892804552
Energy: 0.5866342684881015
Energy: 0.645018260016654
Energy: 0.886684528649873
Energy: 0.9216185833691225
Energy: 0.6440813068257821
Energy: 0.8878208456514626
Energy: 0.6705265873161788
Energy: 0.8340210134293092
Energy: 0.663005620440644
Energy: 0.6630849483126996
Energy: 0.8341526641346511
Energy: 0.6569300595030132
Energy: 0.6632573454807568
Energy: 0.6471003597831388
Energy: 0.5877724329352851
Energy: 0.6813977082739845
Energy: 0.6471399501672103
Energy: 0.5882854284139105
Energy: 0.6254994052758615
Energy: 0.6772615235290173
Energy: 0.6269612430979307
Energy: 0.6254969845714938
Energy: 0.6779678171480035
Energy: 0.7624680257025793
Energy: 0.6569443261441923
Energy: 0.7434240819663184
Energy: 0.666971824422563
Energy: 0.6668321245004066
Energy: 0.6541658848642619
Energy: 0.7314209323430143
Energy: 0.6668470789482205
Energy: 0.5864527618728352
Energy: 0.727955260732249
Energy: 0.6507691183187144
Energy: 0.5865130148313548
Energy: 0.7810181223071189
Energy: 0.6502260447473053
Energy: 0.5860094534433818
Energy: 0.6631733296096256
Energy: 0.586509536170735
Energy: 0.5864292900825522
Energy: 0.7477511298629942
Energy: 0.586484584402754
Energy: 0.8861519635704262
Energy: 0.6440926117146508
Energy: 0.6231340965129769
Energy: 0.8870979509135204
Energy: 0.6457344978795204
Energy: 0.9195559409358686
Energy: 0.694684142584521
Energy: 0.6277689327494919
Energy: 0.5864583391217373
Energy: 0.6484079104341547
Energy: 0.68109252916049
Energy: 0.6861648015558831
Energy: 0.5565902623251666
Energy: 0.6807909266840964
Energy: 0.6030772402095437
Energy: 0.5565498415649279
Energy: 0.7013680010220943
Energy: 0.625259012237773
Energy: 0.8144212249292354
Energy: 0.6252734640913357
Energy: 0.6253686378459367
Energy: 0.6813643768330109
Energy: 0.6472774510613158
Energy: 0.6253732104788022
Energy: 0.7809856015501042
Energy: 0.6850702696360366
Energy: 0.6832355231160813
Energy: 0.7832063473436187
Energy: 0.6944900787989315
Energy: 0.6502721029372402
Energy: 0.7310777752148041
Energy: 0.6264264945516772
Energy: 0.6471404061562523
Energy: 0.7313620080334089
Energy: 0.6263965607566009
Energy: 0.6667321410603615
Energy: 0.8022594283346164
Energy: 0.5722867478242032
Energy: 0.5722753911875889
Energy: 0.7468076958840384
Energy: 0.5722822997089941
Energy: 0.5721568461122053
Energy: 0.6747500307218077
Energy: 0.5862612875063861
Energy: 0.5863021906440639
Energy: 0.6743956796504769
Energy: 0.5862285350113591
Energy: 0.6831427006197942
Energy: 0.6440469788017223
Energy: 0.6850883875902352
Energy: 0.6851103085636692
Energy: 0.6439822895090523
Energy: 0.7560911466786026
Energy: 0.6851140041055511
Energy: 0.7015203743729862
Energy: 0.5563301706635709
Energy: 0.656868754590967
Energy: 0.7014636967147005
Energy: 0.5563828463845258
Energy: 0.6450290100724995
Energy: 0.6463389586836288
Energy: 0.5923967523354771
Energy: 0.6036294102519635
Energy: 0.6470592737583784
Energy: 0.6803944015483291
Energy: 0.6252642853537465
Energy: 0.6773575624722714
Energy: 0.5727071488159917
Energy: 0.6634088237449982
Energy: 0.6774195180662033
Energy: 0.7474696107507293
Energy: 0.6572678986415124
Energy: 0.6540304135073903
Energy: 0.6663608559106708
Energy: 0.6663803518136037
Energy: 0.6541246119459178
Energy: 0.7315922339263866
Energy: 0.6662675189572962
Energy: 0.5722538775921276
Energy: 0.6720560434051509
Energy: 0.5730043408594937
Energy: 0.5722524368622749
Energy: 0.7811411694684833
Energy: 0.5723463068845903
Energy: 0.5864447429801292
Energy: 0.6274898366082987
Energy: 0.5865156996796281
Energy: 0.5864825118774692
Energy: 0.7143052966026492
Energy: 0.5865570763090868
Energy: 0.8883172352216767
Energy: 0.6440806470310353
Energy: 0.6225740945490496
Energy: 0.8878794708039298
Energy: 0.6441509727199369
Energy: 0.9209781432222529
Energy: 0.6940781260734603
Energy: 0.7084602447798466
Energy: 0.6630642478616747
Energy: 0.6946802684152731
Energy: 0.7758405013695057
Energy: 0.6631231562898979
Energy: 0.588119107965896
Energy: 0.6255398232341001
Energy: 0.6254962718129203
Energy: 0.5887589338069921
Energy: 0.6471345981522147
Energy: 0.6814072036811077
Energy: 0.8154379469841643
Energy: 0.6568537345990431
Energy: 0.6254718883468987
Energy: 0.7649753629391455
Energy: 0.6776006054578823
Energy: 0.6254231041008184
Energy: 0.7310294266211186
Energy: 0.6707834553120011
Energy: 0.6472745444501932
Energy: 0.7312411034720796
Energy: 0.6540717491817699
Energy: 0.6668666987656616

minimum gb energy = 0.5563301706635709 eV
minimum distance =  2.63305188421789 Angstroms
sigma value = 27


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

Energy: 0.6239348868622001
Energy: 1.031197082815916
Energy: 0.8848873224626934
Energy: 0.6256539684872535
Energy: 1.031522672210668
Energy: 0.8851842411623821
Energy: 0.9124694357307087
Energy: 0.577537575461569
Energy: 0.5774036467436859
Energy: 0.697122932353905
Energy: 0.5777665417092778
Energy: 0.5775654480842823
Energy: 0.6264978291727592
Energy: 0.5453482060183591
Energy: 0.5454779333158815
Energy: 0.6864548369208905
Energy: 0.5461539486937901
Energy: 0.5451816669529629
Energy: 0.8687379953331988
Energy: 0.7560789782381905
Energy: 0.7534766903013309
Energy: 0.8717376149417434
Energy: 0.6896110634018764
Energy: 0.5977705161813083
Energy: 0.7250236885129152
Energy: 0.5985441110096145
Energy: 0.6169818553014818
Energy: 0.6245635570548698
Energy: 0.6965195605080645
Energy: 0.529990729803205
Energy: 0.5659820171981159
Energy: 0.6044668756793593
Energy: 0.6044918805710152
Energy: 0.566004658760851
Energy: 0.6254814430575186
Energy: 0.5875140888408075
Energy: 0.6098692850456203
Energy: 0.501730888584203
Energy: 0.5019405106900492
Energy: 0.610074813636461
Energy: 0.7710663036734542
Energy: 0.6196850899070978
Energy: 0.5624804059644283
Energy: 0.7462700071443132
Energy: 0.7459901522937618
Energy: 0.5774434992319735
Energy: 0.8320422602903091
Energy: 0.7203508809263536
Energy: 0.6714795741073706
Energy: 0.6879668188092759
Energy: 0.838339289862702
Energy: 0.5623653223837493
Energy: 0.8696654381484261
Energy: 0.5292957810240391
Energy: 0.609636727485989
Energy: 0.6189610194683387
Energy: 0.566599336976551
Energy: 0.610544245707605
Energy: 0.6261221607447596
Energy: 0.5666206134223261
Energy: 0.6264644060196226
Energy: 0.5656093927583646
Energy: 0.5664801010491722
Energy: 0.6266844280558838
Energy: 0.5733168880243937
Energy: 0.5663395680069039
Energy: 0.9128362831777731
Energy: 0.6538364225192916
Energy: 0.6538597070102
Energy: 0.724510966201342
Energy: 0.7156695930699842
Energy: 0.6782842659845272

minimum gb energy = 0.501730888584203 eV
minimum distance =  2.66652014180767 Angstroms
sigma value = 9


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

Energy: 0.9705991769613332
Energy: 1.1126195343210081
Energy: 0.7586304212916611
Energy: 0.9720208624812581
Energy: 1.112238822011425
Energy: 0.8372166117001104
Energy: 0.6556309849693776
Energy: 0.5194565427935769
Energy: 0.5193857662654838
Energy: 0.6254699860860834
Energy: 0.5195371895782431
Energy: 0.5140225052917338
Energy: 0.6514774366713303
Energy: 0.4621493930857941
Energy: 0.46208298327328184
Energy: 0.5427479274062134
Energy: 0.4631626602549316
Energy: 0.4629992743380111
Energy: 0.6452395466889842
Energy: 0.5089825115604069
Energy: 0.5802682716401691
Energy: 0.6440892555103578
Energy: 0.5708745106017981
Energy: 0.5603613009185676
Energy: 0.689967055570628
Energy: 0.6879459405603119
Energy: 0.6495716473188103
Energy: 0.6907261868986357
Energy: 0.6532226584777653
Energy: 0.6225814480270668
Energy: 0.5027503674446265
Energy: 0.7036074200728994
Energy: 0.7708088657512331
Energy: 0.5115721392857476
Energy: 0.7299994682822881
Energy: 0.6353811237586715
Energy: 0.5576321142633494
Energy: 0.4724489881122352
Energy: 0.6318582111157269
Energy: 0.5589116097911297
Energy: 0.7367491214237342
Energy: 0.5577181991987319
Energy: 0.48709837744013645
Energy: 0.6033762816665869
Energy: 0.6850117691108883
Energy: 0.48668082310187105
Energy: 0.6179957562956989
Energy: 0.48495912965701854
Energy: 0.7072564220104346
Energy: 0.6538856817738214
Energy: 0.626046472319688
Energy: 0.7075713812688503
Energy: 0.5952426279651717
Energy: 0.6235920730660972
Energy: 0.7309112396582514
Energy: 0.6580528207221225
Energy: 0.6553411042622493
Energy: 0.7310167843070329
Energy: 0.653122041055973
Energy: 0.6132017052520967
Energy: 0.7507249048086366
Energy: 0.4832261270285611
Energy: 0.4837167250264713
Energy: 0.5302882224337495
Energy: 0.4876418930604765
Energy: 0.4836349001943399
Energy: 0.7651210287274033
Energy: 0.5115383223209552
Energy: 0.5116502698704253
Energy: 0.757807482237626
Energy: 0.5115362271059698
Energy: 0.5114696676033815
Energy: 0.8503391323539543
Energy: 0.8929479067688444
Energy: 0.7284058959375318
Energy: 0.8518421863976836
Energy: 0.8930883041095832
Energy: 0.7535063155273118
Energy: 0.6822585308737102
Energy: 0.5110108466807505
Energy: 0.5926518928840112
Energy: 0.6832352639727458
Energy: 0.6541401718379638
Energy: 0.524366892274882
Energy: 0.5550724158321652
Energy: 0.49966759351680357
Energy: 0.5017874218925098
Energy: 0.5550641419819974
Energy: 0.5089756517779698
Energy: 0.5854173206647604
Energy: 0.4708255428547693
Energy: 0.46763301456911965
Energy: 0.45836837356355215
Energy: 0.47124919979852314
Energy: 0.5820241373960215
Energy: 0.47134056674837016
Energy: 0.5201426445478485
Energy: 0.6269432650852954
Energy: 0.5110485902664199
Energy: 0.5191086813514453
Energy: 0.7549602401401576
Energy: 0.5194850915733824
Energy: 0.664949822285519
Energy: 0.7709367100112546
Energy: 0.6630930977535746
Energy: 0.6663477848884967
Energy: 0.850055765618883
Energy: 0.6622026605725537
Energy: 0.5275249733915042
Energy: 0.4813707318080269
Energy: 0.5127996368020438
Energy: 0.5277152486302022
Energy: 0.5819457789955932
Energy: 0.49410824545614546
Energy: 0.48656270097762006
Energy: 0.48572061869780525
Energy: 0.4849128308855637
Energy: 0.4869850037892321
Energy: 0.48713805789753334
Energy: 0.4855192284451732
Energy: 0.5318981863106225
Energy: 0.49362147185479116
Energy: 0.4935654186873949
Energy: 0.5100534137076878
Energy: 0.5277379002722252
Energy: 0.503523618986095
Energy: 0.973852904445992
Energy: 0.5192306268062715
Energy: 0.5341445759974245
Energy: 0.971778588807307
Energy: 0.5921768653544135
Energy: 0.805743169541885
Energy: 0.9783577777622277
Energy: 0.5196357305985283
Energy: 0.5193781095963659
Energy: 0.7567443727853339
Energy: 0.5052467625367283
Energy: 0.6697933347140017
Energy: 0.5821628028582423
Energy: 0.4888988495179394
Energy: 0.46232539215319923
Energy: 0.5818118535789614
Energy: 0.48878943628538973
Energy: 0.4477061527953914
Energy: 0.6189045546890539
Energy: 0.5361642258600775
Energy: 0.5864709670878787
Energy: 0.620087315280191
Energy: 0.5354913278041098
Energy: 0.585072356919211
Energy: 0.6889955655056809
Energy: 0.6941289638316072
Energy: 0.5750783913775197
Energy: 0.690035219188174
Energy: 0.7236533526962933
Energy: 0.6029785541590919
Energy: 0.9195621904592248
Energy: 0.7006815983877747
Energy: 0.6651140943977036
Energy: 0.9195224536865537
Energy: 0.7322948259954529
Energy: 0.8612507260828689
Energy: 0.5117018308920407
Energy: 0.6080932841780167
Energy: 0.49015214121266604
Energy: 0.5116626366661168
Energy: 0.71507654511278
Energy: 0.5112747468378593
Energy: 0.4839257144250218
Energy: 0.5862478940802998
Energy: 0.5714595834419659
Energy: 0.48384810330989325
Energy: 0.5902084310840355
Energy: 0.4842067889654859
Energy: 0.7596376358773188
Energy: 0.6035563169357315
Energy: 0.6937626529776748
Energy: 0.7611556546257187
Energy: 0.6183093131049285
Energy: 0.6849893117325166
Energy: 0.7389407543103109
Energy: 0.4962942388169878
Energy: 0.5496152640908658
Energy: 0.6234616548649097
Energy: 0.716590152977235
Energy: 0.6122124066054473
Energy: 0.7327243381179875
Energy: 0.5508041717837241
Energy: 0.5524248015169838
Energy: 0.7311296110380162
Energy: 0.5521612084699581
Energy: 0.689547912984369
Energy: 0.8172839751393869
Energy: 0.49014200425970583
Energy: 0.4899735755995836
Energy: 0.8180923462898247
Energy: 0.4906972713553836
Energy: 0.4899094550632915
Energy: 0.8513939000780776
Energy: 0.510998928195738
Energy: 0.49966972734790815
Energy: 0.8515576077638004
Energy: 0.5110590214678562
Energy: 0.7633902440720242
Energy: 0.8652554477989087
Energy: 0.5443490799747405
Energy: 0.5126726339632146
Energy: 0.6455231376689683
Energy: 0.6300092852738954
Energy: 0.6108786233984805
Energy: 0.6174414800546256
Energy: 0.4999646443244875
Energy: 0.5597106968950968
Energy: 0.6174721298684767
Energy: 0.5061005262469267
Energy: 0.5544934750447973
Energy: 0.47276755360342815
Energy: 0.5602727904442967
Energy: 0.5523274238188937
Energy: 0.47354290071837957
Energy: 0.5206310714482306
Energy: 0.4738314966378757
Energy: 0.5192095676376248
Energy: 0.5671175810741712
Energy: 0.46622961728669865
Energy: 0.5191854776967335
Energy: 0.5714209929926626
Energy: 0.5195479162935278
Energy: 1.137908848074541
Energy: 0.7908287920242546
Energy: 0.7524870529523403
Energy: 1.1362985641897643
Energy: 0.8523252221546636
Energy: 0.9441231378079442
Energy: 0.586954742875858
Energy: 0.5927879605354796
Energy: 0.4790656439987909
Energy: 0.5864123255266788
Energy: 0.571397059345093
Energy: 0.5195100324263542
Energy: 0.486043960707895
Energy: 0.48602500674911253
Energy: 0.5359576616364498
Energy: 0.4868123778097058
Energy: 0.48679092612915653
Energy: 0.4852109686762339
Energy: 0.5319077384916585
Energy: 0.4746992699781595
Energy: 0.4749625836302528
Energy: 0.5319647003486424
Energy: 0.47635488946715937
Energy: 0.46113920133760833
Energy: 0.9229878812044636
Energy: 0.5190684731953478
Energy: 0.5197863750435734
Energy: 0.757135168066952
Energy: 0.5189498282997647
Energy: 0.5936965496625397

minimum gb energy = 0.4477061527953914 eV
minimum distance =  2.6546618044601 Angstroms
sigma value = 57


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

Energy: 0.19295002501182948
Energy: 0.8783198093874647
Energy: 0.19912993934528253
Energy: 0.19483408020331872
Energy: 0.8787869501509907
Energy: 0.19337892809374585
Energy: 0.24879122066405296
Energy: 0.22189976405524953
Energy: 0.20483495965386647
Energy: 0.22034059972546358
Energy: 0.22113463001827283
Energy: 0.20500172656287516
Energy: 0.250963715019634
Energy: 0.2226385821561947
Energy: 0.2871957819410121
Energy: 0.25104205681168085
Energy: 0.2226041360510504
Energy: 0.2872853144123653
Energy: 0.8065525618920497
Energy: 0.2227204005740035
Energy: 0.22227319001283402
Energy: 0.806192744613293
Energy: 0.24995394005419883
Energy: 0.22369446661679152
Energy: 0.24809311650578514
Energy: 0.19368727591316404
Energy: 0.21432380028697492
Energy: 0.2485496959155444
Energy: 0.19358475381404336
Energy: 0.20742309302107273
Energy: 0.22272563608923268
Energy: 0.19354445538560874
Energy: 0.19355302609375777
Energy: 0.22279421056198231
Energy: 0.1934816823726944
Energy: 0.21415712087002675
Energy: 0.21930772394988093
Energy: 0.2221949359734603
Energy: 0.20772856554230082
Energy: 0.21974315332175998
Energy: 0.22228773574747815
Energy: 0.20879766836331975
Energy: 0.6374186377449143
Energy: 0.6580657193468222
Energy: 0.7094263137737941
Energy: 0.6374793570457868
Energy: 0.8050923075084744
Energy: 0.7104464000571389
Energy: 0.2478084090294889
Energy: 0.2546566852346557
Energy: 0.2868586490961722
Energy: 0.2482950831299206
Energy: 0.25038488974636663
Energy: 0.2872519527087743
Energy: 0.19333468710668386
Energy: 0.2502645957085505
Energy: 0.1944923982458599
Energy: 0.1934213734906959
Energy: 0.2502557010856474
Energy: 0.21457116041861274
Energy: 0.19336072592616566
Energy: 0.22254599675040398
Energy: 0.22145750144432313
Energy: 0.19344440754262382
Energy: 0.2227084003870383
Energy: 0.21426748790657046
Energy: 0.24945906852045527
Energy: 0.22203024190507775
Energy: 0.2321213170851153
Energy: 0.2499266833946402
Energy: 0.22147513012653441
Energy: 0.2322274866392994
Energy: 0.804810394201878
Energy: 0.7107865898295779
Energy: 0.6594065955267526
Energy: 0.8047170331258118
Energy: 0.6369433009094722
Energy: 0.6562068504764534
Energy: 0.24855712173869987
Energy: 0.22189079790273614
Energy: 0.2321075580872937
Energy: 0.24920851233983887
Energy: 0.22122164185969165
Energy: 0.23204217542575525
Energy: 0.25050219445345095
Energy: 0.19328497954860524
Energy: 0.1933356810560793
Energy: 0.2503857062757317
Energy: 0.19328242630143552
Energy: 0.19389235682516026
Energy: 0.22129277438304856
Energy: 0.2213788691111694
Energy: 0.20659593041620797
Energy: 0.22149272551518245
Energy: 0.19361357154188272
Energy: 0.20505631818574027
Energy: 0.22265882746141094
Energy: 0.28728579427217543
Energy: 0.2871889373915405
Energy: 0.22265608849266605
Energy: 0.2503490689009407
Energy: 0.28740290866172397
Energy: 0.25025343640229636
Energy: 0.6606988040117041
Energy: 0.7125649846809584
Energy: 0.25010928074938243
Energy: 0.8059054528363826
Energy: 0.7133162903250462
Energy: 0.19343839979189398
Energy: 0.24972895312375715
Energy: 0.22980350767355312
Energy: 0.1934915121512799
Energy: 0.2490435911862688
Energy: 0.20957561291757806

minimum gb energy = 0.19295002501182948 eV
minimum distance =  2.72676184238676 Angstroms
sigma value = 11


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

Energy: 0.8079440254250388
Energy: 1.0790946612527625
Energy: 0.8013058971982013
Energy: 0.8094606336975825
Energy: 1.0770644174302386
Energy: 0.869697702933036
Energy: 0.3623535245811523
Energy: 0.36299585531979517
Energy: 0.3889852315148191
Energy: 0.3879552748520881
Energy: 0.36273098103333123
Energy: 0.4229127672658236
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Energy: 0.37842392339371334
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Energy: 0.37889158191969713
Energy: 0.3834453126589245
Energy: 0.43458164649872993
Energy: 0.37962559441577814
Energy: 0.3955273047428117
Energy: 0.4461251248383544
Energy: 0.38066308416136896
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Energy: 0.421428129203674
Energy: 0.36620358872092806
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Energy: 0.6382244715149559
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Energy: 0.5324482672047759
Energy: 0.7421530665927184
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Energy: 0.6472125126723514
Energy: 0.7434314077680186
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Energy: 0.7924152563889378
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Energy: 0.5400782216864626
Energy: 0.6296143144836084
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Energy: 0.6925729184752029
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Energy: 0.6100410232236078
Energy: 0.7401025771752292
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Energy: 0.7930546238705029
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Energy: 0.5246324660617459
Energy: 0.5245382608254986
Energy: 0.6308019414548837
Energy: 0.5245934333237492
Energy: 0.5473981984025983
Energy: 0.701969122338098
Energy: 0.5044366898874201
Energy: 0.5179591283982238
Energy: 0.4920277228827943
Energy: 0.5077294474294954
Energy: 0.5268343446262961
Energy: 0.5100648723066898
Energy: 0.603078422136482
Energy: 0.6525552805500326
Energy: 0.5109752131631143
Energy: 0.5850417950892649
Energy: 0.6512835951738339
Energy: 0.7088634692846267
Energy: 0.4974826711662094
Energy: 0.6070447241995511
Energy: 0.7092250951944147
Energy: 0.696127939656326
Energy: 0.6170322678373762
Energy: 0.8993851118552685
Energy: 0.7359963911437835
Energy: 0.7231550366223631
Energy: 0.9007064642777115
Energy: 0.811266064719605
Energy: 0.8542074877059266
Energy: 0.42067684712267406
Energy: 0.4901378306518374
Energy: 0.4824243426403892
Energy: 0.42164482144334536
Energy: 0.6416607304024614
Energy: 0.4608157571537918
Energy: 0.43066595221965737
Energy: 0.49863760186699413
Energy: 0.5228623792764462
Energy: 0.4290453615751955
Energy: 0.4953014093688966
Energy: 0.4277772108245927
Energy: 0.42441496009454915
Energy: 0.4785544079175558
Energy: 0.4956756267894962
Energy: 0.42416694122087767
Energy: 0.37982039902353343
Energy: 0.5143213446601845
Energy: 1.0186428558901195
Energy: 0.36258199321074785
Energy: 0.4899591838880374
Energy: 0.816409894431953
Energy: 0.3628976678776528
Energy: 0.5709758466581913

minimum gb energy = 0.3530093569217051 eV
minimum distance =  2.64650290484822 Angstroms
sigma value = 41


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

Energy: 0.7857477982902751
Energy: 1.0239691082974844
Energy: 0.8613014605878953
Energy: 0.7872100169292807
Energy: 1.0243996014835755
Energy: 0.7239210940523472
Energy: 0.4044427058555274
Energy: 0.4051675053089251
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Energy: 0.40518903636433284
Energy: 0.46328215617810076
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Energy: 0.7876074218446291
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Energy: 0.4057318529789805
Energy: 0.5868747036284245
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Energy: 0.48327199872933624
Energy: 0.5217867933808443
Energy: 0.50669970569296
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Energy: 0.5216069021822946
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Energy: 0.6249716116507185
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Energy: 0.5034690584495928
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Energy: 0.467558934835591
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Energy: 0.7858538207922835
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Energy: 0.4056440217089303
Energy: 0.4110553970728892
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Energy: 0.4059764480029178
Energy: 0.46657906229430796
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Energy: 0.431835685912505
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Energy: 0.42593180598633334
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Energy: 0.5861516355582449
Energy: 0.40649903297309614
Energy: 1.0257615614424642
Energy: 0.8404178336287402
Energy: 0.8276053985047261
Energy: 1.0251655123907042
Energy: 0.8405180698835569
Energy: 0.7381321838372453
Energy: 0.6399756525955933
Energy: 0.5347642809364195
Energy: 0.534181297157484
Energy: 0.5258261611663946
Energy: 0.6088251090552925
Energy: 0.47835565933401564
Energy: 0.48326082654624347
Energy: 0.5055741199883894
Energy: 0.5795602694771993
Energy: 0.4832149392118782
Energy: 0.5062473056720912
Energy: 0.4899001257428807
Energy: 0.6413897789840027
Energy: 0.46804963699195734
Energy: 0.5046192200222329
Energy: 0.4058423658563358
Energy: 0.4680962624146296
Energy: 0.5078755265954344
Energy: 0.6362437274323994
Energy: 0.7025260137227441
Energy: 0.4663102168085077
Energy: 0.6145046421276349
Energy: 0.48169753074222676
Energy: 0.5837000893364023
Energy: 0.6335437986705397
Energy: 0.7442494820214112
Energy: 0.6975590050299957
Energy: 0.6331698214861003
Energy: 0.7461527959929373
Energy: 0.42174636731966253
Energy: 0.8438246549896633
Energy: 0.4544212298511861
Energy: 0.5055766041664823
Energy: 0.7316491972553019
Energy: 0.3835772205311154
Energy: 0.48918210777095966
Energy: 0.7447822978094185
Energy: 0.742517262673249
Energy: 0.7057469860886848
Energy: 0.7444749835983281
Energy: 0.7885549728192752
Energy: 0.6483532182444516
Energy: 0.4672001004338738
Energy: 0.5250405851846931
Energy: 0.5264270180720796
Energy: 0.46731735378337064
Energy: 0.671733714664309
Energy: 0.494541016098917
Energy: 0.5065371598387397
Energy: 0.6056362629176508
Energy: 0.5672996548411214
Energy: 0.5064327792457263
Energy: 0.6347883288955211
Energy: 0.505261741587023
Energy: 0.6056245871012071
Energy: 0.4058989854524209
Energy: 0.4661665790455347
Energy: 0.6057318707499587
Energy: 0.40740947009112194
Energy: 0.4658453159070252
Energy: 0.7863122057343651
Energy: 0.43380736316848956
Energy: 0.4117591940850792
Energy: 0.7864334341863656
Energy: 0.5823107405718574
Energy: 0.43699756573124665

minimum gb energy = 0.3835772205311154 eV
minimum distance =  2.6816292540357 Angstroms
sigma value = 33


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

Energy: 0.6096967529316678
Energy: 0.9009808948958428
Energy: 0.7488157134754143
Energy: 0.5549456776255967
Energy: 0.9006000715703774
Energy: 0.800055710650086
Energy: 0.7562630573719109
Energy: 0.445432035712311
Energy: 0.4579695282216689
Energy: 0.6909251473913881
Energy: 0.4441696481562463
Energy: 0.5963164139380663
Energy: 0.5841092180938745
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Energy: 0.5617265388191407
Energy: 0.5928856918922829
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Energy: 0.5659786803280991
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Energy: 0.5852790263281976
Energy: 0.5817749116177844
Energy: 0.5845870936666285
Energy: 0.5819383327277398
Energy: 0.6794265258281038
Energy: 0.7279267867414903
Energy: 0.631063476765537
Energy: 0.6091632281755639
Energy: 0.7625753861219382
Energy: 0.6140248290747686
Energy: 0.6895393929157883
Energy: 0.7832212414128799
Energy: 0.6914493471133063
Energy: 0.6795014237667915
Energy: 0.8262971048895473
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Energy: 0.7805396494277717
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Energy: 0.6546748947097912
Energy: 0.630755140765036
Energy: 0.5885085014684346
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Energy: 0.6096761971686805
Energy: 1.0513910180593444
Energy: 0.7133529560654386
Energy: 0.7480128644798175
Energy: 0.9970005102042993
Energy: 0.797959871780917
Energy: 0.7982488874703999

minimum gb energy = 0.4218464757729858 eV
minimum distance =  2.71791972897268 Angstroms
sigma value = 67


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

Energy: 0.6795252390569597
Energy: 0.5178884430598693
Energy: 0.4719632986353925
Energy: 0.6808672960620044
Energy: 0.517767585382811
Energy: 0.47166733694265967
Energy: 0.6134217441107966
Energy: 0.5013968396817343
Energy: 0.4696816788545549
Energy: 0.6130148457669135
Energy: 0.5013944256044462
Energy: 0.4695161813476992
Energy: 0.5616297445476188
Energy: 0.4613215858709985
Energy: 0.4835351547528121
Energy: 0.5617542449401747
Energy: 0.4614013719649064
Energy: 0.47042684590305645
Energy: 0.5556359095107276
Energy: 0.477441277966529
Energy: 0.4686575166958657
Energy: 0.5558726275711049
Energy: 0.5224842796733598
Energy: 0.4686464916422157
Energy: 0.5053658251441685
Energy: 0.5373089829153418
Energy: 0.47800669318064887
Energy: 0.505638460523958
Energy: 0.46886840920624967
Energy: 0.47667480036489535
Energy: 0.5061335898758337
Energy: 0.5607034222251552
Energy: 0.5061042858152731
Energy: 0.506178003953129
Energy: 0.5604931240772428
Energy: 0.5061529425300941
Energy: 0.6775989987593943
Energy: 0.5001223119380203
Energy: 0.5001561222690789
Energy: 0.6643542467128555
Energy: 0.49967732774077156
Energy: 0.46853060009424957

minimum gb energy = 0.4613215858709985 eV
minimum distance =  2.74338499244982 Angstroms
sigma value = 3


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

Energy: 0.9476521522624802
Energy: 0.7233700391411317
Energy: 0.7613706614288072
Energy: 0.954452409839905
Energy: 0.7234593994970575
Energy: 0.7621905262194283
Energy: 0.7451897211186337
Energy: 0.6964205461891941
Energy: 0.6467428454242602
Energy: 0.7230137358284974
Energy: 0.7019246688361528
Energy: 0.5348174325763437
Energy: 0.6216092711717375
Energy: 0.751987849381222
Energy: 0.6018876607871403
Energy: 0.5784810981705446
Energy: 0.785701560567739
Energy: 0.6083216933456551
Energy: 0.5343678004309917
Energy: 0.5657747006836337
Energy: 0.5464280074567054
Energy: 0.535192855842882
Energy: 0.8278059958689863
Energy: 0.5393251876077876
Energy: 0.5331277165093776
Energy: 0.6158179284868722
Energy: 0.574772138551226
Energy: 0.5329189383255754
Energy: 0.7054723274344189
Energy: 0.5391708325689872
Energy: 0.6434476634555523
Energy: 0.7035725284717546
Energy: 0.7002739374932164
Energy: 0.6445824575509072
Energy: 0.7197758196648415
Energy: 0.6552383812868823
Energy: 0.7610198718132676
Energy: 0.6389016401555415
Energy: 0.6330151894463886
Energy: 0.7156469530724703
Energy: 0.6411365766344739
Energy: 0.6107596574270544
Energy: 0.86694775119717
Energy: 0.8649985545630775
Energy: 0.7338273202734961
Energy: 0.8799950040438649
Energy: 0.8657294460725115
Energy: 0.83039703191537
Energy: 0.761661980253961
Energy: 0.6466520660220859
Energy: 0.6416393391515522
Energy: 0.7629507730500367
Energy: 0.624113957314732
Energy: 0.6167874169337021
Energy: 0.8527540426984324
Energy: 0.6472924482496096
Energy: 0.6489153968724225
Energy: 0.8531475592685188
Energy: 0.9201791310565925
Energy: 0.7487051498146041
Energy: 0.6452485764493733
Energy: 0.6100599899993334
Energy: 0.6406089519211808
Energy: 0.6462637632406086
Energy: 0.5334580195235129
Energy: 0.6428803000707319
Energy: 0.7170596285477321
Energy: 0.5969018800974137
Energy: 0.6151040816369912
Energy: 0.6960551587317994
Energy: 0.5736717610765081
Energy: 0.6186048493691868
Energy: 0.7084041391022288
Energy: 0.5579924887457232
Energy: 0.5340370809687978
Energy: 0.7065983712929573
Energy: 0.5376989020103234
Energy: 0.6581370421531962
Energy: 0.791171466862015
Energy: 0.5387452676383795
Energy: 0.5347113079725385
Energy: 0.7924792235775671
Energy: 0.5386880175456148
Energy: 0.5348231582379142
Energy: 0.755107308205729
Energy: 0.6042714534941177
Energy: 0.7107598559658144
Energy: 0.7561844479725538
Energy: 0.5961424984940635
Energy: 0.6047636153243632
Energy: 0.8063097409550188
Energy: 0.5665980604305456
Energy: 0.5820503103200475
Energy: 0.8079551077010584
Energy: 0.7187650939632777
Energy: 0.6024306958458362
Energy: 0.7312411398308126
Energy: 0.7234579640784463
Energy: 0.6921962824879694
Energy: 0.738015093144372
Energy: 1.0345193843011187
Energy: 0.7125630351056461
Energy: 0.7328421934476473
Energy: 0.6560669445720599
Energy: 0.5745031810009479
Energy: 0.7289280921347951
Energy: 0.6086348777778956
Energy: 0.6280250654060788
Energy: 0.9216556456780862
Energy: 0.6962492602719671
Energy: 0.6296681363408874
Energy: 0.8708519981359266
Energy: 0.7621490149232149
Energy: 0.6326289731681447
Energy: 0.8525217094051127
Energy: 0.6162751666362218
Energy: 0.5903983990918401
Energy: 0.9183407124392392
Energy: 0.6227261085055757
Energy: 0.6483396787008804
Energy: 0.6663778584241814
Energy: 0.5721443814809195
Energy: 0.5712500058933467
Energy: 0.6611371133915759
Energy: 0.5707129062375669
Energy: 0.5773843011156976
Energy: 0.6528172680418419
Energy: 0.6347284971262581
Energy: 0.5895385532900712
Energy: 0.6540648423727067
Energy: 0.6498950648494889
Energy: 0.6112520399995405
Energy: 0.5918162441863324
Energy: 0.6426098420263183
Energy: 0.5892922375931666
Energy: 0.5928595558873191
Energy: 0.6864935570588521
Energy: 0.5973940918753063
Energy: 0.7265681849661472
Energy: 0.7399045498205709
Energy: 0.6131492264877004
Energy: 0.7282644948335731
Energy: 0.8589930472543739
Energy: 0.7241685414493135
Energy: 0.7227562634184997
Energy: 0.7041563053230406
Energy: 0.662936760747891
Energy: 0.7006024676172643
Energy: 0.5927230194961163
Energy: 0.5981070265897219
Energy: 0.9232522246337409
Energy: 0.6716771170227812
Energy: 0.656975333706482
Energy: 0.8815335485679836
Energy: 0.8034980381399157
Energy: 0.7487695994554969
Energy: 0.8878907461188821
Energy: 0.7289632405878012
Energy: 0.6774368142975594
Energy: 0.8777580414818537
Energy: 0.7180139835761615
Energy: 0.6830613557103926
Energy: 0.740166020646229
Energy: 0.7065163061193919
Energy: 0.6647083989504385
Energy: 0.7030324630025704
Energy: 0.7426860568937402
Energy: 0.594919076162733
Energy: 0.640616095343693
Energy: 0.7512686889316671
Energy: 0.6023569903131021
Energy: 0.6408785294006901
Energy: 0.8033612235342321
Energy: 0.6392693592606705
Energy: 0.5414062368486396
Energy: 0.6003070039024967
Energy: 0.5426431810708436
Energy: 0.5425179212072819
Energy: 0.71615131321409
Energy: 0.5466438940732049
Energy: 0.6193866714542603
Energy: 0.7008733397517953
Energy: 0.5976388078113315
Energy: 0.6201336325782902
Energy: 0.7307852874026027
Energy: 0.6025530532774096
Energy: 0.7034922619804962
Energy: 0.6526349897756287
Energy: 0.6363280840918147
Energy: 0.6539532023629115
Energy: 0.6496717338287228
Energy: 0.6154489214372743
Energy: 0.9401338933215723
Energy: 0.6471829422923229
Energy: 0.6293772523965347
Energy: 0.9227793697810039
Energy: 0.6451535264073152
Energy: 0.6914768273977933
Energy: 0.8806708333231976
Energy: 0.6953337714546991
Energy: 0.6689945245148717
Energy: 0.8742457538345041
Energy: 0.798587999995331
Energy: 0.6761934796375074
Energy: 0.729158164816687
Energy: 0.6964626012600168
Energy: 0.6785230974090924
Energy: 0.64563552454925
Energy: 0.7113349323959499
Energy: 0.6602676234165379
Energy: 0.6943923712062224
Energy: 0.6578487697683878
Energy: 0.672708745552156
Energy: 0.6953776905179857
Energy: 0.9120176469012448
Energy: 0.7102904881850665
Energy: 0.6703924198143256
Energy: 0.6170447164559809
Energy: 0.6045429649343746
Energy: 0.6710186985289666
Energy: 0.6657144122217563
Energy: 0.6134054681717068
Energy: 0.6992988651663834
Energy: 0.5990726524431889
Energy: 0.5800317654748417
Energy: 0.700042855627023
Energy: 0.5418674190341881
Energy: 0.6774028209479456
Energy: 0.6853870392317858
Energy: 0.5341686411068495
Energy: 0.5347430804175445
Energy: 0.6864762909852472
Energy: 0.5397049646023535
Energy: 0.5346444693273039
Energy: 0.7537576834598441
Energy: 0.568357857706886
Energy: 0.5700656725812394
Energy: 0.7550752232786987
Energy: 0.603346927574766
Energy: 0.6172194679194561
Energy: 0.8285407404094041
Energy: 0.6198827139118871
Energy: 0.6052898262808661
Energy: 0.7997155644596058
Energy: 0.6459267489227289
Energy: 0.6367677170672456
Energy: 0.7081004510222902
Energy: 0.618956513841952
Energy: 0.6561009717838807
Energy: 0.7013594150215721
Energy: 0.7896283263040181
Energy: 0.6955843180922319
Energy: 0.7702180998827449
Energy: 0.7196480581497637
Energy: 0.7152373211612105
Energy: 0.7661137401462834
Energy: 0.9815355869034463
Energy: 0.7161251863064558
Energy: 0.8031772416822609
Energy: 0.5862551468062865
Energy: 0.5861422716370752
Energy: 0.8036365168346726
Energy: 0.7714561525001913
Energy: 0.6040408002675846
Energy: 0.8190030604446942
Energy: 0.6732576544545371
Energy: 0.6535643922110971
Energy: 0.8203895315784934
Energy: 0.6722566566145832
Energy: 0.6453884553772608
Energy: 0.7570818972178606
Energy: 0.5763145829206197
Energy: 0.5731807970547509
Energy: 0.7576660290641883
Energy: 0.5749592979091124
Energy: 0.5732467595915157
Energy: 0.6550824645161154
Energy: 0.5608251263793704
Energy: 0.5731465505317145
Energy: 0.6561522232506709
Energy: 0.6511641773358716
Energy: 0.6628209196115536
Energy: 0.5728846810626784
Energy: 0.6376407588336269
Energy: 0.5896616132011409
Energy: 0.5651139615722844
Energy: 0.5932547566693529
Energy: 0.5702575759937843
Energy: 0.6018315908941168
Energy: 0.5528233367652496
Energy: 0.6209658211092544
Energy: 0.6027538550307563
Energy: 0.8920260424582701
Energy: 0.5905384220635382
Energy: 0.7678185825291319
Energy: 0.6820388337300984
Energy: 0.6332354678552091
Energy: 0.745820080901657
Energy: 0.8459692108376555
Energy: 0.612818830945068
Energy: 0.7354029261688015
Energy: 0.7251002999320678
Energy: 0.713166004880788
Energy: 0.7022643809536208
Energy: 0.6574429547778382
Energy: 0.5883845920975088

minimum gb energy = 0.5329189383255754 eV
minimum distance =  2.6546232094737 Angstroms
sigma value = 81


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

Energy: 0.9546518527703493
Energy: 0.6197815497889214
Energy: 0.5307563539263934
Energy: 0.8927943425970652
Energy: 0.6170647650930852
Energy: 0.820065525914698
Energy: 0.6961049809177418
Energy: 0.564006962997518
Energy: 0.5639917916061635
Energy: 0.5732486452532244
Energy: 0.5646943332641877
Energy: 0.5629356264059191
Energy: 0.7275819059626
Energy: 0.5688009717250094
Energy: 0.6071091912628921
Energy: 0.645864269568229
Energy: 0.6719560918161469
Energy: 0.6863921377608343
Energy: 0.6268510703582807
Energy: 0.5735092985071997
Energy: 0.6697196114368986
Energy: 0.6490903218474829
Energy: 0.5536866112212084
Energy: 0.6560310480602701
Energy: 0.6088382020649072
Energy: 0.6263824449355561
Energy: 0.626414864053676
Energy: 0.6133759277756633
Energy: 0.829200179550148
Energy: 0.6201104379523511
Energy: 0.7448234206086449
Energy: 0.762673433032442
Energy: 0.7608010077210926
Energy: 0.7494564649541302
Energy: 0.6785664006255429
Energy: 0.7570826048484912
Energy: 0.6933020202506011
Energy: 0.6032149985127433
Energy: 0.6084575989618424
Energy: 0.7348794923926294
Energy: 0.6036540477473272
Energy: 0.6295655062826571
Energy: 0.8432216786534305
Energy: 0.7610382860595896
Energy: 0.761142086611918
Energy: 0.843972495969525
Energy: 0.7498223647745998
Energy: 0.6599694324142013
Energy: 0.710439263560858
Energy: 0.6300209432169631
Energy: 0.6148152697218914
Energy: 0.707614184109793
Energy: 0.5971505320719356
Energy: 0.6292834891690593
Energy: 0.7062404203746134
Energy: 0.6518244470905483
Energy: 0.8006059070660734
Energy: 0.6197071534143183
Energy: 0.868401575721516
Energy: 0.6536721324528119
Energy: 0.6168027388074735
Energy: 0.554532633902711
Energy: 0.5533700771550739
Energy: 0.620313261088426
Energy: 0.49097805551097173
Energy: 0.5804180783059714
Energy: 0.6645081802272991
Energy: 0.6452540788841711
Energy: 0.6854523104276251
Energy: 0.553481623813212
Energy: 0.6765746470376637
Energy: 0.6419302787108433
Energy: 0.670919092739762
Energy: 0.6420903088265846
Energy: 0.6425666156626262
Energy: 0.6717830178772368
Energy: 0.651076244635075
Energy: 0.6055804766058968
Energy: 0.8243771086272857
Energy: 0.611732544567494
Energy: 0.6193419012522363
Energy: 0.6536231014576541
Energy: 0.6186372121471686
Energy: 0.619954076023418
Energy: 0.8440410758104934
Energy: 0.6396426684819785
Energy: 0.7612485341590115
Energy: 0.8425159378483181
Energy: 0.6483465390422483
Energy: 0.760869370078361
Energy: 0.6009729881030339
Energy: 0.6383825119881062
Energy: 0.6340870924967417
Energy: 0.60154451361397
Energy: 0.7653273029104739
Energy: 0.6330427127938618
Energy: 0.7384667636317653
Energy: 0.8177013997645328
Energy: 0.7084417161391823
Energy: 0.7385867623117311
Energy: 0.8446705391408352
Energy: 0.6438083811972957
Energy: 0.6677811587092155
Energy: 0.6409633796141309
Energy: 0.6728087849498152
Energy: 0.6309954702753532
Energy: 0.6802989542244017
Energy: 0.6392890937408291
Energy: 0.8978311572452503
Energy: 0.6320136037381483
Energy: 0.6532644146508397
Energy: 0.8989280328685418
Energy: 0.7542203660981142
Energy: 0.5174131280959867
Energy: 0.8959829911348896
Energy: 0.6302193880964363
Energy: 0.6531829123514223
Energy: 0.7573360792662029
Energy: 0.6577645584697924
Energy: 0.6528088136753974
Energy: 0.6306000611067014
Energy: 0.6615814579335554
Energy: 0.6623769130283979
Energy: 0.6420561326188664
Energy: 0.67515905218892
Energy: 0.6818110954548651
Energy: 0.7288817982925051
Energy: 0.6217530737315109
Energy: 0.6043070059906619
Energy: 0.7298397502994263
Energy: 0.6708068369286592
Energy: 0.6046886540931398
Energy: 0.6259639083743311
Energy: 0.6150956494815042
Energy: 0.6281277779420017
Energy: 0.6264277190912659
Energy: 0.6330974407849607
Energy: 0.6264719236566676
Energy: 0.6182893212776347
Energy: 0.7494073790764152
Energy: 0.7572050763359037
Energy: 0.6190588384771814
Energy: 0.8342690330459138
Energy: 0.7615796162110204
Energy: 0.732202220010522
Energy: 0.6102079249887322
Energy: 0.6245527104017599
Energy: 0.7386133252061319
Energy: 0.6016408692191726
Energy: 0.6216190554134542
Energy: 0.8452353903783089
Energy: 0.7101330892611261
Energy: 0.7831494400522736
Energy: 0.8457932937725342
Energy: 0.7183596356595665
Energy: 0.6646669577316331
Energy: 0.8097681603401626
Energy: 0.5998678530225274
Energy: 0.6047863439171053
Energy: 0.8101843491001545
Energy: 0.6875096253733262
Energy: 0.6769533188310599
Energy: 0.7212002316749724
Energy: 0.5050265307047835
Energy: 0.6183536798339765
Energy: 0.721342911874181
Energy: 0.5205831266181552
Energy: 0.5822321671444549
Energy: 0.6086351428861096
Energy: 0.683272720343566
Energy: 0.7831613186241828
Energy: 0.6231751463099071
Energy: 0.9267154157820839
Energy: 0.6519481614011505
Energy: 0.6143801390555258
Energy: 0.6433998704410545
Energy: 0.622216289798805
Energy: 0.6124144546468554
Energy: 0.6147786219859058
Energy: 0.6678552952609863
Energy: 0.6720697139506697
Energy: 0.7140310644499048
Energy: 0.7152669105508872
Energy: 0.6728514758742344
Energy: 0.7294026861910464
Energy: 0.6658005387106919
Energy: 0.5990940681665259
Energy: 0.6156548898461004
Energy: 0.6193314690810232
Energy: 0.5846116362864845
Energy: 0.6217428250060876
Energy: 0.5713588872431133
Energy: 0.8487126244387942
Energy: 0.6260736943572196
Energy: 0.6293675450436261
Energy: 0.8435030078609975
Energy: 0.6164005670142549
Energy: 0.7571406115802897
Energy: 0.7979131555296273
Energy: 0.6232992625067801
Energy: 0.6257502818100539
Energy: 0.8031122324927717
Energy: 0.7328889544657919
Energy: 0.6229813892694276
Energy: 0.6111702133165484
Energy: 0.5674519875869546
Energy: 0.6579927369001982
Energy: 0.6231643485212706
Energy: 0.8411300535906772
Energy: 0.5651613791103586
Energy: 0.7561268639575147
Energy: 0.7674996394191578
Energy: 0.6392639099784561
Energy: 0.7291094450241002
Energy: 0.8397276445976137
Energy: 0.7240221075024064
Energy: 0.7012390244601885
Energy: 0.564050317629413
Energy: 0.5730275316551461
Energy: 0.5729115872562498
Energy: 0.6599872785024119
Energy: 0.5820332637044412
Energy: 0.9548412109967314
Energy: 0.5887835289497182
Energy: 0.7480375050906547
Energy: 0.8930979244192918
Energy: 0.5759092203547082
Energy: 0.7380973009705436

minimum gb energy = 0.49097805551097173 eV
minimum distance =  2.65703698893169 Angstroms
sigma value = 43


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

Energy: 0.9702369805422582
Energy: 0.7526044672508801
Energy: 0.7296011464027483
Energy: 0.971274531937952
Energy: 0.749168310801349
Energy: 0.7142932822428394
Energy: 0.7391673742009093
Energy: 0.5769207129335042
Energy: 0.5774740897433894
Energy: 0.7058909452342387
Energy: 0.5768905451333386
Energy: 0.6063817836329806
Energy: 0.7270644875281043
Energy: 0.6621475921423774
Energy: 0.5927749121853201
Energy: 0.7267409901517194
Energy: 0.7364575391089814
Energy: 0.6025302664479706
Energy: 0.5440055225122326
Energy: 0.5374848245672945
Energy: 0.5438421698657727
Energy: 0.5439063311245583
Energy: 0.6573536907311275
Energy: 0.5437669263437981
Energy: 0.5417613710996708
Energy: 0.6320873021571501
Energy: 0.6014607750051549
Energy: 0.5326086431916663
Energy: 0.5272102796334989
Energy: 0.5446360851870352
Energy: 0.6449937749277244
Energy: 0.5667513102369803
Energy: 0.5868414641757492
Energy: 0.6448820580151768
Energy: 0.5283780072654667
Energy: 0.6067359735372984
Energy: 0.5906341211253738
Energy: 0.5485843452426912
Energy: 0.5485691832521276
Energy: 0.589839878368836
Energy: 0.5486224767053578
Energy: 0.5486948221937871
Energy: 0.8068516911986846
Energy: 0.6027312591361469
Energy: 0.6532010614849515
Energy: 0.8076174088390105
Energy: 0.6013003866301246
Energy: 0.6237431991416225
Energy: 0.6953487683509357
Energy: 0.5933467915336047
Energy: 0.5530981829870675
Energy: 0.6813565250646113
Energy: 0.7086729038227134
Energy: 0.5536627980208444
Energy: 0.7976762193025745
Energy: 0.6704410866635743
Energy: 0.6177989373597383
Energy: 0.7978514124104575
Energy: 0.8525326927087837
Energy: 0.6526937633355435
Energy: 0.6423622417672911
Energy: 0.6082647105060565
Energy: 0.6820859608306656
Energy: 0.642427621593437
Energy: 0.6192237520182077
Energy: 0.6849961140399744
Energy: 0.7520620235865347
Energy: 0.6512205857091018
Energy: 0.5930021189964221
Energy: 0.5168311243954896
Energy: 0.7231943546276294
Energy: 0.5461949382012802
Energy: 0.8351148310600581
Energy: 0.5839290334310818
Energy: 0.5508264525359804
Energy: 0.8189703628364583
Energy: 0.5833188256062887
Energy: 0.5490746437927112
Energy: 0.5989648896174117
Energy: 0.6084892383803768
Energy: 0.5974097791819185
Energy: 0.5992917084207159
Energy: 0.5839291208554067
Energy: 0.6039980667652476
Energy: 0.5425857954837195
Energy: 0.6451110226954593
Energy: 0.6004526268775933
Energy: 0.5428661542419656
Energy: 0.6635257035222619
Energy: 0.5982444905076999
Energy: 0.5337275335708939
Energy: 0.5970261997829472
Energy: 0.5346575731046693
Energy: 0.5335399521714647
Energy: 0.6049886171994019
Energy: 0.5335675379716783
Energy: 0.5551118730643199
Energy: 0.6011034511019929
Energy: 0.6010471860258685
Energy: 0.5550820229146504
Energy: 0.742077354571889
Energy: 0.5996318290978283
Energy: 0.6406942851563631
Energy: 0.6703776949749641
Energy: 0.6076200194612534
Energy: 0.7028243583408351
Energy: 0.6530068033884219
Energy: 0.6085853615480218
Energy: 0.7672883836035435
Energy: 0.6663871265721785
Energy: 0.666318766199073
Energy: 0.7593711192585224
Energy: 0.6771914229940018
Energy: 0.6447318280238521
Energy: 0.6686501306441117
Energy: 0.7485163941482676
Energy: 0.7037299864325727
Energy: 0.6686076390073181
Energy: 0.7430062243690073
Energy: 0.5966969297863763
Energy: 0.6518587478212066
Energy: 0.6362132606019489
Energy: 0.6458101864648879
Energy: 0.6459285001165872
Energy: 0.6466442669066356
Energy: 0.6380237680983782
Energy: 0.7018384899841742
Energy: 0.8029560325802323
Energy: 0.8028844081731092
Energy: 0.7018107164998596
Energy: 0.8822881969568215
Energy: 0.706525562821168
Energy: 0.6298664425203243
Energy: 0.5883158865801272
Energy: 0.6220336045160517
Energy: 0.6298718549894491
Energy: 0.6848249873011656
Energy: 0.6117247076343154
Energy: 0.7530095572699298
Energy: 0.7008457897186593
Energy: 0.6223562497867983
Energy: 0.7177847812025422
Energy: 0.6873742590441154
Energy: 0.613918799574522
Energy: 0.6634763503722368
Energy: 0.532507924898682
Energy: 0.5328538633015786
Energy: 0.6599078358761612
Energy: 0.5328778874228288
Energy: 0.5264025852952954
Energy: 0.588857959873072
Energy: 0.5180793144000385
Energy: 0.5178591733793835
Energy: 0.6000708337089085
Energy: 0.5180983312626904
Energy: 0.5690273037779154
Energy: 0.5945732536480252
Energy: 0.641206279622065
Energy: 0.6132098405180824
Energy: 0.5917641416677057
Energy: 0.6515208875201938
Energy: 0.6144987569129671
Energy: 0.6013596062892382
Energy: 0.6188094102673514
Energy: 0.6158402014822999
Energy: 0.5968433012439179
Energy: 0.5830817166568261
Energy: 0.5828923562795216
Energy: 0.6579388513845695
Energy: 0.6113026091750497
Energy: 0.7453960645916773
Energy: 0.6265835017511067
Energy: 0.8198164156083648
Energy: 0.5972458462663899
Energy: 0.728954211019038
Energy: 0.5768560365417882
Energy: 0.5999528468728849
Energy: 0.7290699483663917
Energy: 0.5365562255240452
Energy: 0.5814043243051983
Energy: 0.9689140732794922
Energy: 0.7955647046442965
Energy: 0.6903905623068114
Energy: 0.9615949994405778
Energy: 0.7799706222104655
Energy: 0.7197968373620289

minimum gb energy = 0.5168311243954896 eV
minimum distance =  2.68766446467471 Angstroms
sigma value = 57


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

Energy: 0.7687257467803139
Energy: 0.7993095574112369
Energy: 0.6058377019029806
Energy: 0.7699795522713284
Energy: 0.79938351377005
Energy: 0.6050406023165172
Energy: 0.6402917981611452
Energy: 0.5526185520333887
Energy: 0.5522592728731596
Energy: 0.5524428092065055
Energy: 0.5525425095075008
Energy: 0.5845418452666404
Energy: 0.674317483738381
Energy: 0.6221038799080505
Energy: 0.6103594247807398
Energy: 0.6734604389786923
Energy: 0.6772470658608921
Energy: 0.5515409959018219
Energy: 0.5405632433624958
Energy: 0.6068940852539512
Energy: 0.5641422756639528
Energy: 0.540633761455109
Energy: 0.6416346653992371
Energy: 0.5353213844448063
Energy: 0.5861510279772384
Energy: 0.6433495499923638
Energy: 0.642837114247998
Energy: 0.5842549984659351
Energy: 0.6589232711661562
Energy: 0.5674189895030074
Energy: 0.6401687635445192
Energy: 0.5759230394607073
Energy: 0.6016813468964584
Energy: 0.6910366622408348
Energy: 0.5760571761304938
Energy: 0.5895145134742181
Energy: 0.5927063022761001
Energy: 0.5395963621173654
Energy: 0.5396415112965768
Energy: 0.5933345417000584
Energy: 0.5418899547005878
Energy: 0.5396621573366984
Energy: 0.696202721305372
Energy: 0.5863097862822816
Energy: 0.5774763464086646
Energy: 0.6965771927790023
Energy: 0.5492999498887705
Energy: 0.579242941703092
Energy: 0.5713521324858858
Energy: 0.5812031737084605
Energy: 0.5845717310517088
Energy: 0.5454939413686011
Energy: 0.6400520010487062
Energy: 0.5846079172409843
Energy: 0.786665741130231
Energy: 0.6385546705638787
Energy: 0.6385861241498803
Energy: 0.786657246808257
Energy: 0.8961365413487423
Energy: 0.5398631263087468
Energy: 0.6403569799251957
Energy: 0.6048659465202448
Energy: 0.5981461801312872
Energy: 0.6404638125855193
Energy: 0.5592009710204656
Energy: 0.5927223092964979
Energy: 0.5152210252656189
Energy: 0.6410380511686133
Energy: 0.5853956912559853
Energy: 0.5157113853282768
Energy: 0.6403587429061836
Energy: 0.5801950295659579
Energy: 0.5173808186704438
Energy: 0.5849793407733977
Energy: 0.5752581737844178
Energy: 0.5145440879141818
Energy: 0.5537729524486776
Energy: 0.5805965822519815
Energy: 0.6400251376866826
Energy: 0.5519653814077565
Energy: 0.5810952018848774
Energy: 0.640164498282201
Energy: 0.5519711257697383
Energy: 0.6054902877451929
Energy: 0.5399818066192348
Energy: 0.6221893213834636
Energy: 0.6542428863508738
Energy: 0.5355763663759511
Energy: 0.7172295732234888
Energy: 0.6547992337109527
Energy: 0.5394028100745855
Energy: 0.5966816436340395
Energy: 0.541084780340484
Energy: 0.5404171749401788
Energy: 0.5843171695619838
Energy: 0.5439681399178481
Energy: 0.5310524798156872
Energy: 0.6437225639585296
Energy: 0.6434913608203707
Energy: 0.5860041348907179
Energy: 0.6915155968633706
Energy: 0.5575634583622777
Energy: 0.5656006860880313
Energy: 0.5407179659690368
Energy: 0.5759169684136355
Energy: 0.5656197620451048
Energy: 0.5404803072101146
Energy: 0.6116905846240873
Energy: 0.5928873213978446
Energy: 0.5408819440015403
Energy: 0.5484992938245151
Energy: 0.5927955594457044
Energy: 0.540744355139019
Energy: 0.5485964539484735
Energy: 0.5929335957675501
Energy: 0.6829391155639445
Energy: 0.5932428077116111
Energy: 0.5929867734427721
Energy: 0.7095347779546785
Energy: 0.5931893358247626
Energy: 0.5524475950415554
Energy: 0.581331242017384
Energy: 0.5814048791085205
Energy: 0.5524650758500766
Energy: 0.5518855533550049
Energy: 0.591714981252471
Energy: 0.8502342530858543
Energy: 0.6434993905519644
Energy: 0.6433898024777941
Energy: 0.8494265052342534
Energy: 0.8693630198640722
Energy: 0.6153043881601362
Energy: 0.6400212068460097
Energy: 0.5519820074280485
Energy: 0.5811525504981088
Energy: 0.6402208816362678
Energy: 0.6401439613631593
Energy: 0.6056011053411986
Energy: 0.5157960942144624
Energy: 0.679113952616695
Energy: 0.580336207594085
Energy: 0.5146217322335594
Energy: 0.6492775460961733
Energy: 0.5805196134999255

minimum gb energy = 0.5145440879141818 eV
minimum distance =  2.71735179914306 Angstroms
sigma value = 17


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

Energy: 0.8434562055148896
Energy: 0.7582038795561397
Energy: 0.6339050547884985
Energy: 0.8446991969303391
Energy: 0.7744050302582708
Energy: 0.5433240015689997
Energy: 0.7241725227415535
Energy: 0.5671312475048667
Energy: 0.582212761331493
Energy: 0.6601503740365604
Energy: 0.5737187850443646
Energy: 0.5815419171899352
Energy: 0.7017197212018356
Energy: 0.5838582637075228
Energy: 0.5763385144757751
Energy: 0.6906180892105516
Energy: 0.6709811301883538
Energy: 0.5457345382614874
Energy: 0.5468232822796083
Energy: 0.5835550673620743
Energy: 0.5407239217981316
Energy: 0.5468039774708214
Energy: 0.6840791860950324
Energy: 0.5739649641195922
Energy: 0.5354934937808995
Energy: 0.5405348313984282
Energy: 0.6021187749301407
Energy: 0.535519501390754
Energy: 0.6562196855393543
Energy: 0.6031218109330222
Energy: 0.7262630578518853
Energy: 0.48566027893040176
Energy: 0.5360774229664467
Energy: 0.7269566304523052
Energy: 0.485353078877205
Energy: 0.5930738064305496
Energy: 0.6352428984854405
Energy: 0.479156396491767
Energy: 0.4791892210190355
Energy: 0.6354143346845684
Energy: 0.4797530229294899
Energy: 0.5236114267060762
Energy: 0.6924121371320232
Energy: 0.5503618395608283
Energy: 0.5747095015853247
Energy: 0.694997143969956
Energy: 0.6163359041645275
Energy: 0.5757341166658568
Energy: 0.48098839363099927
Energy: 0.5681841275857421
Energy: 0.5336457094189022
Energy: 0.4819118631842691
Energy: 0.6182441130438272
Energy: 0.4794360711394998
Energy: 0.48496153580941936
Energy: 0.5439871880357251
Energy: 0.5907218166396248
Energy: 0.4852218016831173
Energy: 0.560326068808603
Energy: 0.5439049842231151
Energy: 0.6712037198403124
Energy: 0.5366886881393166
Energy: 0.5371964280758013
Energy: 0.6626458275119609
Energy: 0.547225421615792
Energy: 0.5362557748190947
Energy: 0.718513246707868
Energy: 0.5484916495388168
Energy: 0.5468699909892775
Energy: 0.717876060858791
Energy: 0.5482461941714368
Energy: 0.5475045722375054
Energy: 0.7005521540392191
Energy: 0.6435306352982112
Energy: 0.5856209252476013
Energy: 0.640056827117726
Energy: 0.6982504397340408
Energy: 0.5847793024038968
Energy: 0.5986622410548711
Energy: 0.5750776693004911
Energy: 0.5828839071871534
Energy: 0.5986613581700488
Energy: 0.6461602641490578
Energy: 0.6086573635211839
Energy: 0.756755297049167
Energy: 0.6446067257714391
Energy: 0.6448799124813392
Energy: 0.7506320071665847
Energy: 0.6457319576457965
Energy: 0.5606503536824767
Energy: 0.6385182223197198
Energy: 0.5734391367378421
Energy: 0.5818086607733873
Energy: 0.6385733769542508
Energy: 0.5735459576541532
Energy: 0.5825701356414623
Energy: 0.710882716755748
Energy: 0.6529551895635521
Energy: 0.5997926575081897
Energy: 0.7108381597726753
Energy: 0.6536545863752049
Energy: 0.6000148989699685

minimum gb energy = 0.479156396491767 eV
minimum distance =  2.69136377330353 Angstroms
sigma value = 17


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

Energy: 0.8798448435819223
Energy: 0.7014350807235641
Energy: 0.5227923121421668
Energy: 0.8811884793545969
Energy: 0.7023335440089895
Energy: 0.5625128261431853
Energy: 0.6908034724845352
Energy: 0.5512685342906851
Energy: 0.5822548074736081
Energy: 0.6467107544469285
Energy: 0.6377340163437166
Energy: 0.6169902472714753
Energy: 0.6558178163985334
Energy: 0.5509104609388321
Energy: 0.5511902371725453
Energy: 0.6566608792812069
Energy: 0.5993979969639271
Energy: 0.5223639321705288
Energy: 0.5420421841368144
Energy: 0.5504977566667848
Energy: 0.518389641434222
Energy: 0.5434916638597713
Energy: 0.6397590117101286
Energy: 0.4865058135521441
Energy: 0.5521255170338897
Energy: 0.5112126939289774
Energy: 0.5129408153016516
Energy: 0.552564342740958
Energy: 0.6292885593102368
Energy: 0.5533095010164655
Energy: 0.7676980904720249
Energy: 0.47124381552643296
Energy: 0.5323884903738181
Energy: 0.6630312678760665
Energy: 0.4712400594817344
Energy: 0.48647253465091794
Energy: 0.5844579259700934
Energy: 0.4648863316827143
Energy: 0.46496893467830525
Energy: 0.5463919042551987
Energy: 0.4665376798007076
Energy: 0.49381381406943775
Energy: 0.6570214229347344
Energy: 0.5507151627420334
Energy: 0.5513966956887114
Energy: 0.6562688816315432
Energy: 0.5506465353935914
Energy: 0.5239570438342496
Energy: 0.4360783649750565
Energy: 0.534405729649935
Energy: 0.4351893320239576
Energy: 0.4368604062194175
Energy: 0.6129610315435505
Energy: 0.43583717435097535
Energy: 0.4406247203130236
Energy: 0.5050873414372238
Energy: 0.5359171792136633
Energy: 0.4349345571379448
Energy: 0.5108663811909901
Energy: 0.5301525117135272
Energy: 0.601822420067968
Energy: 0.4397882264742988
Energy: 0.529093258976456
Energy: 0.5811141705897499
Energy: 0.4397575330127413
Energy: 0.5298368343893719
Energy: 0.6042224627993227
Energy: 0.435606719894003
Energy: 0.43524466815349105
Energy: 0.5597501874587878
Energy: 0.43880392355158204
Energy: 0.43534085585747007
Energy: 0.46483338151651526
Energy: 0.5196474593113605
Energy: 0.517421590012266
Energy: 0.549132823081404
Energy: 0.636905381141485
Energy: 0.4969595335572978
Energy: 0.4642637052842087
Energy: 0.5512998794429071
Energy: 0.5603061490012324
Energy: 0.46502407765903453
Energy: 0.558210191826658
Energy: 0.4648649844157201
Energy: 0.47117001290276284
Energy: 0.5414178246283922
Energy: 0.5408727722874072
Energy: 0.471112611273883
Energy: 0.654689159735152
Energy: 0.515012516307606
Energy: 0.6287930498174252
Energy: 0.5551114127126984
Energy: 0.5143847286501173
Energy: 0.6294976544124676
Energy: 0.59266872380393
Energy: 0.5359589925813574
Energy: 0.6017711182106582
Energy: 0.5398840445707845
Energy: 0.5398243843097229
Energy: 0.653911619259707
Energy: 0.5397393137218253
Energy: 0.49611984718892405
Energy: 0.6246935771028596
Energy: 0.5812117156752097
Energy: 0.5721335645836387
Energy: 0.5605763367179795
Energy: 0.6556574616341414
Energy: 0.5037516225923714
Energy: 0.6558157088780263
Energy: 0.55281328930987
Energy: 0.5741826668565227
Energy: 0.6564685022031891
Energy: 0.6576273581171284
Energy: 0.5755974491868248
Energy: 0.7440713782990926
Energy: 0.5543092949252599
Energy: 0.5369781131934209
Energy: 0.7440559036518871
Energy: 0.6832002789849776
Energy: 0.6060855619662168
Energy: 0.6858506260154491
Energy: 0.6369771512591468
Energy: 0.5526680206295171
Energy: 0.6866236844835942
Energy: 0.6367271988171632
Energy: 0.5592668118870459
Energy: 0.607107593026288
Energy: 0.6491033540352817
Energy: 0.5922583391088561
Energy: 0.6010939148813186
Energy: 0.6510913345923283
Energy: 0.5222805044162979
Energy: 0.6738866601690202
Energy: 0.5564556750552154
Energy: 0.5861687294583832
Energy: 0.6739005673120995
Energy: 0.583240162849161
Energy: 0.5919140786567715
Energy: 0.6578854936810177
Energy: 0.5857431994520662
Energy: 0.561540692511605
Energy: 0.6585395353009872
Energy: 0.649438320688748
Energy: 0.5611881110897333
Energy: 0.5454879998872899
Energy: 0.5132581256586636
Energy: 0.5528343429603907
Energy: 0.5454397553353961
Energy: 0.6619816013102393
Energy: 0.5257567134685307
Energy: 0.5570801907346777
Energy: 0.5289694944803939
Energy: 0.55486617595887
Energy: 0.5578223943737727
Energy: 0.49598750011633314
Energy: 0.5556249931411702
Energy: 0.5984269433273242
Energy: 0.6090336957310779
Energy: 0.5873034129569573
Energy: 0.6622006423537361
Energy: 0.6288779988192912
Energy: 0.5136011294115989
Energy: 0.6364464328201612
Energy: 0.4648470125152811
Energy: 0.4649049209324133
Energy: 0.6372197839485155
Energy: 0.4661855405353143
Energy: 0.4648909646024136
Energy: 0.6288164804377803
Energy: 0.5325471878866649
Energy: 0.5362050227912575
Energy: 0.6268415079369821
Energy: 0.4955450742462778
Energy: 0.5446770968821761
Energy: 0.4399062261020365
Energy: 0.5331591206758196
Energy: 0.5407149890370156
Energy: 0.4397973203398587
Energy: 0.5505747971467709
Energy: 0.5310280009795108
Energy: 0.4385875786316832
Energy: 0.5304735352022111
Energy: 0.5246258125315085
Energy: 0.4392768972531711
Energy: 0.5208767221201401
Energy: 0.49118868691060075
Energy: 0.6769056980598839
Energy: 0.5526389021487275
Energy: 0.5516265199673651
Energy: 0.6768387879542779
Energy: 0.4907660384908506
Energy: 0.5721096944497386
Energy: 0.6152756008582039
Energy: 0.43906752932917786
Energy: 0.43561738145976475
Energy: 0.6163593325134449
Energy: 0.43625992457427404
Energy: 0.4356781073759657
Energy: 0.7314224559341677
Energy: 0.4894561144618704
Energy: 0.5316884047423152
Energy: 0.7329466543059517
Energy: 0.4432827738831365
Energy: 0.522167803232328
Energy: 0.4742904663809974
Energy: 0.5200992852507076
Energy: 0.5479272316644919
Energy: 0.46629610762831625
Energy: 0.49252438181562175
Energy: 0.5482081023692349
Energy: 0.4675680753532564
Energy: 0.49454852312995234
Energy: 0.5113161816379344
Energy: 0.4666161702460715
Energy: 0.610260436266472
Energy: 0.46451256248208767
Energy: 0.6267395835960369
Energy: 0.5403801751950108
Energy: 0.5349646229898752
Energy: 0.6274301816897964
Energy: 0.5684380100007761
Energy: 0.5428640827848644
Energy: 0.6608714677473713
Energy: 0.5400775241092196
Energy: 0.5401705025953425
Energy: 0.6285122103333415
Energy: 0.5409902998243512
Energy: 0.5401984819751272
Energy: 0.8241718167383881
Energy: 0.6491423985752892
Energy: 0.5443572279638711
Energy: 0.6827214882836655
Energy: 0.651947939024374
Energy: 0.5319957899778454
Energy: 0.6584369350836443
Energy: 0.5582641762661368
Energy: 0.5616549153086009
Energy: 0.6594317191043245
Energy: 0.5844181068613445
Energy: 0.5424274742120633
Energy: 0.6413280533682932
Energy: 0.5190384936968069
Energy: 0.5712399089795083
Energy: 0.6415282627300595
Energy: 0.519654702173248
Energy: 0.5553623472791693
Energy: 0.6842175207416834
Energy: 0.5361657972735856
Energy: 0.5709184849479981
Energy: 0.6850560533566742
Energy: 0.6686391877898863
Energy: 0.5862800697656897
Energy: 0.6788530638536263
Energy: 0.5993389784435327
Energy: 0.5861020659522503
Energy: 0.6737734952915022
Energy: 0.6005746687330084
Energy: 0.5917914985378863

minimum gb energy = 0.4349345571379448 eV
minimum distance =  2.67728987706193 Angstroms
sigma value = 57


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

Energy: 0.7923249153353912
Energy: 0.6558785628555422
Energy: 0.5020465617676309
Energy: 0.7939157514644212
Energy: 0.7213712738055296
Energy: 0.5322792038474538
Energy: 0.6511700170983443
Energy: 0.5587963487490096
Energy: 0.5568274761446436
Energy: 0.6104188412203888
Energy: 0.6073455967540105
Energy: 0.5658528597711351
Energy: 0.6160290028419433
Energy: 0.515290728913297
Energy: 0.49425665420012777
Energy: 0.6167463165750459
Energy: 0.5499434788953216
Energy: 0.5028476417782285
Energy: 0.5253639082283583
Energy: 0.49491398902296846
Energy: 0.4968368316077596
Energy: 0.5258158885906034
Energy: 0.5789486214293066
Energy: 0.4735750459527308
Energy: 0.5917931920834986
Energy: 0.456974732739993
Energy: 0.4905138365773359
Energy: 0.5926966769250495
Energy: 0.618961171106271
Energy: 0.4630833770519776
Energy: 0.715153462155943
Energy: 0.4638369547088081
Energy: 0.4373213066159633
Energy: 0.7168099254852053
Energy: 0.4632468149960449
Energy: 0.46226556630929405
Energy: 0.6009308158947443
Energy: 0.45450245836130726
Energy: 0.4504956644389596
Energy: 0.5732570924043375
Energy: 0.453157667589912
Energy: 0.47405606770097297
Energy: 0.6041244354760533
Energy: 0.5031805747034765
Energy: 0.49035895032466603
Energy: 0.6050962599479044
Energy: 0.49783087864937225
Energy: 0.5213634004411718
Energy: 0.41761458496252274
Energy: 0.5658776795707557
Energy: 0.41561097544990244
Energy: 0.4182526239928762
Energy: 0.5788363732456293
Energy: 0.41596802448466896
Energy: 0.433540595638284
Energy: 0.4872369545957117
Energy: 0.4938922384345114
Energy: 0.4344073296971571
Energy: 0.4774858065361062
Energy: 0.4867320835278931
Energy: 0.6818926755642122
Energy: 0.41734810325391714
Energy: 0.48669647219967577
Energy: 0.49529324904067595
Energy: 0.41399131316677845
Energy: 0.4870927692569384
Energy: 0.5797774185452627
Energy: 0.40572110805339473
Energy: 0.4005374247987858
Energy: 0.5321677680193889
Energy: 0.40306643421904975
Energy: 0.4492888492609753
Energy: 0.6154201515080804
Energy: 0.5092620181245323
Energy: 0.5073874053265265
Energy: 0.48967762290034805
Energy: 0.5587738292168558
Energy: 0.518621587427163
Energy: 0.40081175951145886
Energy: 0.4864279150787323
Energy: 0.40010811471796653
Energy: 0.40197244900446677
Energy: 0.5527183437090077
Energy: 0.4006857626140308
Energy: 0.4058946946016558
Energy: 0.48534093371748344
Energy: 0.4906273333518191
Energy: 0.4060495280074387
Energy: 0.484896914759265
Energy: 0.49743957557860374
Energy: 0.6307723371746827
Energy: 0.42010550372283967
Energy: 0.5084395477190166
Energy: 0.5434079170339707
Energy: 0.4302146634138218
Energy: 0.49502028236922974
Energy: 0.538883705754992
Energy: 0.41553730944926603
Energy: 0.4163782549891049
Energy: 0.5053813490973685
Energy: 0.4202463139098153
Energy: 0.46534933631628445
Energy: 0.5142083089746247
Energy: 0.4660912288432711
Energy: 0.48314727226160065
Energy: 0.5129895087825627
Energy: 0.6093467398835287
Energy: 0.4768490331411924
Energy: 0.45050510380982306
Energy: 0.49462443451030447
Energy: 0.4506190673746712
Energy: 0.4516077909808133
Energy: 0.5804600764106034
Energy: 0.45041543058167477
Energy: 0.5819942673478341
Energy: 0.49553625472923113
Energy: 0.5012831233900171
Energy: 0.5825638650274322
Energy: 0.4748433488879262
Energy: 0.5630699409303245
Energy: 0.6154295803616678
Energy: 0.5241714632758488
Energy: 0.5605933006538364
Energy: 0.5927530301816669
Energy: 0.5206605302567198
Energy: 0.5112806072573998
Energy: 0.4621959536724438
Energy: 0.5214915623752328
Energy: 0.454308184268148
Energy: 0.5489171371388173
Energy: 0.5290445425882949
Energy: 0.5156367137895116
Energy: 0.5767147514846686
Energy: 0.5560882461935545
Energy: 0.518506139596635
Energy: 0.5788339727376076
Energy: 0.6163041273675491
Energy: 0.5422540522269301
Energy: 0.619172241395222
Energy: 0.4810523349964586
Energy: 0.5420334161585688
Energy: 0.6202063375821194
Energy: 0.6346704970706357
Energy: 0.5693600821322812
Energy: 0.6445026107380082
Energy: 0.5072923708230351
Energy: 0.48755182178195694
Energy: 0.6452424202707445
Energy: 0.5075125566146107
Energy: 0.5464142001826794
Energy: 0.6442552133601046
Energy: 0.5273436140008878
Energy: 0.5555394489167494
Energy: 0.6449763051010325
Energy: 0.6457966852402417
Energy: 0.5562389007320182
Energy: 0.8202395228825825
Energy: 0.6177256250370289
Energy: 0.508356238872672
Energy: 0.5098560752349268
Energy: 0.6156051002895966
Energy: 0.5075842554549376

minimum gb energy = 0.40010811471796653 eV
minimum distance =  2.6595732675743 Angstroms
sigma value = 43


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

Energy: 0.7370560006930672
Energy: 0.5699377507726608
Energy: 0.44701770417783077
Energy: 0.7381414343287097
Energy: 0.5696731837034288
Energy: 0.411919451742812
Energy: 0.5448412474743515
Energy: 0.44906326332149216
Energy: 0.4594362430557887
Energy: 0.5157987027105628
Energy: 0.4635709864508142
Energy: 0.42738441879954125
Energy: 0.5288163017827514
Energy: 0.42258496512500004
Energy: 0.40058374738274766
Energy: 0.5248920626970547
Energy: 0.4842546296127473
Energy: 0.42567749807895094
Energy: 0.4783434064663972
Energy: 0.40055972453936295
Energy: 0.39902720300048344
Energy: 0.4789070897282654
Energy: 0.477805834118149
Energy: 0.4204702236915028
Energy: 0.5054258339920266
Energy: 0.4028972614299649
Energy: 0.42165599056082
Energy: 0.4666017172287631
Energy: 0.514549015352206
Energy: 0.42145667156677324
Energy: 0.6957215007199845
Energy: 0.4044148108862616
Energy: 0.3992476898986985
Energy: 0.6837807454815827
Energy: 0.4036001911895098
Energy: 0.4299705907358761
Energy: 0.5229231392908672
Energy: 0.40157121957603026
Energy: 0.42860351886348586
Energy: 0.47022244149473513
Energy: 0.40175104565811953
Energy: 0.43108723613471517
Energy: 0.5213966515100502
Energy: 0.4162000881093831
Energy: 0.3952084633304638
Energy: 0.5070855820199258
Energy: 0.41626683954149224
Energy: 0.4084473488764089
Energy: 0.37286252795447583
Energy: 0.4080863563487106
Energy: 0.3712143671979891
Energy: 0.37388303842463577
Energy: 0.49768377837623784
Energy: 0.3711136196823186
Energy: 0.378232024096565
Energy: 0.42713979044263867
Energy: 0.4070430529786223
Energy: 0.3744088007292551
Energy: 0.466086058367605
Energy: 0.40761822411176496
Energy: 0.6547183793251623
Energy: 0.35606757112671983
Energy: 0.41718226841797257
Energy: 0.44103256371689087
Energy: 0.3561870071572439
Energy: 0.39936666077401833
Energy: 0.4916791231941013
Energy: 0.3529624182068215
Energy: 0.3528734081531621
Energy: 0.4814922563509142
Energy: 0.35297728403523315
Energy: 0.4284730273111921
Energy: 0.5177592716265234
Energy: 0.4135038603765636
Energy: 0.4206289925790365
Energy: 0.48748639564886015
Energy: 0.4134816196347172
Energy: 0.4145531632952297
Energy: 0.3420422654887653
Energy: 0.4819178607207003
Energy: 0.3418416409435924
Energy: 0.343094284423011
Energy: 0.4853844206715181
Energy: 0.34200956761512535
Energy: 0.3471476792492501
Energy: 0.40279760843374235
Energy: 0.4220815502823828
Energy: 0.34971082637051387
Energy: 0.39970663940846696
Energy: 0.4132503577000941
Energy: 0.4833282692874155
Energy: 0.34106325103915686
Energy: 0.34111920201625795
Energy: 0.3576994172266626
Energy: 0.3410707344266592
Energy: 0.41087718121953865
Energy: 0.3554689421885143
Energy: 0.33692158762628877
Energy: 0.33706682145970607
Energy: 0.4036045805513959
Energy: 0.33683949626898635
Energy: 0.4087918218744782
Energy: 0.5027418260139812
Energy: 0.4246966869474837
Energy: 0.43434520464861787
Energy: 0.46479855717578517
Energy: 0.4935101536418907
Energy: 0.4341642730320211
Energy: 0.33708397055126993
Energy: 0.46222200337075636
Energy: 0.3370644727403679
Energy: 0.33771911440429225
Energy: 0.46830867709116847
Energy: 0.3370130332743323
Energy: 0.5066306687240069
Energy: 0.42010130139087887
Energy: 0.4300236095626993
Energy: 0.4586733047543779
Energy: 0.401381997767074
Energy: 0.4290700710696531
Energy: 0.3934212686673565
Energy: 0.34203125510351234
Energy: 0.3420837801588404
Energy: 0.4252708742062629
Energy: 0.3422055099758151
Energy: 0.41191624505335717
Energy: 0.5079715633641368
Energy: 0.34547500201605025
Energy: 0.34560791125267526
Energy: 0.4039798266990407
Energy: 0.3454545650939341
Energy: 0.4111874349844085
Energy: 0.41973227039194266
Energy: 0.3982389586757498
Energy: 0.41923830985132615
Energy: 0.4201680048025887
Energy: 0.4622858687907087
Energy: 0.4198300998003968
Energy: 0.35304201617382913
Energy: 0.44544864229155884
Energy: 0.35277199428492045
Energy: 0.3540351396350407
Energy: 0.48991873488586163
Energy: 0.35275293713717387
Energy: 0.5115374150099825
Energy: 0.4121107424368946
Energy: 0.42845177440706156
Energy: 0.4888027273857626
Energy: 0.4120640217376933
Energy: 0.3984404374732915
Energy: 0.5123859748701931
Energy: 0.37132656728881946
Energy: 0.3712581546018103
Energy: 0.47000231734290837
Energy: 0.37142097847980693
Energy: 0.44020571534809805
Energy: 0.678481220177078
Energy: 0.37436850934472454
Energy: 0.40506773897465825
Energy: 0.40120498896429535
Energy: 0.3741802109481301
Energy: 0.40405862652500335
Energy: 0.44392286654806173
Energy: 0.4019024204477306
Energy: 0.39790350979743205
Energy: 0.4439603471031843
Energy: 0.46445824331396346
Energy: 0.39770609650913114
Energy: 0.40626355277733117
Energy: 0.417249635778279
Energy: 0.4016318045764605
Energy: 0.40731210165342496
Energy: 0.5080463604664159
Energy: 0.4015973670105959
Energy: 0.5121022414658326
Energy: 0.4099198880424322
Energy: 0.40391950633710144
Energy: 0.49797123964220424
Energy: 0.4145642733150278
Energy: 0.4245523376421918
Energy: 0.5413963386006905
Energy: 0.45458627563520426
Energy: 0.49273012613007616
Energy: 0.4927222162389932
Energy: 0.4547471116769343
Energy: 0.47275394982417845
Energy: 0.7233600143056556
Energy: 0.4561314422506033
Energy: 0.4214518768454378
Energy: 0.7112512856110396
Energy: 0.45477447688461464
Energy: 0.41828855744294335
Energy: 0.5156061432309726
Energy: 0.45272182050032356
Energy: 0.46133668745486
Energy: 0.4742244948174403
Energy: 0.5275268358178591
Energy: 0.4630007808000556
Energy: 0.5375470811134065
Energy: 0.4159747270872912
Energy: 0.42568163544120846
Energy: 0.5373547244425461
Energy: 0.49474394763180557
Energy: 0.45802234612284615
Energy: 0.5453946582849143
Energy: 0.4182882253741127
Energy: 0.4271056038746948
Energy: 0.5452752007517124
Energy: 0.4935756735680774
Energy: 0.4220292235218532
Energy: 0.5498209222051271
Energy: 0.4774901670737672
Energy: 0.4723358948839084
Energy: 0.5205970594866647
Energy: 0.4893168079470033
Energy: 0.4612653246862292

minimum gb energy = 0.33683949626898635 eV
minimum distance =  2.66652343437952 Angstroms
sigma value = 81


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

Energy: 0.14815028631394758
Energy: 0.3428960584914156
Energy: 0.01964379714573269
Energy: 0.020712678142070368
Energy: 0.27813070616411095
Energy: 0.14823102241480868
Energy: 0.28322398607921834
Energy: 0.3411396304902451
Energy: 0.357980349886839
Energy: 0.3655175061461938
Energy: 0.2779656888747222
Energy: 0.3435992478863329
Energy: 0.5560018493463583
Energy: 0.019692383566392416
Energy: 0.019713862155456955
Energy: 0.5515169005576207
Energy: 0.019615266712856513
Energy: 0.019842402614373342
Energy: 0.2780874026764892
Energy: 0.019695608444659424
Energy: 0.019788306791242605
Energy: 0.311601594298068
Energy: 0.019676602806817357
Energy: 0.042982566751514524
Energy: 0.04260631352091844
Energy: 0.6299316361922738
Energy: 0.36054993023491144
Energy: 0.04321458489238307
Energy: 0.544672200667857
Energy: 0.2963594747094981
Energy: 0.020208636336811702
Energy: 0.2694959052673304
Energy: 0.01973146046724585
Energy: 0.020861182322326335
Energy: 0.4294881097131685
Energy: 0.01968569404361882
Energy: 0.7389965047298678
Energy: 0.272684604731075
Energy: 0.343680594511028
Energy: 0.3084038948088258
Energy: 0.27266803837247955
Energy: 0.27284268410610785
Energy: 0.5497390458227898
Energy: 0.0196432738285293
Energy: 0.019664035465930648
Energy: 0.5430839116122519
Energy: 0.01962268137395185
Energy: 0.01965017305654937
Energy: 0.28369931771239965
Energy: 0.01973801033118086
Energy: 0.04329675277191586
Energy: 0.277741702559999
Energy: 0.01966073490584374
Energy: 0.043791856615506344
Energy: 0.1483150343514488
Energy: 0.5482032979822397
Energy: 0.3777760134933722
Energy: 0.019756286329497025
Energy: 0.5485759984958519
Energy: 0.36303722991546183

minimum gb energy = 0.019615266712856513 eV
minimum distance =  2.67025085006004 Angstroms
sigma value = 3


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

Energy: 0.7612544074267389
Energy: 0.48414340756693275
Energy: 0.5274765136000158
Energy: 0.7620284029183078
Energy: 0.5008696293158077
Energy: 0.4472309537764092
Energy: 0.5333680130789218
Energy: 0.4602372191494311
Energy: 0.4876568897692529
Energy: 0.49182676367740963
Energy: 0.4596832895782091
Energy: 0.4635462698922247
Energy: 0.4836022878816586
Energy: 0.47199111761598356
Energy: 0.47209775842826374
Energy: 0.48389278486430676
Energy: 0.4882355794812866
Energy: 0.4938317659792493
Energy: 0.4939148911467604
Energy: 0.43374980107745115
Energy: 0.4345126385035435
Energy: 0.4627987205879681
Energy: 0.41277190936172253
Energy: 0.493204923600613
Energy: 0.4139036628700514
Energy: 0.4849336736314588
Energy: 0.4891782494805524
Energy: 0.41394723838567793
Energy: 0.48469660766779527
Energy: 0.5001654968516767
Energy: 0.7266650624963003
Energy: 0.47184056611143393
Energy: 0.49455578558379476
Energy: 0.6155174782253324
Energy: 0.4747225045207161
Energy: 0.4452741304657965
Energy: 0.45378024291737495
Energy: 0.4425444185192469
Energy: 0.45500335021447785
Energy: 0.43836465823959814
Energy: 0.44256415018467465
Energy: 0.4413761386107918
Energy: 0.45909478359053757
Energy: 0.46171689668158306
Energy: 0.4605231710478268
Energy: 0.4584336953845731
Energy: 0.435497971406248
Energy: 0.4342668019982393
Energy: 0.45254641565383225
Energy: 0.4538292781842565
Energy: 0.47726690863172055
Energy: 0.45308175061966355
Energy: 0.37085000428229054
Energy: 0.4602554361814355
Energy: 0.428682974138041
Energy: 0.40215957867197644
Energy: 0.41187280202148446
Energy: 0.4247960118731863
Energy: 0.4008671161177618
Energy: 0.41206927600233123
Energy: 0.5705824822483052
Energy: 0.46857934783608884
Energy: 0.4635723436911746
Energy: 0.4370779846432298
Energy: 0.46036405066565395
Energy: 0.4383450273371447
Energy: 0.3561711979423975
Energy: 0.4496829693444099
Energy: 0.43787929576170925
Energy: 0.3568223107054827
Energy: 0.4534103679817882
Energy: 0.3806823051248791
Energy: 0.3827588870771542
Energy: 0.4254539789775261
Energy: 0.43860707463450854
Energy: 0.38273528451440386
Energy: 0.42258674373106464
Energy: 0.382050471567166
Energy: 0.5541789311513804
Energy: 0.3662523943443944
Energy: 0.4215837855953636
Energy: 0.5329584104763491
Energy: 0.3531972082342229
Energy: 0.423924580956572
Energy: 0.4299334988729531
Energy: 0.36147806828643686
Energy: 0.3641682288983409
Energy: 0.4304097855852593
Energy: 0.36313826613620237
Energy: 0.4139875850078211
Energy: 0.42909346680378935
Energy: 0.44512286504260146
Energy: 0.44478885277503927
Energy: 0.4755640711840811
Energy: 0.43201103830198606
Energy: 0.42413599354354475
Energy: 0.34521363702253843
Energy: 0.4229567428667906
Energy: 0.42285856225699775
Energy: 0.3454332573443762
Energy: 0.4207619420525146
Energy: 0.3589711267828805
Energy: 0.3419044816741727
Energy: 0.4258569451888947
Energy: 0.423857049095607
Energy: 0.34215162662125165
Energy: 0.5609924895857779
Energy: 0.4189933054867762
Energy: 0.5568253570640258
Energy: 0.4379122827973143
Energy: 0.4164960112866308
Energy: 0.48241501596209907
Energy: 0.42270699596343536
Energy: 0.4162625800753332
Energy: 0.4308388383538703
Energy: 0.3532811325107909
Energy: 0.35335051266634515
Energy: 0.4317409719515897
Energy: 0.3555028321798959
Energy: 0.3690277056208508
Energy: 0.4314574022742736
Energy: 0.41613590584838206
Energy: 0.44507850553489864
Energy: 0.42804232801690306
Energy: 0.4384552444591079
Energy: 0.405668110240783
Energy: 0.3652212429832895
Energy: 0.39518873387353187
Energy: 0.3960946922553501
Energy: 0.36589597823987247
Energy: 0.39142759284100004
Energy: 0.3640055327383675
Energy: 0.34443411657129014
Energy: 0.424314067543776
Energy: 0.42886321313897247
Energy: 0.3443070280832427
Energy: 0.4998158641302024
Energy: 0.42908326374707306
Energy: 0.6310467379416526
Energy: 0.3782183070530581
Energy: 0.40607459906020354
Energy: 0.6314887441238665
Energy: 0.3780144942954293
Energy: 0.4309259866839374
Energy: 0.45574658917237953
Energy: 0.35600385650338984
Energy: 0.38059800598777754
Energy: 0.41319008804523877
Energy: 0.35593417592726445
Energy: 0.38055303342123004
Energy: 0.46001157674379284
Energy: 0.4486162779084462
Energy: 0.4414343249563843
Energy: 0.46095828362547664
Energy: 0.41201450967408104
Energy: 0.46504238795027164
Energy: 0.4120412894947104
Energy: 0.4400398391804745
Energy: 0.4122214884709799
Energy: 0.41299823774941985
Energy: 0.4499172528978563
Energy: 0.41213559584850695
Energy: 0.3646771919144425
Energy: 0.4709715305626553
Energy: 0.4841170124475635
Energy: 0.3648854930494059
Energy: 0.4547595771286919
Energy: 0.4592806233506673
Energy: 0.6915502111579089
Energy: 0.4585934714049842
Energy: 0.4535724339563856
Energy: 0.5794676434486135
Energy: 0.4584781671562762
Energy: 0.41751920901825557
Energy: 0.4166057735183713
Energy: 0.4427508486943184
Energy: 0.4647967928929461
Energy: 0.41658451692624693
Energy: 0.44060077766942685
Energy: 0.4680246386826892
Energy: 0.4912366334388456
Energy: 0.4747370028467401
Energy: 0.4727515022073169
Energy: 0.4911165808732346
Energy: 0.44344719774505054
Energy: 0.4538131833177953
Energy: 0.483486249035997
Energy: 0.45978963030107123
Energy: 0.4811614142881206
Energy: 0.48386374285812983
Energy: 0.3793556603263481
Energy: 0.48504999702768653
Energy: 0.4312487032508673
Energy: 0.4612955752704891
Energy: 0.47767346740860395
Energy: 0.38887171745382243
Energy: 0.4790615548764115
Energy: 0.47238203237553966

minimum gb energy = 0.3419044816741727 eV
minimum distance =  2.65507676083376 Angstroms
sigma value = 67


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

Energy: 0.754708567595938
Energy: 0.549797529855771
Energy: 0.5910818775119657
Energy: 0.7558191701804846
Energy: 0.756120592411098
Energy: 0.6039521882287361
Energy: 0.6196431912453626
Energy: 0.5749470389045499
Energy: 0.602411795514464
Energy: 0.6202816168816432
Energy: 0.5972275989423681
Energy: 0.5926489644303723
Energy: 0.5866429729203767
Energy: 0.566521873232477
Energy: 0.5764745357203616
Energy: 0.5875598593046656
Energy: 0.5652251848830978
Energy: 0.5660565866485177
Energy: 0.5605010179727155
Energy: 0.6074209231782985
Energy: 0.6079895895740347
Energy: 0.5610969622293772
Energy: 0.5472452490224827
Energy: 0.5832230688174191
Energy: 0.5200811430878544
Energy: 0.5628545496207794
Energy: 0.5614986124809372
Energy: 0.5202830126858775
Energy: 0.5656279584418222
Energy: 0.6110698920437211
Energy: 0.7133522148339301
Energy: 0.6160230708304172
Energy: 0.5694004964765139
Energy: 0.7129210557020086
Energy: 0.5849150574306712
Energy: 0.5645749102884088
Energy: 0.49952802252891715
Energy: 0.5409075569464508
Energy: 0.55708493194788
Energy: 0.5209516059206833
Energy: 0.5443412416007245
Energy: 0.511238421999625
Energy: 0.5150403238837369
Energy: 0.5298943673366513
Energy: 0.493152202704596
Energy: 0.5156555163317361
Energy: 0.5367239959301029
Energy: 0.5517141739716699
Energy: 0.6263639412798372
Energy: 0.5696719836597903
Energy: 0.5673080978314362
Energy: 0.5816122759159075
Energy: 0.45191411815005383
Energy: 0.5669107067500889
Energy: 0.4924745528577689
Energy: 0.4619018917537511
Energy: 0.45815025236394574
Energy: 0.4925618619233585
Energy: 0.4594770326967176
Energy: 0.49329654583961835
Energy: 0.48263384741428966
Energy: 0.5427010120397094
Energy: 0.5446386639256058
Energy: 0.5320458064840844
Energy: 0.5262425566529683
Energy: 0.5289023280915509
Energy: 0.4402949564370713
Energy: 0.5529054101634544
Energy: 0.5422749671107693
Energy: 0.44084908476044005
Energy: 0.5575625261916473
Energy: 0.4649425684283421
Energy: 0.4396316266930271
Energy: 0.5389235265609148
Energy: 0.5374783261733986
Energy: 0.44033247901977374
Energy: 0.633169204172114
Energy: 0.4775802876007047
Energy: 0.594824131102843
Energy: 0.5488026252472498
Energy: 0.5338134982121662
Energy: 0.5690451846541548
Energy: 0.5108675387480002
Energy: 0.524463690699383
Energy: 0.528604951588824
Energy: 0.43771723380518823
Energy: 0.4341562892844471
Energy: 0.5293986998965711
Energy: 0.43263913428133555
Energy: 0.5062122170709082
Energy: 0.6490473639735159
Energy: 0.5424694441625593
Energy: 0.5415668444888494
Energy: 0.5250988266749578
Energy: 0.43731125952197736
Energy: 0.5414183538719002
Energy: 0.4606870259624395
Energy: 0.5286148625578889
Energy: 0.4822123514608654
Energy: 0.46129711226179443
Energy: 0.5289055655305585
Energy: 0.4793608581263401
Energy: 0.4654276296166951
Energy: 0.5497330191325142
Energy: 0.5644764994406674
Energy: 0.4654439806461108
Energy: 0.5412011732707287
Energy: 0.5122211598862766
Energy: 0.6687433984485939
Energy: 0.5681417684197362
Energy: 0.5176189460409074
Energy: 0.6545895567918901
Energy: 0.5660065500931744
Energy: 0.5449038255012931
Energy: 0.4639934457998688
Energy: 0.5000901023495131
Energy: 0.49607946780550777
Energy: 0.4647107523594549
Energy: 0.49927907738843175
Energy: 0.5553788358420717
Energy: 0.5980630720520699
Energy: 0.5902709729551219
Energy: 0.5939864500811501
Energy: 0.5990231577639903
Energy: 0.5097905509722118
Energy: 0.5634545334618498
Energy: 0.5865716537667208
Energy: 0.5442527105867294
Energy: 0.6026019648675279
Energy: 0.5873873251474305
Energy: 0.5471553394659169
Energy: 0.5784139150070888
Energy: 0.5578776674633262
Energy: 0.5627358491650319
Energy: 0.5567935174980502
Energy: 0.5589147187369589
Energy: 0.5602760077104755
Energy: 0.5929512078984622

minimum gb energy = 0.43263913428133555 eV
minimum distance =  2.64589174219513 Angstroms
sigma value = 33


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

Energy: 0.8477955872644295
Energy: 0.7561723972177012
Energy: 0.7308342779889923
Energy: 0.8489789287548013
Energy: 0.7691189066145404
Energy: 0.6249959783911709
Energy: 0.6653269317759217
Energy: 0.6169122323249379
Energy: 0.6350413750304701
Energy: 0.6654448478505651
Energy: 0.6350757770293189
Energy: 0.661058772667568
Energy: 0.633591111863236
Energy: 0.6711761332749883
Energy: 0.6715909037268923
Energy: 0.6340916710964909
Energy: 0.6365344323673555
Energy: 0.6429853621411321
Energy: 0.5911819620581612
Energy: 0.6659345994047503
Energy: 0.6770152127746406
Energy: 0.5919602003484646
Energy: 0.607922590415824
Energy: 0.6747912838302317
Energy: 0.5482274932214362
Energy: 0.6315204147898518
Energy: 0.6337637561155522
Energy: 0.5480906775600667
Energy: 0.6423419730260862
Energy: 0.6497327321235344
Energy: 0.7814022497596276
Energy: 0.6522502678876292
Energy: 0.6829339778142197
Energy: 0.7824472610377655
Energy: 0.6503912430222877
Energy: 0.6053527815117206
Energy: 0.5479561400632882
Energy: 0.5950942896404802
Energy: 0.6479603244067372
Energy: 0.5479527556214678
Energy: 0.5968878445062975
Energy: 0.5720569166117033
Energy: 0.5373483672713073
Energy: 0.6059333002751011
Energy: 0.5904292598911285
Energy: 0.5382128069192121
Energy: 0.6059292956994692
Energy: 0.5831495070769228
Energy: 0.6252855409866319
Energy: 0.6022693648204446
Energy: 0.6034139487893498
Energy: 0.625923211176648
Energy: 0.4911601903435721
Energy: 0.6000304905171004
Energy: 0.6289547069970498
Energy: 0.4871535463675193
Energy: 0.4870615507155811
Energy: 0.6299969460223184
Energy: 0.48877024523995216
Energy: 0.5529217829899197
Energy: 0.7153258649908264
Energy: 0.5902723429621793
Energy: 0.5890641915105062
Energy: 0.5813047811407451
Energy: 0.5234338743488295
Energy: 0.5732638676431271
Energy: 0.4907497125086232
Energy: 0.6005275402867915
Energy: 0.5369225815360616
Energy: 0.48795021875812783
Energy: 0.6339948029201141
Energy: 0.5367327426452423
Energy: 0.4914733346435964
Energy: 0.603474150590892
Energy: 0.616239866359998
Energy: 0.49059846737613383
Energy: 0.6115829962225197
Energy: 0.54188845130918
Energy: 0.7159668436771648
Energy: 0.6163375149829644
Energy: 0.6130989701013305
Energy: 0.6584182667037737
Energy: 0.6009134945274616
Energy: 0.5427410910164513
Energy: 0.562317129234698
Energy: 0.5383365193158286
Energy: 0.5364718874606361
Energy: 0.5604497721964398
Energy: 0.5406120106389866
Energy: 0.5830928381471564
Energy: 0.642408039577397
Energy: 0.6161514013515501
Energy: 0.6068523076381293
Energy: 0.6431491157318472
Energy: 0.5053767012588692
Energy: 0.5647511199296574
Energy: 0.6323826038067
Energy: 0.6326975094867427
Energy: 0.6327086494638027
Energy: 0.6324813715041898
Energy: 0.6332478176068164
Energy: 0.6290930629267544
Energy: 0.6329839096046161
Energy: 0.5996481028426385
Energy: 0.6371682838891916
Energy: 0.6330773060014395
Energy: 0.5994594670652376
Energy: 0.6509831852121479
Energy: 0.8483534636842431
Energy: 0.6207596591789872
Energy: 0.7257012596068021
Energy: 0.849566061643467
Energy: 0.6199144964576919
Energy: 0.6251485999040555
Energy: 0.5919918494375751
Energy: 0.632993202336067
Energy: 0.6350953777913075
Energy: 0.5906130238994107
Energy: 0.6435736632523139
Energy: 0.6371199916006159
Energy: 0.6328121144424079
Energy: 0.6594384849873479
Energy: 0.6595592449596124
Energy: 0.6335969614566201
Energy: 0.6592805615967622
Energy: 0.6296600250826225
Energy: 0.5915566466169829
Energy: 0.6710570431390229
Energy: 0.6713478379481504
Energy: 0.5924163128215058
Energy: 0.6213251311243365
Energy: 0.6704721486531432
Energy: 0.5483651063320243
Energy: 0.6155587719010878
Energy: 0.642178560185941
Energy: 0.5481473268849543
Energy: 0.6332294520229624
Energy: 0.6413715198290536
Energy: 0.7811131473363917
Energy: 0.6520034594682762
Energy: 0.6807654485397733
Energy: 0.7817099002580904
Energy: 0.6633955893963788
Energy: 0.6056682962840692
Energy: 0.5483317594834769
Energy: 0.6188691937757396
Energy: 0.6154173805548872
Energy: 0.5479845998268899
Energy: 0.5964031429053407
Energy: 0.6518606847195392
Energy: 0.5361831129487493
Energy: 0.6059141063168683
Energy: 0.6076886070616606
Energy: 0.5369889582174344
Energy: 0.6057442967404352
Energy: 0.5608268514047164
Energy: 0.6247295694052826
Energy: 0.602666231359476
Energy: 0.6049161105826382
Energy: 0.5947808670619944
Energy: 0.5442195951841653
Energy: 0.6023901484381128
Energy: 0.6236433053510146
Energy: 0.4885809873056479
Energy: 0.4885615923511763
Energy: 0.6232183485093562
Energy: 0.4906972094420819
Energy: 0.5366951441376892
Energy: 0.6741334300235263
Energy: 0.5769824013195005
Energy: 0.5900440637632126
Energy: 0.6749844618782477
Energy: 0.5232101566893063
Energy: 0.5906714617703
Energy: 0.48775533055961806
Energy: 0.6006565149346541
Energy: 0.5988697446405202
Energy: 0.4870330541189922
Energy: 0.6340932198470545
Energy: 0.5367936085134394
Energy: 0.48968813783072984
Energy: 0.6078057883744362
Energy: 0.5421822807383455
Energy: 0.48986602270145124
Energy: 0.607772557526526
Energy: 0.5417614976184493
Energy: 0.6509783477423244
Energy: 0.6121338023801177
Energy: 0.6124910585800016
Energy: 0.5907992189082065
Energy: 0.600130494577089
Energy: 0.5777749378292275
Energy: 0.6065092040468691
Energy: 0.5364610048505465
Energy: 0.5363625855418971
Energy: 0.607174250739328
Energy: 0.5380506480509095
Energy: 0.5738495522676024
Energy: 0.6304036052983546
Energy: 0.5650916896828285
Energy: 0.5637919130274217
Energy: 0.5921050455835439
Energy: 0.5049207684998867
Energy: 0.5649201177052108
Energy: 0.6324303012283359
Energy: 0.6327044507900242
Energy: 0.6264739142907395
Energy: 0.632869162358047
Energy: 0.7162095848677457
Energy: 0.6264913483459832
Energy: 0.6140905887411056
Energy: 0.5996329264556829
Energy: 0.6371148955952686
Energy: 0.6331462801486852
Energy: 0.5995723905664262
Energy: 0.6612663716776214
Energy: 0.8482465020797346
Energy: 0.6146832421484831
Energy: 0.7275629577650388
Energy: 0.849471067524541
Energy: 0.6204411910584188
Energy: 0.6251129869388928

minimum gb energy = 0.4870330541189922 eV
minimum distance =  2.63638863422839 Angstroms
sigma value = 41


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

Energy: 0.7816011669408407
Energy: 0.8013668973837107
Energy: 0.7939169307015899
Energy: 0.7830144340221646
Energy: 0.9288783305395302
Energy: 0.7958297472081087
Energy: 0.6786953887733185
Energy: 0.6781178930107973
Energy: 0.6721607795917001
Energy: 0.6785359175460647
Energy: 0.6785691214047836
Energy: 0.7013114298927627
Energy: 0.6790371901652271
Energy: 0.7301818873686301
Energy: 0.731582287255054
Energy: 0.6820131850992699
Energy: 0.729804716936654
Energy: 0.6919594800472951
Energy: 0.7000947802993293
Energy: 0.7246247229456673
Energy: 0.7413321967881114
Energy: 0.6427467962351863
Energy: 0.6778351939670932
Energy: 0.6318628904781498
Energy: 0.5764605387464344
Energy: 0.6766405439904914
Energy: 0.6912300077169468
Energy: 0.5766536256112084
Energy: 0.6951451461055761
Energy: 0.6948231444948653
Energy: 0.7217227870155524
Energy: 0.7282126625688212
Energy: 0.7329191314991735
Energy: 0.7224319278578178
Energy: 0.7255426572189247
Energy: 0.7340458400656477
Energy: 0.5769177587263431
Energy: 0.6687292669221032
Energy: 0.6878515825136691
Energy: 0.5770098651642527
Energy: 0.664054749474781
Energy: 0.637583247655023
Energy: 0.5641122096311266
Energy: 0.6670705095411956
Energy: 0.6242364791121509
Energy: 0.5649011138704161
Energy: 0.7280913141906067
Energy: 0.6272732835096955
Energy: 0.7137640117662349
Energy: 0.6663509280082314
Energy: 0.6650101397026128
Energy: 0.6574114899415021
Energy: 0.6028026954073383
Energy: 0.6658686844604261
Energy: 0.6239056515654795
Energy: 0.5671692016501816
Energy: 0.6073040264741456
Energy: 0.6240994101821299
Energy: 0.5661318023307452
Energy: 0.6392609829058578
Energy: 0.6568241500456957
Energy: 0.6306409157257444
Energy: 0.602454312273935
Energy: 0.6576223092707416
Energy: 0.5384410738235716
Energy: 0.6020187352561039
Energy: 0.6321061331856591
Energy: 0.6715540844758521
Energy: 0.66007192781432
Energy: 0.7143095977144132
Energy: 0.7320114228996693
Energy: 0.6624215439238057
Energy: 0.6788000325685957
Energy: 0.6381369320196835
Energy: 0.6823936277348929
Energy: 0.6796210367433236
Energy: 0.6409141654400585
Energy: 0.7003574833415391
Energy: 0.8112419673997864
Energy: 0.691147570570106
Energy: 0.7887638720749076
Energy: 0.785350127877749
Energy: 0.6881797855290381
Energy: 0.7858848397808873

minimum gb energy = 0.5384410738235716 eV
minimum distance =  2.62749226498164 Angstroms
sigma value = 11


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

Energy: 0.9767716429357957
Energy: 1.0148593029549142
Energy: 0.9155704284678616
Energy: 0.9784254175051627
Energy: 1.0105458785387962
Energy: 0.8057289318454663
Energy: 0.7765363748354804
Energy: 0.6480360528917198
Energy: 0.6496986889065428
Energy: 0.748421219140678
Energy: 0.6601472265763578
Energy: 0.7081583342435313
Energy: 0.8363815917296362
Energy: 0.7840039103603836
Energy: 0.7840841542679975
Energy: 0.82449465621691
Energy: 0.7771673624124361
Energy: 0.7732654313857128
Energy: 0.7973066128190701
Energy: 0.7684548437868309
Energy: 0.7223122251812686
Energy: 0.7732492855555546
Energy: 0.6554793807306994
Energy: 0.7081451325851758
Energy: 0.712728790587218
Energy: 0.6601799570018986
Energy: 0.6541712622884803
Energy: 0.6992309847821692
Energy: 0.6628611057590458
Energy: 0.6973085258421556
Energy: 0.7493886455056805
Energy: 0.6550882520811525
Energy: 0.7109561579394972
Energy: 0.740808417895442
Energy: 0.642043739856585
Energy: 0.711388088511341
Energy: 0.6338035529410553
Energy: 0.712393824497957
Energy: 0.7144542217312435
Energy: 0.6420436868268578
Energy: 0.7168754574893542
Energy: 0.7091998132485253
Energy: 0.6476379117414897
Energy: 0.709159830139529
Energy: 0.7043007537505116
Energy: 0.6485748405503446
Energy: 0.6749636153115139
Energy: 0.705766029708146
Energy: 0.7513931045580327
Energy: 0.7626053645254294
Energy: 0.7738770137625509
Energy: 0.8076086822704288
Energy: 0.7645711932514414
Energy: 0.8070660107097505
Energy: 0.7067816094405931
Energy: 0.7910611794497004
Energy: 0.7741192836454495
Energy: 0.7627168465486113
Energy: 0.7984423265907089
Energy: 0.8070532795671463
Energy: 0.7005823296328116
Energy: 0.677577368804525
Energy: 0.702056891097292
Energy: 0.6816512205062428
Energy: 0.6970470969771925
Energy: 0.6623040089259536
Energy: 0.7673769037324338
Energy: 0.8597322317180313
Energy: 0.8566747069266571
Energy: 0.7852158192975904
Energy: 0.9014122667056779
Energy: 0.8528902945209207
Energy: 0.65859756564549
Energy: 0.7689252524164472
Energy: 0.718987799314185
Energy: 0.6586146873396124
Energy: 0.7870994832444305
Energy: 0.7164269820094122
Energy: 0.838014411694468
Energy: 0.7842599257552989
Energy: 0.7712820541095216
Energy: 0.8041916507127245
Energy: 0.7910687918395863
Energy: 0.7841062704825519
Energy: 0.622304953354836
Energy: 0.7075007863312249
Energy: 0.7263441735251989
Energy: 0.6224687014984952
Energy: 0.780828634606471
Energy: 0.7236355916069519
Energy: 0.6237862127300479
Energy: 0.7139010595445815
Energy: 0.718122484337528
Energy: 0.6246262336577588
Energy: 0.7408484904807949
Energy: 0.6672452600824595
Energy: 0.6119359230440445
Energy: 0.7080765833266969
Energy: 0.7126478627522888
Energy: 0.612181362764993
Energy: 0.7024013963399217
Energy: 0.6973349050800218
Energy: 0.7788637738732556
Energy: 0.6953422235777335
Energy: 0.7280334984066409
Energy: 0.7800726353119016
Energy: 0.6968256695113334
Energy: 0.712904931459353
Energy: 0.6554916570392537
Energy: 0.699836551933142
Energy: 0.7148877090362835
Energy: 0.6404417255107998
Energy: 0.7197484411360259
Energy: 0.6867081083921207
Energy: 0.8304407136695781
Energy: 0.8103164254535552
Energy: 0.8057315618430507
Energy: 0.8309814858396669
Energy: 0.8539867350726068
Energy: 0.8511922108848918
Energy: 0.7186502150705059
Energy: 0.7776982763195517
Energy: 0.7128208952132652
Energy: 0.6984779012521838
Energy: 0.640055211501749
Energy: 0.6734896842018625
Energy: 0.6467462095716363
Energy: 0.6917014414666284
Energy: 0.6790111878587126
Energy: 0.6468139484751052
Energy: 0.6915682392733545
Energy: 0.6787849306925249
Energy: 0.9251745221824185
Energy: 0.7804822422148128
Energy: 0.8633625355081648
Energy: 0.8743897476645494
Energy: 0.8201455600180453
Energy: 0.8578518635621121
Energy: 0.7088085724204914
Energy: 0.6407613235440092
Energy: 0.6802416531577509
Energy: 0.7080066035727952
Energy: 0.6405775985752417
Energy: 0.710237292119594
Energy: 0.6901216482156898
Energy: 0.7443598906074422
Energy: 0.7429345886954344
Energy: 0.6911448328522721
Energy: 0.7482649210633613
Energy: 0.7288270720731611
Energy: 0.7537388150435528
Energy: 0.6772153390322723
Energy: 0.7057202862273945
Energy: 0.7218282096470653
Energy: 0.6207751008369203
Energy: 0.7073668929609398
Energy: 0.7437481185229783
Energy: 0.6233793676495862
Energy: 0.6233311455453321
Energy: 0.7227196644942195
Energy: 0.6248393274091519
Energy: 0.7034933472073781
Energy: 0.7808962586530548
Energy: 0.6933544410927752
Energy: 0.7234553227307895
Energy: 0.7160168220710007
Energy: 0.6349815509045292
Energy: 0.72951194950642
Energy: 0.7618078932258285
Energy: 0.7740347160012676
Energy: 0.7606233407269567
Energy: 0.7606817817684856
Energy: 0.7911444251024585
Energy: 0.7440875809834758
Energy: 0.7743611543753157
Energy: 0.6841998085218153
Energy: 0.6599870922178209
Energy: 0.7655819139035542
Energy: 0.642504587955915
Energy: 0.725749040712612
Energy: 0.9786253165914595
Energy: 0.7795457158905543
Energy: 0.9116789832542366
Energy: 0.951779434090342
Energy: 0.7355234223223425
Energy: 0.908024863713704

minimum gb energy = 0.6119359230440445 eV
minimum distance =  2.6317020976811 Angstroms
sigma value = 57


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

Energy: 0.8742200007375616
Energy: 0.9077114417137166
Energy: 0.757984278391071
Energy: 0.8765427644888303
Energy: 0.9868499360195022
Energy: 0.7589461134193788
Energy: 0.7146898225089031
Energy: 0.7909484104686147
Energy: 0.7353957364466238
Energy: 0.7147933477648047
Energy: 0.7849202737533172
Energy: 0.71738630174391
Energy: 0.7320335077753788
Energy: 0.7225276615497364
Energy: 0.718065101708679
Energy: 0.7325556652492035
Energy: 0.7977046942455348
Energy: 0.6828168749102153
Energy: 0.7392878939352826
Energy: 0.709274243295678
Energy: 0.6580756314770148
Energy: 0.7402101113900877
Energy: 0.7558630650905456
Energy: 0.6581322888010356
Energy: 0.6243493013372502
Energy: 0.7222113494059089
Energy: 0.7406449528689705
Energy: 0.6245436381381217
Energy: 0.7044057953838603
Energy: 0.7303824729215365
Energy: 0.7611493321172309
Energy: 0.7391002976797263
Energy: 0.736519210237449
Energy: 0.7589715126410002
Energy: 0.681589243200482
Energy: 0.7375467446526974
Energy: 0.6818599120719541
Energy: 0.6387804337119313
Energy: 0.7011918208481716
Energy: 0.6828099985915186
Energy: 0.6405405717253716
Energy: 0.7222392803201765
Energy: 0.7146615216492342
Energy: 0.6745855350041957
Energy: 0.7095228985924935
Energy: 0.715521594233662
Energy: 0.6945812080463251
Energy: 0.692424558410531
Energy: 0.763159006950125
Energy: 0.7277771405151957
Energy: 0.7548022722801477
Energy: 0.6998703129514505
Energy: 0.7292219899891914
Energy: 0.7551578670173447
Energy: 0.598522262466734
Energy: 0.7264690654526752
Energy: 0.7546926415460494
Energy: 0.6998546503673372
Energy: 0.7491389436033943
Energy: 0.7550762437524583
Energy: 0.7840305372228612
Energy: 0.7106922156788334
Energy: 0.7093872671867312
Energy: 0.7848719477667699
Energy: 0.7474579568224525
Energy: 0.6581246813957875
Energy: 0.727882240751208
Energy: 0.7605103020169757
Energy: 0.7222598845237775
Energy: 0.7282875299618581
Energy: 0.7578672741177656
Energy: 0.9066335000914911
Energy: 0.6244262226701222
Energy: 0.7170779706746166
Energy: 0.7158984037678564
Energy: 0.6253064212420446
Energy: 0.6785282104432203
Energy: 0.7163764173279291
Energy: 0.759586714639579
Energy: 0.6821562089452683
Energy: 0.7380074980556062
Energy: 0.7606441114020698
Energy: 0.6829546909709622
Energy: 0.7387107762358499
Energy: 0.6992362678855086
Energy: 0.6395348643389867
Energy: 0.7174523029078573
Energy: 0.6994675532041739
Energy: 0.678969987105037
Energy: 0.7048698063111808
Energy: 0.6812698918445067
Energy: 0.6622926722208066
Energy: 0.7187039189525204
Energy: 0.6812655723056918
Energy: 0.6636041297639592
Energy: 0.6804194878458012
Energy: 0.598636239616805
Energy: 0.6949423615736174
Energy: 0.7359383840101348
Energy: 0.5990173168679058
Energy: 0.6976855903840605
Energy: 0.7034554927797307

minimum gb energy = 0.598522262466734 eV
minimum distance =  2.65249358586349 Angstroms
sigma value = 9


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

Energy: 1.0118801124670167
Energy: 1.0286678853225792
Energy: 0.8972458463836501
Energy: 0.9698981740429296
Energy: 1.174954881246038
Energy: 0.8961464837483994
Energy: 0.7906348181903359
Energy: 0.7488378436697158
Energy: 0.7242855109428574
Energy: 0.7911246783612678
Energy: 0.7534029688750892
Energy: 0.7191128676278822
Energy: 0.8144155115318121
Energy: 0.7264002513581841
Energy: 0.819659072025388
Energy: 0.8289960493399983
Energy: 0.7515741598487212
Energy: 0.819973442387788
Energy: 0.7322764262617871
Energy: 0.7021006342535266
Energy: 0.7311547695633356
Energy: 0.719337234441999
Energy: 0.7096273540504423
Energy: 0.7377164142218251
Energy: 0.712437192859467
Energy: 0.6873966055846997
Energy: 0.6836605965473863
Energy: 0.7127760100626569
Energy: 0.6831921601916037
Energy: 0.69253541198613
Energy: 0.6555450737282681
Energy: 0.7090790269451356
Energy: 0.6853131752748469
Energy: 0.6558694447028034
Energy: 0.7258824003724277
Energy: 0.6959771559100323
Energy: 0.8309440689289131
Energy: 0.750966756300062
Energy: 0.8967941761191027
Energy: 0.8309012961902573
Energy: 0.792542685415218
Energy: 0.8987078241929166
Energy: 0.7586867709449925
Energy: 0.6932350240402962
Energy: 0.6932205060934177
Energy: 0.7594436862318756
Energy: 0.7260380781430676
Energy: 0.7177383199507471
Energy: 0.7981432249360656
Energy: 0.7557184804943544
Energy: 0.6920701610593125
Energy: 0.7476139808035074
Energy: 0.7660585039000316
Energy: 0.819365184538289
Energy: 0.7523445077540208
Energy: 0.7533701317182182
Energy: 0.708870585875508
Energy: 0.8061924059815303
Energy: 0.7510000914686817
Energy: 0.7080762856535477
Energy: 0.7175655340620389
Energy: 0.6906023221373928
Energy: 0.696281317901273
Energy: 0.7156977888685969
Energy: 0.7170916696136714
Energy: 0.6950760262235884
Energy: 0.696115068867857
Energy: 0.7014727481127478
Energy: 0.6957772815388584
Energy: 0.6973005643550784
Energy: 0.6754203567341572
Energy: 0.6862319878311988
Energy: 0.793275105526739
Energy: 0.727503778583217
Energy: 0.7443317254257844
Energy: 0.7533901172285219
Energy: 0.7259605108422118
Energy: 0.7413635784417476
Energy: 0.8174036537395486
Energy: 0.7321525430570828
Energy: 0.7422133766262866
Energy: 0.8179167039060393
Energy: 0.7417314226769943
Energy: 0.7416404861286998
Energy: 0.7878080993462389
Energy: 0.6954636821620854
Energy: 0.6928821576806824
Energy: 0.7744886336376949
Energy: 0.7163010266695558
Energy: 0.7525168269019326
Energy: 0.8009670812350768
Energy: 0.8479074746645713
Energy: 0.6925676200394921
Energy: 0.7910335132818359
Energy: 0.8600913562415853
Energy: 0.8807706291337436
Energy: 0.7457146486894454
Energy: 0.7717623982663505
Energy: 0.7470945937272019
Energy: 0.7463860806535637
Energy: 0.7673791622231186
Energy: 0.7415900226575391
Energy: 0.7659030402890743
Energy: 0.7130127147168195
Energy: 0.7237964166718829
Energy: 0.7545284338248333
Energy: 0.7082152646200571
Energy: 0.7250820655462171
Energy: 0.7233430185194674
Energy: 0.7420910304229379
Energy: 0.7500028390489014
Energy: 0.7230972769023353
Energy: 0.7108882267290724
Energy: 0.7483218824723233
Energy: 0.7339457682947503
Energy: 0.7374264361318265
Energy: 0.7344573384479561
Energy: 0.7512612743435733
Energy: 0.7393819163324261
Energy: 0.7319372634357852
Energy: 0.7390388726792348
Energy: 0.7493353822783712
Energy: 0.7227173501853125
Energy: 0.7294287337731027
Energy: 0.7439615255070068
Energy: 0.770745205322599

minimum gb energy = 0.6555450737282681 eV
minimum distance =  2.60316417751788 Angstroms
sigma value = 27


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

Energy: 0.8655564701227715
Energy: 0.9286450662588859
Energy: 0.7581888079807563
Energy: 0.808555730526663
Energy: 0.9225575237573865
Energy: 0.806713592668134
Energy: 0.8925390861085217
Energy: 0.8026868323487433
Energy: 0.7945676791848593
Energy: 0.7984049968389517
Energy: 0.7998030962544901
Energy: 0.8287211354532605
Energy: 0.83562662373323
Energy: 0.7757216933848557
Energy: 0.7619198302283733
Energy: 0.7811397861696531
Energy: 0.6766233795150873
Energy: 0.7783010069524986
Energy: 0.8174317819437743
Energy: 0.8103543504491977
Energy: 0.8087995694483294
Energy: 0.8053124266062294
Energy: 0.7871884502600007
Energy: 0.8371681051764125
Energy: 0.686203155813121
Energy: 0.798815743884754
Energy: 0.7900292760416752
Energy: 0.6866066786335374
Energy: 0.8335491004958059
Energy: 0.8067444875329652
Energy: 0.7791848415754409
Energy: 0.7404002216713681
Energy: 0.7617224290246701
Energy: 0.7760954281881173
Energy: 0.7559553417396335
Energy: 0.7365957242681361
Energy: 0.7923016000754072
Energy: 0.7637094047536418
Energy: 0.7347449520356168
Energy: 0.7970329601859181
Energy: 0.7740939434222024
Energy: 0.73535917251428
Energy: 0.8264370934370471
Energy: 0.7324280611654975
Energy: 0.750080794812684
Energy: 0.7627885679072153
Energy: 0.7828819920826664
Energy: 0.7762464970253132
Energy: 0.889881493134839
Energy: 0.790753097224397
Energy: 0.7355560416453409
Energy: 0.7082007016698093
Energy: 0.8085951402687597
Energy: 0.747455391044927
Energy: 0.8934650597707882
Energy: 0.7236287764761593
Energy: 0.7272452588039131
Energy: 0.743995783421221
Energy: 0.7460872840234185
Energy: 0.7182239352233598
Energy: 0.7130100135836702
Energy: 0.7968901387475339
Energy: 0.8202669751474994
Energy: 0.8274661760125808
Energy: 0.6775578530834938
Energy: 0.7383361115080757
Energy: 0.7472326463080387
Energy: 0.6765832753972472
Energy: 0.6787941936659269
Energy: 0.7165071780304209
Energy: 0.6856330350522359
Energy: 0.6763678474645151
Energy: 0.7372141766384737
Energy: 0.7288043625253462
Energy: 0.7076532785476333
Energy: 0.7378415133403132
Energy: 0.722328050181585
Energy: 0.7075267060141095
Energy: 0.7377667657572692
Energy: 0.740227567354772
Energy: 0.7266621228815364
Energy: 0.7378252868039507
Energy: 0.7351260493659955
Energy: 0.7267774673916721
Energy: 0.7330402447724096
Energy: 0.6795990336856121
Energy: 0.7189315122201815
Energy: 0.7335927511448067
Energy: 0.6799778655071921
Energy: 0.6991558224181377
Energy: 0.7705280957961128
Energy: 0.7274600335653146
Energy: 0.7553967087315894
Energy: 0.7571662317512509
Energy: 0.756758745338609
Energy: 0.7345745854113214
Energy: 0.6893360534803877
Energy: 0.8212496363135119
Energy: 0.820327764988397
Energy: 0.6898461941511904
Energy: 0.8286868952407944
Energy: 0.8087906710966783
Energy: 0.743338996393195
Energy: 0.7651297378616697
Energy: 0.7078388526800206
Energy: 0.7336371603592929
Energy: 0.7520770781444848
Energy: 0.7070606130935259
Energy: 0.8203146267351769
Energy: 0.7513789982636018
Energy: 0.7345926276366892
Energy: 0.8181951473625652
Energy: 0.7718448641940762
Energy: 0.7343413069737129
Energy: 0.8147809409717183
Energy: 0.7597216940392961
Energy: 0.7436732213708819
Energy: 0.7012017081980562
Energy: 0.7740428741317564
Energy: 0.7344748352420813
Energy: 0.8153054771298177
Energy: 0.7713546415912547
Energy: 0.7487425693459618
Energy: 0.7649629206250924
Energy: 0.7488802045352717
Energy: 0.7772228898461313
Energy: 0.6766620160035852
Energy: 0.7598536184365602
Energy: 0.8472404562154916
Energy: 0.6768306040509314
Energy: 0.8425767028316861
Energy: 0.8428791060225006
Energy: 0.8677679189253061
Energy: 0.8174330668447314
Energy: 0.7878272077643588
Energy: 0.803563316322628
Energy: 0.7623288325875452
Energy: 0.827820415316234
Energy: 0.8236622195909449
Energy: 0.7799730700151111
Energy: 0.7629657877261633
Energy: 0.779045367114944
Energy: 0.7688882359257705
Energy: 0.7746588505557858
Energy: 0.8853670506946113
Energy: 0.8334276240782159
Energy: 0.7779993539122421
Energy: 0.8073597305956316
Energy: 0.8183129520273921
Energy: 0.772839397896797

minimum gb energy = 0.6763678474645151 eV
minimum distance =  2.62733169785174 Angstroms
sigma value = 19


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

Energy: 0.961767275907785
Energy: 1.1968069859960575
Energy: 0.9795807373796802
Energy: 0.9294599614051161
Energy: 0.806517472322413
Energy: 0.9849713430567599
Energy: 0.8046482327258688
Energy: 0.7431155785250203
Energy: 0.7411813897932147
Energy: 0.8045113996876306
Energy: 0.7238999715595352
Energy: 0.7059891393399256
Energy: 0.718651175915756
Energy: 0.7222288282865135
Energy: 0.7146203970909856
Energy: 0.7180117482208274
Energy: 0.7202459992545567
Energy: 0.7043647496052913
Energy: 0.7452170691220771
Energy: 0.7073860235339032
Energy: 0.6950796471079589
Energy: 0.7456636777385344
Energy: 0.7190629557317452
Energy: 0.694713279251175
Energy: 0.6596190361533276
Energy: 0.7231034487853006
Energy: 0.7112802473334896
Energy: 0.6471579880425439
Energy: 0.7142025205610322
Energy: 0.6970271563841136
Energy: 0.709872170661731
Energy: 0.7703753556344425
Energy: 0.6933468913095753
Energy: 0.7283826317473814
Energy: 0.7849812675953571
Energy: 0.6974650372865397
Energy: 0.7522867561009563
Energy: 0.9462741452259551
Energy: 0.9373588368311732
Energy: 0.7209101078743155
Energy: 0.9679367557197137
Energy: 0.9184844988107528
Energy: 0.7267081597195338
Energy: 0.6911896996582444
Energy: 0.7024239733753768
Energy: 0.7645465558909927
Energy: 0.7475902811362378
Energy: 0.7331355538814109
Energy: 0.6376283229222928
Energy: 0.676294844942533
Energy: 0.6539676628045041
Energy: 0.6379921670371574
Energy: 0.6708108196446365
Energy: 0.6492416130122742
Energy: 0.7311815940657409
Energy: 0.6891464008854427
Energy: 0.6768409595035381
Energy: 0.6745609231807543
Energy: 0.7023573185517805
Energy: 0.677236468020324
Energy: 0.793620745747586
Energy: 0.7606224115257948
Energy: 0.7518046898563397
Energy: 0.7976447457702945
Energy: 0.7718226199531408
Energy: 0.7412537331503408
Energy: 0.7135880088711706
Energy: 0.7091316243407789
Energy: 0.6840643508082469
Energy: 0.7077166403128194
Energy: 0.6996583176481447
Energy: 0.6974132479436744
Energy: 0.8800194070582256
Energy: 0.7032879865993452
Energy: 0.6915927114820478
Energy: 0.8445346474813538
Energy: 0.7216585853788203
Energy: 0.7139261046750951
Energy: 0.7946991227408349
Energy: 0.7028745126720337
Energy: 0.7115483518205954
Energy: 0.7522107030890343
Energy: 0.6839628882749987
Energy: 0.7097036237299609
Energy: 0.6471519711862153
Energy: 0.6565648179099733
Energy: 0.6408071794633893
Energy: 0.6474369935712024
Energy: 0.6261282084326273
Energy: 0.6389103441513788
Energy: 0.7126845114669279
Energy: 0.6655511186592842
Energy: 0.6496700959238744
Energy: 0.7134390723301506
Energy: 0.6477106273943745
Energy: 0.6562924356523829
Energy: 0.7976603933121028
Energy: 0.7785641493870231
Energy: 0.8614601931082772
Energy: 0.7983748648626988
Energy: 0.7764446410012037
Energy: 0.8558964995835716
Energy: 0.7573470719998273
Energy: 0.7075337963569286
Energy: 0.7109004576052135
Energy: 0.7252475594542306
Energy: 0.7105773931955931
Energy: 0.6931407497153707
Energy: 0.6852691747275875
Energy: 0.7377724453021794
Energy: 0.7300895799855314
Energy: 0.6861347102398053
Energy: 0.7399085001341993
Energy: 0.6825339418539778
Energy: 0.7045626828961046
Energy: 0.7384360872639213
Energy: 0.6864520059861362
Energy: 0.7055372789543375
Energy: 0.7365324016158459
Energy: 0.6868777191412508
Energy: 0.6255029849209095
Energy: 0.6514966326870617
Energy: 0.6523486669769573
Energy: 0.6259559504465182
Energy: 0.6478149017247538
Energy: 0.650819546108587
Energy: 0.6528693909136505
Energy: 0.6939705352427623
Energy: 0.6646441009676916
Energy: 0.6532935787619042
Energy: 0.6837635978554978
Energy: 0.6645630600158101
Energy: 0.7916381098322585
Energy: 0.6924335782345536
Energy: 0.692241600071585
Energy: 0.6897816933910699
Energy: 0.6959822609340269
Energy: 0.6965053999104828
Energy: 0.707219336509416
Energy: 0.6967740865015956
Energy: 0.7145502215511417
Energy: 0.690597829024743
Energy: 0.6820761682218952
Energy: 0.6866364795233663
Energy: 0.7178617006541835
Energy: 0.6950015739441718
Energy: 0.6957759243560488
Energy: 0.6773456773305165
Energy: 0.6984943188384457
Energy: 0.689148556480681
Energy: 0.7219561357515623
Energy: 0.7385034741425466
Energy: 0.7222770877565137
Energy: 0.7224267613855458
Energy: 0.739522940062943
Energy: 0.7229199228379198
Energy: 0.6827469024863028
Energy: 0.6563498943419399
Energy: 0.6554992037073731
Energy: 0.6828334429657593
Energy: 0.6560287064367482
Energy: 0.6569311725745246
Energy: 0.7187661225305411
Energy: 0.6688880854759264
Energy: 0.6723977776926415
Energy: 0.7191594386812171
Energy: 0.655116885592409
Energy: 0.652033627547159
Energy: 0.7914358980005761
Energy: 0.6903045706192623
Energy: 0.694014762766607
Energy: 0.801505217492266
Energy: 0.6868792579295593
Energy: 0.6735993308933175

minimum gb energy = 0.6255029849209095 eV
minimum distance =  2.6398972880995 Angstroms
sigma value = 101


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

Energy: 0.8709815096948149
Energy: 1.1383041127527296
Energy: 1.014716195291013
Energy: 0.8724855289401953
Energy: 1.1254327995592792
Energy: 0.811230023268661
Energy: 0.811049304725824
Energy: 0.6749429675497589
Energy: 0.6566651890452014
Energy: 0.8101908343608305
Energy: 0.697827186335152
Energy: 0.6710486564916749
Energy: 0.7309689523687664
Energy: 0.7438901992381599
Energy: 0.741215785380221
Energy: 0.7313629123782902
Energy: 0.7399059853375585
Energy: 0.7273488803292265
Energy: 0.7763730299344668
Energy: 0.687182298389163
Energy: 0.6728963550070686
Energy: 0.7772910885185724
Energy: 0.7017838097058211
Energy: 0.6724815064536462
Energy: 0.6170005296993276
Energy: 0.738678678400041
Energy: 0.7184133690152349
Energy: 0.6183305310431645
Energy: 0.738405278867246
Energy: 0.6381898179952142
Energy: 0.7311211915909009
Energy: 0.7129378793771282
Energy: 0.6691823088984405
Energy: 0.7313257038267114
Energy: 0.7484545775403854
Energy: 0.6677142391762907
Energy: 0.6620339382266687
Energy: 0.9443521067823083
Energy: 0.9131242867152001
Energy: 0.6621581472190284
Energy: 0.94230103159695
Energy: 0.9024069059363268
Energy: 0.7676210330478118
Energy: 0.6735008155761018
Energy: 0.6767397795832765
Energy: 0.767975985563351
Energy: 0.7115745941361451
Energy: 0.7308084288020429
Energy: 0.606987965815674
Energy: 0.6625624473520897
Energy: 0.6337841172802277
Energy: 0.606927334936402
Energy: 0.6593201554177723
Energy: 0.6351043348495087
Energy: 0.642279508025979
Energy: 0.6695733677205344
Energy: 0.6782500621660557
Energy: 0.6430580747800012
Energy: 0.717062081206518
Energy: 0.6627144637352124
Energy: 0.7328418889548324
Energy: 0.8379833840966612
Energy: 0.8130069084132849
Energy: 0.733502310493427
Energy: 0.8385374125561678
Energy: 0.7954231448410393
Energy: 0.7134408553786179
Energy: 0.6591984130005495
Energy: 0.6776997596736001
Energy: 0.7147948310706697
Energy: 0.6559689655810332
Energy: 0.6733723403785765
Energy: 0.7443880541397688
Energy: 0.9118998335308656
Energy: 0.9132461143266015
Energy: 0.7448292194138351
Energy: 0.7386742084000847
Energy: 0.9115090354295095
Energy: 0.7450947407835197
Energy: 0.6754172667038948
Energy: 0.6883447994191905
Energy: 0.6187797248705782
Energy: 0.6828862149749794
Energy: 0.6826404550889611
Energy: 0.6592676320467683
Energy: 0.6196679929822088
Energy: 0.635461107943808
Energy: 0.6601305030825438
Energy: 0.6185190002336192
Energy: 0.6414287218685922
Energy: 0.8133530801269917
Energy: 0.6270896352339947
Energy: 0.6383133095117273
Energy: 0.7135117223612123
Energy: 0.6828008226995529
Energy: 0.6619938503736994
Energy: 0.8741081845307217
Energy: 0.8610325239835979
Energy: 1.0112787264340495
Energy: 0.8716961800564894
Energy: 0.8689374617016892
Energy: 0.803619606458569
Energy: 0.7221944239783924
Energy: 0.6232093545603757
Energy: 0.7644317941906762
Energy: 0.7292005450300257
Energy: 0.7410221371707986
Energy: 0.6814347915943145
Energy: 0.7393011696697186
Energy: 0.7576851570744918
Energy: 0.7424465151403827
Energy: 0.7384542057228353
Energy: 0.7719339891811847
Energy: 0.7292936939908482
Energy: 0.7525745007723349
Energy: 0.7480571458423194
Energy: 0.6473820142873453
Energy: 0.7537426077830127
Energy: 0.7546782851729069
Energy: 0.6684094826621331
Energy: 0.6192485061909595
Energy: 0.6820441167296986
Energy: 0.7416373794281943
Energy: 0.6186277620849446
Energy: 0.7511890951908271
Energy: 0.6417382073522769
Energy: 0.6201839962365651
Energy: 0.7093792317297362
Energy: 0.6658636475612508
Energy: 0.621231007045767
Energy: 0.7581979264119844
Energy: 0.6719123266785283
Energy: 0.6696461500899638
Energy: 0.9449994512282655
Energy: 0.9244913656451161
Energy: 0.670319390072616
Energy: 0.7578819801823736
Energy: 0.9093117142612783
Energy: 0.6945697412282493
Energy: 0.6913099584315967
Energy: 0.6766910513470042
Energy: 0.7262082856148814
Energy: 0.8734499501713753
Energy: 0.7227584582487017
Energy: 0.6059575703981587
Energy: 0.6503424317571818
Energy: 0.6342680314856127
Energy: 0.6062554785559219
Energy: 0.6729963429981608
Energy: 0.6471916555878828
Energy: 0.6065929909081239
Energy: 0.661275785009066
Energy: 0.6626472978602694
Energy: 0.6066129690138502
Energy: 0.7127579243413087
Energy: 0.6484394823475492
Energy: 0.7809891157834009
Energy: 0.846898248070794
Energy: 0.8245332244561724
Energy: 0.7808053965651139
Energy: 0.8477922052988195
Energy: 0.8103848355506267
Energy: 0.7250421735331188
Energy: 0.7615847500431968
Energy: 0.6794813183286896
Energy: 0.7259849622403832
Energy: 0.6182032968397643
Energy: 0.6777406342084393
Energy: 0.7445741418197115
Energy: 0.7272868015696311
Energy: 0.6770138707389394
Energy: 0.7355548413198341
Energy: 0.7248482468768516
Energy: 0.664878152181173
Energy: 0.7444479149195973
Energy: 0.6992875788177668
Energy: 0.6767115166378157
Energy: 0.7449213414096372
Energy: 0.7261561758902172
Energy: 0.6781316379338064
Energy: 0.6708672747415503
Energy: 0.6362852097957351
Energy: 0.6473490450215694
Energy: 0.6705203149042878
Energy: 0.6176383248420848
Energy: 0.6474359300863698
Energy: 0.7132423270729258
Energy: 0.6271779732107788
Energy: 0.6420282279393498
Energy: 0.6632402294518273
Energy: 0.6370927821545213
Energy: 0.6420474024092248
Energy: 0.8711235420068765
Energy: 0.7027671583376371
Energy: 0.7042756602001043
Energy: 0.8715441689929402
Energy: 0.7015114998567894
Energy: 0.6771921613769671

minimum gb energy = 0.6059575703981587 eV
minimum distance =  2.65354233978941 Angstroms
sigma value = 33


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

Energy: 0.009797881719183022
Energy: 0.4552339886123434
Energy: 0.010268921869016146
Energy: 0.010964531040892971
Energy: 0.45696239670387867
Energy: 0.010139025831168642
Energy: 0.37534412303990283
Energy: 0.0771805068810695
Energy: 0.07671244562799188
Energy: 0.07762997557682226
Energy: 0.07814698755666007
Energy: 0.07656832071596262
Energy: 0.757765366357833
Energy: 0.45609639608974734
Energy: 0.4554941136879967
Energy: 0.45534456329719925
Energy: 0.45721302270786235
Energy: 0.45509768009343615
Energy: 0.37534412304194087
Energy: 0.07718050688176828
Energy: 0.07671244562799188
Energy: 0.0776299755761429
Energy: 0.07814698755631067
Energy: 0.07656832071561323

minimum gb energy = 0.009797881719183022 eV
minimum distance =  2.84423331095715 Angstroms
sigma value = 1