Model name: model_name=EAM_Dynamo_BorovikovMendelevKing_2016_CuZr__MO_097471813275_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.638568460941315
cohesive_energy=3.4069304484773077
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.85150736178308e-19, 2.33416307277558e-19, 2.75507089629372e-19, 3.1240041098049e-19, 3.4409627133091194e-19, 3.70778920993548e-19, 3.9327828746481e-19, 4.1256208543163392e-19, 4.2941858579794795e-19, 4.44386119912776e-19, 4.57812360105696e-19, 4.699408372250759e-19, 4.81015082119284e-19, 4.9133950834878e-19, 5.012441643001679e-19, 5.107755130958339e-19, 5.19648367294926e-19, 5.27463784915578e-19, 5.338660827450419e-19, 5.387206779460619e-19, 5.42102872820436e-19, 5.442481873333619e-19, 5.4542899151262e-19, 5.45807105198244e-19, 5.45406561039744e-19, 5.44129626262446e-19, 5.41862546325336e-19, 5.38457920978086e-19, 5.3373310208442e-19, 5.27463784915578e-19, 5.193775994437799e-19, 5.0916372340202995e-19, 4.964840975205539e-19, 4.809734255267999e-19, 4.622199480258299e-19, 4.39720581554568e-19, 4.12821638046342e-19, 3.80531370164706e-19, 3.41101803201966e-19, 2.9101455726985798e-19, 2.22827521903452e-19, 1.208263884588126e-19, -4.50735545913318e-20, -3.1792792036779e-19, -7.806028865576759e-19, -1.595731077401418e-18, -3.09984328616418e-18, -6.0248250144935995e-18, -1.20618265714056e-17, -2.54814978401262e-17, -5.836793564727359e-17, -1.5040128738114539e-16, -4.62048515125992e-16]
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: 0.014673199379589653
Energy: 0.020936703514662234
Energy: 0.11191123844757134
Energy: 0.11151203573526479
Energy: 0.019792506646142592
Energy: 0.015933948102023025
Energy: 0.11006035708155144
Energy: 0.11296777602276888
Energy: 0.1111296254662513
Energy: 0.018769290713017046
Energy: 0.015303540194868341
Energy: 0.11553414618409771
Energy: 0.11031887096773303
Energy: 0.11240054241257996
Energy: 0.11235316990093548
Energy: 0.11041016393436559
Energy: 0.11524912943467772
Energy: 0.11019884081913614
Energy: 0.11292755019883066
Energy: 0.1116556949265048
Energy: 0.11252978058816694
Energy: 0.018149416125682313
Energy: 0.0150375763756111
Energy: 0.1103368377564581
Energy: 0.111548708837655
Energy: 0.11212342785796264
Energy: 0.01758970348962785
Energy: 0.015084599357043076
Energy: 0.1102591188141035
Energy: 0.11233425966325579
Energy: 0.11158184784625126
Energy: 0.01614500136803475
Energy: 0.01610796070241293
Energy: 0.11399298635448303
Energy: 0.11021454106815262
Energy: 0.1120281885182776
Energy: 0.016675668003077102
Energy: 0.01537254310190922
Energy: 0.11131175674892642
Energy: 0.10963184823158183
Energy: 0.11096754340379239
Energy: 0.11093909844543551
Energy: 0.11317734734230768
Energy: 0.01659768204684049
Energy: 0.016230252898167027
Energy: 0.11070392854072748
Energy: 0.11146605009029475
Energy: 0.11287156440754609
Energy: 0.017344705954582137
Energy: 0.11354394846247412
Energy: 0.11363491816970595
Energy: 0.1105955934639508
Energy: 0.11112103855016786
Energy: 0.015709361706896255
Energy: 0.01915169558096801
Energy: 0.11348002820410266
Energy: 0.10985357933541508
Energy: 0.11207312144367725
Energy: 0.016304060322634754
Energy: 0.015122937103622433
Energy: 0.015190252629795469
Energy: 0.11330365042293013
Energy: 0.11144200322328403
Energy: 0.11101355888941078
Energy: 0.11408884370444315
Energy: 0.01950654265547321
Energy: 0.11420339930853414
Energy: 0.11106945631689441
Energy: 0.11127171797977034
Energy: 0.11357561235613702

minimum gb energy = 0.014673199379589653 eV
minimum distance =  2.53128433366565 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

Energy: 1.275058204320511
Energy: 0.9269052990196438
Energy: 0.8958440397972963
Energy: 0.8982133362318124
Energy: 0.8757109959350892
Energy: 0.8750146098921643
Energy: 0.8563992103658797
Energy: 0.8970010346554624
Energy: 0.8976530763642205
Energy: 0.9353912456964231
Energy: 0.8724980743768334
Energy: 1.0481466923114995
Energy: 0.8998964860746901
Energy: 0.8975427081317936
Energy: 0.7479944794000436
Energy: 0.7718169467915839
Energy: 0.9919775382533598
Energy: 0.8956234488667678
Energy: 0.8960930670906394
Energy: 0.9166400552167071
Energy: 0.922162695159106
Energy: 0.9597424163131862
Energy: 0.7954910503768439
Energy: 0.7449310036917269
Energy: 0.7666733984724353
Energy: 0.7446107160537132
Energy: 0.9752591872455012
Energy: 0.7983581105582889
Energy: 0.9108454406238186
Energy: 0.9183692250962775
Energy: 0.9234000699026297
Energy: 0.9063537314667651
Energy: 0.9232957252243894
Energy: 0.744755139687196
Energy: 0.7673608540082637
Energy: 0.7448790878869029
Energy: 0.9011225439868619
Energy: 0.9012644593577162
Energy: 0.9122013487411128
Energy: 0.9016841559003003
Energy: 0.9390331738399347
Energy: 0.9171659187209887
Energy: 0.9798634824826278
Energy: 0.9310458621220504
Energy: 0.8461935145306919
Energy: 1.0284241618859968
Energy: 0.9102685714078496
Energy: 0.9925688577720502
Energy: 0.9575506323656067
Energy: 0.8303226273769745
Energy: 0.9002292858139004
Energy: 0.9044141837549523
Energy: 0.9925235421991718
Energy: 0.8208448443607048
Energy: 0.9446051464449948
Energy: 0.900489367667219
Energy: 0.9617264308609081
Energy: 0.9804035677000411
Energy: 0.8202176123016346
Energy: 0.989147940178997
Energy: 0.9390059594749834
Energy: 0.895793282483224
Energy: 1.033971897991455
Energy: 0.8348825682535791
Energy: 0.9426956687437265
Energy: 0.9411170814768994
Energy: 0.9209355074416153
Energy: 0.8687141098043051
Energy: 0.8446403662875582
Energy: 0.9434902629143661
Energy: 0.9406734871198841
Energy: 0.9524357477115111
Energy: 0.972173767163012
Energy: 0.8357713791279302
Energy: 0.9343228842100966
Energy: 0.9469574287067986
Energy: 0.9392189911171425
Energy: 0.9296364897276229
Energy: 0.9331800784213984
Energy: 0.9533748352747085
Energy: 0.9390711171313543
Energy: 0.8627115781289583
Energy: 0.7733905283897405
Energy: 1.0385895377658065
Energy: 0.9418646252065329
Energy: 1.0279098684645651
Energy: 0.8758931792157567
Energy: 0.7569846154774115
Energy: 0.9582717985770927
Energy: 0.947957324532312
Energy: 0.9869146721413978
Energy: 0.822124960345533
Energy: 0.8218670211205761
Energy: 0.868110149286812
Energy: 0.9337380231002211
Energy: 0.8834828884669161
Energy: 0.8941796190110831
Energy: 0.8343637402509553
Energy: 0.895841178081037
Energy: 0.8192900515520279
Energy: 1.0065361090339429
Energy: 0.8293514333553055
Energy: 0.8428529263856909
Energy: 0.867951618470066
Energy: 0.8031269495625485
Energy: 0.9312282383358221
Energy: 0.8371220624031803
Energy: 0.8462361439949823
Energy: 0.7863766694797841
Energy: 0.7902966615939924
Energy: 0.9294208528261011
Energy: 0.6893322433893826
Energy: 1.0016377971952748
Energy: 0.9496200751173233
Energy: 0.9471849236188262
Energy: 1.055790836166552
Energy: 0.8244142543363229
Energy: 0.9586558334144815
Energy: 0.966655591344929
Energy: 1.0004752308001785
Energy: 0.8336108158778208
Energy: 0.8009972893183459
Energy: 0.8346959286761241
Energy: 0.9097643452960672
Energy: 0.9472976865726654
Energy: 1.074420524697988
Energy: 0.8298712709644845
Energy: 0.9753457276967419
Energy: 0.9072534755712691
Energy: 0.9479336332289701
Energy: 0.6882693181839133
Energy: 0.6903830823959235
Energy: 0.9370525466386276
Energy: 0.9369892666440244
Energy: 0.9816372532448003
Energy: 0.893219577014269
Energy: 0.9376443681164098
Energy: 0.9343877033860108
Energy: 0.9401073120470548
Energy: 0.9007956713349207
Energy: 0.8971444664115955
Energy: 0.8998072157277002
Energy: 0.93480324410854
Energy: 0.9352583796300121
Energy: 0.9421350325819573
Energy: 0.9349478375874174
Energy: 0.9386606856161547
Energy: 0.934306156059257
Energy: 0.9339159311184292
Energy: 0.9016548731461029
Energy: 0.6888545412554649
Energy: 1.0642151833724423
Energy: 0.9379486327775909
Energy: 0.9360617260531864
Energy: 0.8346246449600101
Energy: 0.7760337170201574
Energy: 0.9548307281503599
Energy: 0.9352623907462273
Energy: 0.934469374874906
Energy: 0.6894305291360776
Energy: 0.7196485751139222
Energy: 1.029587175320456
Energy: 0.7931379563986395
Energy: 0.8996626031969656
Energy: 0.8204004687550659
Energy: 0.8965709493608183
Energy: 0.8477495840597772
Energy: 0.7960821078121278
Energy: 0.9084692646846017
Energy: 0.6881341269926775
Energy: 0.7194243697481283
Energy: 0.8109301738407471
Energy: 0.898938757429333
Energy: 0.8311616019113464
Energy: 0.779032696365631
Energy: 0.8934413395780524
Energy: 0.8014140702629691
Energy: 0.7966538525336431
Energy: 0.7175567353618739
Energy: 0.8028673766744199
Energy: 0.882978904941383
Energy: 0.9354303424842745
Energy: 0.9800407647346355
Energy: 1.0011341775608082
Energy: 0.8002568680307557
Energy: 0.948843585846869
Energy: 0.9416689575287706
Energy: 0.975665347061056
Energy: 0.9285600481193358
Energy: 0.6894200445317824
Energy: 0.9539831451084122
Energy: 0.9647988974642345
Energy: 0.924245002344539
Energy: 0.8220439509943138
Energy: 0.9944783146300935
Energy: 0.9052327786481135
Energy: 0.954685489029294
Energy: 0.9851095027291329
Energy: 0.8891550541961468
Energy: 0.993340591614703
Energy: 1.0293013811905813
Energy: 0.9375711122375082
Energy: 0.8016643694812998
Energy: 0.8425847250089885
Energy: 0.9726152111918334
Energy: 1.0370366033200997
Energy: 1.0172517658458424
Energy: 0.992197060215564
Energy: 0.8298872604142975
Energy: 1.0022259962659816
Energy: 1.0463105938104307
Energy: 0.9537419134327996
Energy: 0.9490838677295086
Energy: 0.8215117235059815
Energy: 0.939588311709486
Energy: 0.9504569567080924
Energy: 0.9569700832127991
Energy: 0.8406727071300809
Energy: 0.8268237358647026
Energy: 0.942349920015053
Energy: 0.9446617125039806
Energy: 0.9604831096136618
Energy: 0.7573326888065264
Energy: 0.9872552482419896
Energy: 0.9449829235990606
Energy: 1.030381715261574
Energy: 0.8555274779037862
Energy: 0.7575398119596806
Energy: 0.9661794686376712
Energy: 0.9438451913241589
Energy: 0.9343400397224477
Energy: 0.8534753390577514
Energy: 0.8463361356330761
Energy: 0.8949426914193679
Energy: 0.9002914664961581
Energy: 0.8589804354888837
Energy: 0.8661986835294959
Energy: 0.8260189073237416
Energy: 0.9080733032386528
Energy: 0.85451805505203
Energy: 0.9844052457315373
Energy: 0.8249825239045215
Energy: 0.8304290427516337
Energy: 0.8695647417846536
Energy: 0.8021728711156364
Energy: 0.8669085354647601
Energy: 0.8356689083144755
Energy: 0.8238478440558509
Energy: 0.9489361082800704
Energy: 0.8541746296039748
Energy: 1.0886942143292782
Energy: 0.911865885869278
Energy: 0.8284043919181303
Energy: 0.8575179465360979
Energy: 0.8916183002252559
Energy: 1.0256046951723503
Energy: 0.7465813371376844
Energy: 0.8286526495923491
Energy: 0.9797212465592636
Energy: 0.8964582146955021
Energy: 1.0271619331887072
Energy: 0.8893963434440985
Energy: 1.0029041452870977
Energy: 0.9598710021502698
Energy: 0.9044194135869
Energy: 0.9334067675826815
Energy: 0.9161216359971892
Energy: 0.8614727915939364
Energy: 0.9481998967898417
Energy: 0.9041194648036206
Energy: 0.9063546555299672
Energy: 0.9150866037095762
Energy: 0.8951041370911239
Energy: 0.8931543483715549
Energy: 0.8584140639742773
Energy: 0.7467242145854099
Energy: 0.8523784199932344
Energy: 0.896311683667243
Energy: 0.899934457911773
Energy: 1.023871634309303
Energy: 0.9137339914583786
Energy: 0.8718026730677408
Energy: 0.8963573241539994
Energy: 0.8993863387852149
Energy: 0.8743289888105156
Energy: 0.9118280228763603
Energy: 0.8540402945135085
Energy: 0.8953567948772275
Energy: 0.8960552370103131
Energy: 0.9405257239794268

minimum gb energy = 0.6881341269926775 eV
minimum distance =  2.12505500107476 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

Energy: 1.6999853211080633
Energy: 1.0207080240302058
Energy: 0.9061697110461262
Energy: 1.0155267180485306
Energy: 1.0022362049065425
Energy: 0.9971749175638698
Energy: 1.0003092075472706
Energy: 0.9467038568647016
Energy: 1.019420382624591
Energy: 1.0384159616534918
Energy: 0.8992540174963172
Energy: 1.1121969251020594
Energy: 0.9455509116840125
Energy: 1.0189443759695926
Energy: 0.9085146736490406
Energy: 0.9357628784931258
Energy: 1.003291772881945
Energy: 0.9181650340100086
Energy: 1.0638680777858245
Energy: 0.9853399092539424
Energy: 1.0148788037081817
Energy: 1.072080564897918
Energy: 1.08589346302311
Energy: 0.9581799312228252
Energy: 0.9497742496166078
Energy: 0.8840232866809762
Energy: 1.0724796618134849
Energy: 1.085905217836857
Energy: 0.9745633883077583
Energy: 0.9498823835850854
Energy: 1.0000081347555443
Energy: 0.9481088116058679
Energy: 1.1121847582269597
Energy: 0.8807025616067754
Energy: 0.9521369553726963
Energy: 0.8985909383369984
Energy: 0.9042386501149694
Energy: 0.9706144399179915
Energy: 0.9379386199185504
Energy: 0.95223055843682
Energy: 1.1302785077126276
Energy: 0.9108885721946588
Energy: 1.0580982837738155
Energy: 1.0898558655936903
Energy: 0.9028112302000333
Energy: 1.0115021747218345
Energy: 0.878031170960031
Energy: 1.0644369291833788
Energy: 1.0814803848918457
Energy: 1.037474949714314
Energy: 1.018531833903865
Energy: 1.0136078837781488
Energy: 1.0260462136242432
Energy: 0.9585893032299589
Energy: 1.0249426212911967
Energy: 1.0067501207788776
Energy: 1.002050597041326
Energy: 1.0202739559445704
Energy: 0.9820535270536694
Energy: 1.0430933110269243
Energy: 0.9932962190797213
Energy: 0.9418553608565697
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Energy: 0.9912134475504932
Energy: 0.9230799337508654
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Energy: 1.037722186293749
Energy: 1.0112652688361872
Energy: 0.9263333234080026
Energy: 0.9784239655911762
Energy: 0.9512145549229492
Energy: 1.0298101277362528
Energy: 1.086740775234262
Energy: 1.0853575827514899
Energy: 0.8955220189694253
Energy: 0.9513148378804293
Energy: 0.9457056883590028
Energy: 1.066955057907345
Energy: 1.0857025240751919
Energy: 0.9744206328456347
Energy: 0.950347260423912
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Energy: 0.9712940748044178
Energy: 1.1248126684723254
Energy: 0.8926556915295369
Energy: 0.9504194653102639
Energy: 0.9145287949315893
Energy: 0.9001186156601381
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Energy: 0.9905074958054694
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Energy: 0.9245953268443038
Energy: 1.0786182342337796
Energy: 1.0947205955441133
Energy: 1.0043762969785703
Energy: 1.0076362913100843
Energy: 0.8938748474992346
Energy: 1.0274898804401997
Energy: 1.0941487376607437
Energy: 1.0646957422157404
Energy: 1.012807925013226
Energy: 1.0106737414409572
Energy: 1.0544724731559256
Energy: 1.2180489070214606
Energy: 1.0239489074131871
Energy: 0.897620803300696
Energy: 1.011899845502986
Energy: 1.028455828105814
Energy: 1.0857025095848218
Energy: 0.9625398057242442
Energy: 0.9786670727303025
Energy: 1.022297049709385
Energy: 1.1081661360356234
Energy: 1.053572963658626
Energy: 0.914591461197753
Energy: 0.9014823084308861
Energy: 1.0167015227702065
Energy: 1.0132113266766558
Energy: 1.088188517220538
Energy: 1.0006083968553954
Energy: 0.9775809196713223
Energy: 1.0384376834946003
Energy: 1.0854426240836907
Energy: 0.9871332917094182
Energy: 0.914388834164564
Energy: 0.9531467801480447
Energy: 0.9481811267369836
Energy: 1.0749415848709474
Energy: 0.999782661586831
Energy: 0.9635842641372181
Energy: 0.9581874988393392
Energy: 1.0616972133029015
Energy: 0.985299959326214
Energy: 1.0375620389895204
Energy: 0.8674289328986134
Energy: 0.9055207020126522
Energy: 1.060068800683455
Energy: 0.8765897154789623
Energy: 1.0436477646737006
Energy: 1.2497585905057862
Energy: 1.0368774823232356
Energy: 1.0053026719754952
Energy: 0.9073276668152895
Energy: 1.091100736603793
Energy: 1.1403600874403417
Energy: 1.0109692035732822
Energy: 1.0059848089887546
Energy: 0.8969642186507726
Energy: 1.0615212353319479
Energy: 1.096932533765031
Energy: 1.0767736551977805
Energy: 0.9146441826445073
Energy: 1.0032471103260674
Energy: 0.9125387060293917
Energy: 1.0930533851691304
Energy: 1.0275292055016383
Energy: 0.886073813319647
Energy: 1.0049868230202605
Energy: 0.9122472748203787
Energy: 1.1012177523762836
Energy: 0.9558445636264966
Energy: 0.9087585256600654
Energy: 1.1129607006200095
Energy: 1.0715313099836064
Energy: 0.9625591573824046
Energy: 0.8790009689480709
Energy: 0.8762300489891596
Energy: 1.0384017410309907
Energy: 1.0720553900347656
Energy: 0.9782496726213208
Energy: 0.943784151689849
Energy: 0.9427402766384192
Energy: 1.0196096445150997
Energy: 1.0731545457889622
Energy: 0.9791679300975255
Energy: 0.9560146043923902
Energy: 0.9428364050137201
Energy: 1.036650483175002
Energy: 1.072801931746929
Energy: 1.0321327138053957
Energy: 0.9517668458134528
Energy: 0.9824631893829864
Energy: 1.1280481495281514
Energy: 1.007512776294423
Energy: 1.0707917471764299
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minimum gb energy = 0.8490204898988253 eV
minimum distance =  2.19982643629252 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 0.9932072470821214
Energy: 1.0215816922695773
Energy: 0.9068101457093981
Energy: 0.9902071344015213
Energy: 0.9377256424671533
Energy: 0.9936297763487763
Energy: 1.0214659902599381
Energy: 0.9141026862677586
Energy: 0.9946923592509014
Energy: 1.0656391340645994
Energy: 0.9914104794713112
Energy: 1.0078662034267916
Energy: 1.010905140891977
Energy: 0.9453875681455234
Energy: 0.9975470869763604
Energy: 0.9922931560170289
Energy: 0.9135211710782927
Energy: 1.0140684458182703
Energy: 0.9446608742591632
Energy: 0.9972860112628839
Energy: 0.9439472808677795
Energy: 0.9419425866844165
Energy: 0.9344187720089242
Energy: 0.9435960517027246
Energy: 0.991068501521168
Energy: 0.9438162030882818
Energy: 0.9007362057572309
Energy: 0.9348890570188855
Energy: 0.9441145513307656
Energy: 0.9895989069451984
Energy: 0.9397008362685
Energy: 1.0042095688438544
Energy: 0.9344057936682819
Energy: 1.043301386063681
Energy: 0.9940385458079305
Energy: 0.9394990008986717
Energy: 0.9502726463250607
Energy: 0.9345683601871022
Energy: 0.9768964514966927
Energy: 0.9915263426153278
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Energy: 0.9418866270922717
Energy: 0.947670963052356
Energy: 0.8927084945041277
Energy: 0.9327085640919947
Energy: 0.8952790713633673
Energy: 0.94456391360132
Energy: 0.932495459162482
Energy: 0.8939084261921313
Energy: 0.9337102942121389
Energy: 1.0679597819352957
Energy: 0.934182883135824
Energy: 1.0239322185894848
Energy: 0.9152393097223099
Energy: 0.9341447862391694
Energy: 0.9325412170514779
Energy: 0.9341041519890833
Energy: 1.0239659502364633
Energy: 0.9170981302709633
Energy: 0.9341656490133342
Energy: 0.941922572594413
Energy: 0.9328004040080934
Energy: 0.9125188997765786
Energy: 1.0238857168922295
Energy: 0.9507600109388542
Energy: 0.9420569622143632
Energy: 0.933014073886697
Energy: 0.8876342598553841
Energy: 1.025891826325494
Energy: 0.9508303806818843
Energy: 0.9591756132676699
Energy: 0.9910088991588584
Energy: 0.8943479491850622
Energy: 0.9932524590913483
Energy: 0.9936600711853784
Energy: 0.9613426651715979
Energy: 0.9917857929147431
Energy: 0.9542334789528968
Energy: 0.9912604469539982
Energy: 0.9957574501573966
Energy: 0.9909229127678221
Energy: 0.9897514616129711
Energy: 1.0064661862031827
Energy: 0.9932505827944557
Energy: 1.1138368202057998
Energy: 0.9926365402505221
Energy: 0.9904724016377849
Energy: 1.0077028671591681
Energy: 0.9930197220339568
Energy: 0.9531015657712817
Energy: 0.8920188134295153
Energy: 0.9006263761428995
Energy: 0.9930564560263109
Energy: 0.9929181330745752
Energy: 0.9378879612777422
Energy: 0.8918588545754678
Energy: 0.8928327903814242
Energy: 0.992050605205059
Energy: 0.942485146853362
Energy: 0.9929508218841614
Energy: 0.8911778787669804
Energy: 0.8923701465723687
Energy: 0.892082976103959
Energy: 1.027737065908394
Energy: 0.9680629596527915
Energy: 0.8911803388199284
Energy: 0.8920995426732299
Energy: 0.8921348048196751
Energy: 1.028194776331909
Energy: 0.9665166592446169
Energy: 0.8913180236812307
Energy: 0.9015658511497668
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Energy: 0.881536805765503
Energy: 0.9901098177159058
Energy: 0.8911851208068408
Energy: 0.9007884849902593
Energy: 0.9016021739247537
Energy: 0.9304156827989104
Energy: 0.9898845962377295
Energy: 0.9958420245559665
Energy: 0.9537635726034792
Energy: 1.0172990810063405
Energy: 0.8934590449507264
Energy: 1.019912791096256
Energy: 0.945670502312225
Energy: 1.0168692259632488
Energy: 1.0171778316173503
Energy: 0.9011185667532582
Energy: 1.0198512268043647
Energy: 0.9958652096662026
Energy: 1.020569323156529
Energy: 1.0035581631903656
Energy: 1.0166896196216701
Energy: 1.0152638436418386
Energy: 0.9948714448841267
Energy: 1.0229855840613984
Energy: 1.003054533542196
Energy: 1.0222014107436548
Energy: 0.9539105337196498
Energy: 0.9917539432416612
Energy: 0.9024959491916864
Energy: 0.9042850875363541
Energy: 0.9913802484213854
Energy: 0.9005385329323815
Energy: 0.9590415326584838
Energy: 0.9026014550736301
Energy: 0.893525676784419
Energy: 0.9904362953223571
Energy: 0.8997330024457366
Energy: 0.9311642033209963
Energy: 0.8918684501889833
Energy: 0.9554029362030071
Energy: 0.8927528737032419
Energy: 0.9956523218690045
Energy: 0.9310546210954496
Energy: 0.8917793924966056
Energy: 0.8937764320696392
Energy: 0.8927296960790893
Energy: 1.1567074606592198
Energy: 0.9900815318266634
Energy: 0.8918520060192638
Energy: 0.8924434506539147
Energy: 0.902749899058622
Energy: 0.9243071519639213
Energy: 0.9901077960045226
Energy: 0.891810731764826
Energy: 0.8935618931983488
Energy: 0.9011645968704142
Energy: 0.9568372189605319
Energy: 0.9904941204972254
Energy: 1.0079647221043895
Energy: 0.9926963289143921
Energy: 0.9987714367418081
Energy: 0.944373022975241
Energy: 0.990472464178122
Energy: 1.0069245160758724
Energy: 0.9908745530473875
Energy: 0.9981291723605
Energy: 0.9602193491370786
Energy: 0.9462290643257885
Energy: 0.9941281446515491
Energy: 0.9932133065179289
Energy: 1.0019272129114567
Energy: 1.0213363413478678
Energy: 0.9563143363046779
Energy: 0.9946160669664661
Energy: 0.9933081157010826
Energy: 1.0030153758918379
Energy: 1.0113257920084082
Energy: 0.9310123777769648
Energy: 0.9896738599526157
Energy: 0.9437411028913308
Energy: 0.9019679808655243
Energy: 0.9967766017214285
Energy: 0.8894846491457682
Energy: 0.9608372398459163
Energy: 0.94306943936532
Energy: 0.8917798338811366
Energy: 0.9971585956558923
Energy: 1.1568431799442365
Energy: 0.938214622432116
Energy: 0.9358343339306862
Energy: 0.952964292173487
Energy: 0.9915014605054696
Energy: 0.9923438223264679
Energy: 0.9384885010228866
Energy: 0.9332258413644327
Energy: 0.951054630046716
Energy: 0.9915051850821316
Energy: 0.9974610705297503
Energy: 0.9327540374765124
Energy: 0.9468031139930404
Energy: 0.9341003008655171
Energy: 0.9901109795291495
Energy: 0.9948058030576327
Energy: 0.9452938955573932
Energy: 0.9470238170352414
Energy: 0.9347833364176547
Energy: 0.9918611838147083
Energy: 0.9336183182676286
Energy: 0.9434290000777635
Energy: 0.9489848716945989
Energy: 0.9341531668525463
Energy: 1.0240914114566608
Energy: 0.9332962467289058
Energy: 0.9472585445054957
Energy: 0.9492280914007513
Energy: 0.9349672577785422
Energy: 1.0239662884705323
Energy: 0.965916600477544
Energy: 0.9482868623530852
Energy: 0.9427845304781126
Energy: 0.9354955878398441
Energy: 1.0331397006068463
Energy: 0.9344494839766142
Energy: 0.948678898673166
Energy: 0.9433380655771404
Energy: 0.9326630097340534
Energy: 1.0243267576354007
Energy: 1.0234027159146117
Energy: 0.8909097609686903
Energy: 0.960298525500104
Energy: 0.9923248599229063
Energy: 0.9531952625353018
Energy: 1.0248071307797146
Energy: 0.8978515166947644
Energy: 0.9605456138481195
Energy: 0.9929338704613376
Energy: 0.9507471717018072
Energy: 0.9913496008959518
Energy: 1.018791599508986
Energy: 0.9919030870866162
Energy: 0.9654794863281795
Energy: 1.0121866272777837
Energy: 1.0201144646561877
Energy: 1.018857170784659
Energy: 0.9920253453634742
Energy: 0.9654972376989077
Energy: 0.9934591443124359
Energy: 0.9417055075288542
Energy: 1.0176969667566027
Energy: 0.892864671110328
Energy: 0.9498540337294193
Energy: 0.9919406500086358
Energy: 0.9419332291759263
Energy: 1.0231122656672067
Energy: 0.9011148829898563
Energy: 0.9502333133328084
Energy: 0.992864866322585
Energy: 0.9701473615509009
Energy: 0.8930096340971673
Energy: 0.8919485743670995
Energy: 0.8917712693804162
Energy: 0.8899130354847384
Energy: 0.886287411649139
Energy: 0.8928172233206587
Energy: 0.8922198469902377
Energy: 0.8919636312168685
Energy: 0.9672263886120199

minimum gb energy = 0.881536805765503 eV
minimum distance =  2.23002711350266 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 1.236017413082656
Energy: 0.9252896337275884
Energy: 0.9103131661827903
Energy: 0.9326888492261756
Energy: 0.8581878569487813
Energy: 1.1573753580362152
Energy: 0.9149382460021273
Energy: 0.913852919849438
Energy: 0.9448352320722335
Energy: 0.9255274410600961
Energy: 0.9415823148227221
Energy: 0.9518054007514578
Energy: 0.9318385092983474
Energy: 0.931739481766987
Energy: 0.9239614745140055
Energy: 0.9309567870108897
Energy: 0.8866801092979358
Energy: 0.9363179821571962
Energy: 0.9389548687193934
Energy: 0.9802853194088986
Energy: 0.9053130642910441
Energy: 1.0169042560703812
Energy: 0.9043480296864977
Energy: 0.9520130626498058
Energy: 0.9731615385279208
Energy: 0.9672602189834596
Energy: 0.959054131665231
Energy: 0.9578162779066739
Energy: 0.9464151932715421
Energy: 0.9760550562749144
Energy: 0.9870768615419608
Energy: 0.9326361563796509
Energy: 0.9558736361716184
Energy: 0.9576925434401601
Energy: 0.8996999236226152
Energy: 0.9552051605729509
Energy: 0.9369762699532982
Energy: 0.9062290162309172
Energy: 0.9057040376647421
Energy: 0.9747371302761269
Energy: 0.9681654019868419
Energy: 0.9334129939679676
Energy: 0.9539812576620503
Energy: 0.9453237417635921
Energy: 0.8842825811634396
Energy: 0.9476576791210455
Energy: 0.9347483708459664
Energy: 0.9495510314507977
Energy: 0.9470443345211199
Energy: 0.9415469246435365
Energy: 0.9657822001395615
Energy: 0.8945808668820835
Energy: 0.9669434073144579
Energy: 0.8927940698071432
Energy: 0.9524272722833529
Energy: 0.9661364966690715
Energy: 0.8940110054046112
Energy: 0.9532894957267861
Energy: 0.8946911950355797
Energy: 0.9725135184836666
Energy: 0.9541400107066915
Energy: 0.9622163205633768
Energy: 0.9700016491787875
Energy: 0.9451015101858127
Energy: 0.8926546336039082
Energy: 0.9825094815472949
Energy: 0.9805200270551587
Energy: 0.9685930780545419
Energy: 0.9407084281461137
Energy: 0.8913021484146276
Energy: 0.925447818868828
Energy: 0.9617276781247538
Energy: 0.9636459834893283
Energy: 0.9854431455463264
Energy: 0.9438594846674093
Energy: 0.8876237490287594
Energy: 0.9614902093506951
Energy: 0.9637996027650767
Energy: 0.9640262861330843
Energy: 0.9434939962146399
Energy: 0.8600837720185172
Energy: 0.9315336929616316
Energy: 0.9365668500967043
Energy: 0.9638616359768396
Energy: 0.9354454360182665
Energy: 0.8601999439890584
Energy: 0.9330998069012038
Energy: 0.9362811778169968
Energy: 0.9628583411197663
Energy: 0.9216939292617313
Energy: 0.951345733336068
Energy: 0.9158755445290528
Energy: 0.9659977958037584
Energy: 0.9766216526327566
Energy: 0.9612995621091922
Energy: 0.9265149666181096
Energy: 0.9543216015303183
Energy: 0.9649784708535523
Energy: 0.9780772564926519
Energy: 0.9607829857855337
Energy: 0.9691506863805215
Energy: 0.9835003602834012
Energy: 0.9542635323513134
Energy: 0.9856331108329123
Energy: 0.967937100002734
Energy: 0.986841138326124
Energy: 0.9848509670425412
Energy: 0.9544869655129908
Energy: 0.9984341903408063
Energy: 0.9448787091979086
Energy: 0.9865075561272102
Energy: 0.9637947285766165
Energy: 0.9573319927284084
Energy: 0.8857749660086723
Energy: 0.8961981247661205
Energy: 1.0035287619357274
Energy: 0.9246269922330902
Energy: 0.9559562962417398
Energy: 0.9504259350764691
Energy: 0.9770100913542127
Energy: 0.991891897644025
Energy: 0.9329650291646678
Energy: 0.885582728783754
Energy: 0.941850490599718
Energy: 0.9063804940590555
Energy: 0.9898890631204731
Energy: 0.9344141533140133
Energy: 0.9541327661818951
Energy: 0.9463611837616548
Energy: 0.9150800660820273
Energy: 0.9441627499234632
Energy: 0.8953833531291461
Energy: 0.9318658265381664
Energy: 0.8934699494011077
Energy: 0.8839896234498505
Energy: 0.9064636120677023
Energy: 0.8955054004857944
Energy: 0.9156634548126071
Energy: 0.8933743220481842
Energy: 0.9290465511560309
Energy: 0.9243984074747595
Energy: 0.94848786727003
Energy: 0.9318284190566613
Energy: 0.908764316282272
Energy: 0.8845417746736649
Energy: 0.9469337091048031
Energy: 0.9378661635366957
Energy: 0.9429576624399519
Energy: 0.9172225971453408
Energy: 0.9541953774272823

minimum gb energy = 0.8581878569487813 eV
minimum distance =  2.27098873293267 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 0.8009106497534431
Energy: 0.7913873665708674
Energy: 0.7921167086392066
Energy: 0.8039225946172911
Energy: 0.7717722411606034
Energy: 0.7840038324570415
Energy: 0.789428665938506
Energy: 0.7940486662984624
Energy: 0.8064419045248509
Energy: 0.8608839859150129
Energy: 0.8438055326205633
Energy: 0.8021465103650236
Energy: 0.7938257871637042
Energy: 0.7924421408500809
Energy: 0.8537593493220209
Energy: 0.8548435627354726
Energy: 0.7836213458988398
Energy: 0.7974766331295271
Energy: 0.7974247688178336
Energy: 0.8796570580630555
Energy: 0.8133782938178271
Energy: 0.8428828462835279
Energy: 0.8433109082838791
Energy: 0.8310309911434872
Energy: 0.8412607954530918
Energy: 0.8257635801401402
Energy: 0.8437792417485438
Energy: 0.8471474436486589
Energy: 0.8228575389390923
Energy: 0.8422117421257866
Energy: 0.8433243623319896
Energy: 0.794076741577756
Energy: 0.834072499898697
Energy: 0.8342117274852705
Energy: 0.9654034389062859
Energy: 0.8593685057190639
Energy: 0.7975361036203278
Energy: 0.8143529130133713
Energy: 0.8489695843503192
Energy: 0.8510394012995044
Energy: 0.8553474244572397
Energy: 0.8339874024954719
Energy: 0.8525905433590185
Energy: 0.8536285026609352
Energy: 0.8422460988800075
Energy: 0.8190737782486038
Energy: 0.8332924960899608
Energy: 0.851294512494827
Energy: 0.8509154085362857
Energy: 0.867619007233414
Energy: 0.8744004046876217
Energy: 0.834825657413262
Energy: 0.8735414121025945
Energy: 0.8252393120535213
Energy: 0.8685698463802288
Energy: 0.874857438418095
Energy: 0.8353661406034546
Energy: 0.8639124346329942
Energy: 0.8541316081208138
Energy: 0.8833649972282077
Energy: 0.8612248330955418
Energy: 0.8511573233833012
Energy: 0.8503787033247853
Energy: 0.8004815411524289
Energy: 0.8663625276686652
Energy: 0.8214454097726094
Energy: 0.8508723518482513
Energy: 0.8505647138885012
Energy: 0.8498282964765318
Energy: 0.872106183852518
Energy: 0.8917275168201494
Energy: 0.8291461828170166
Energy: 0.8296451543446559
Energy: 0.8015016805668691
Energy: 0.8279107879931469
Energy: 0.9282894041359407
Energy: 0.8292627437944232
Energy: 0.8295334988947862
Energy: 0.8016432314910305
Energy: 0.8407819604820731
Energy: 0.8770453653909345
Energy: 0.8190128732838061
Energy: 0.9470131148323258
Energy: 0.8218546351705316
Energy: 0.8295259100112699
Energy: 0.8425875817489615
Energy: 0.8176976028206762
Energy: 0.7839109358067707
Energy: 0.8499891980425
Energy: 0.8291009399958262
Energy: 0.8670039776685053
Energy: 0.814947902041064
Energy: 0.8021574670510921
Energy: 0.8172634773843216
Energy: 0.8541513365479512
Energy: 0.8572304837511479
Energy: 0.8149690689002024
Energy: 0.8020142929664484
Energy: 0.8190986343644974
Energy: 0.8593927146150359
Energy: 0.8160559160126343
Energy: 0.8011922581713291
Energy: 0.8049455447688885
Energy: 0.8116774398848409
Energy: 0.799778015645965
Energy: 0.7838170506584817
Energy: 0.801427602400254
Energy: 0.8042534898185468
Energy: 0.8134836934412364
Energy: 0.8932931718486826
Energy: 0.8173236181511874
Energy: 0.817185858382368
Energy: 0.8012597023778136
Energy: 0.801490192784069
Energy: 0.8543178101333145
Energy: 0.8103868953134259
Energy: 0.8195866669448642
Energy: 0.7902149324283843
Energy: 0.8024647448439078
Energy: 0.8552091268176621
Energy: 0.8055713446003354
Energy: 0.8841277564794288
Energy: 0.7893024961045468
Energy: 0.8571747223202615
Energy: 0.8483745302182018
Energy: 0.8060359930937139
Energy: 0.8127722994038817
Energy: 0.7904709008671124
Energy: 0.8376673588044897
Energy: 0.8486278177139788
Energy: 0.8065955538057884
Energy: 0.8079303059242122
Energy: 0.8058162119634806
Energy: 0.837450777663708
Energy: 0.836210010172329
Energy: 0.8063141898165624
Energy: 0.8090080362477626
Energy: 0.8234832288492439
Energy: 0.8371568114323088
Energy: 0.8362670277085339
Energy: 0.8192426875326706
Energy: 0.808708712800194
Energy: 0.8313658423871072
Energy: 0.8798448604193435
Energy: 0.8307373482003849
Energy: 0.8152238158681258
Energy: 0.810356974172402
Energy: 0.8322268469889521
Energy: 0.8544509321399452
Energy: 0.8314013447290366
Energy: 1.0035386187970357
Energy: 0.8487706410427687
Energy: 0.8415233224091242
Energy: 0.8417688260667939
Energy: 0.8495837938984737
Energy: 0.9117855205610271
Energy: 0.8405616270172629
Energy: 0.8428725193117431
Energy: 0.8403742547919384
Energy: 0.8482116294556192
Energy: 0.8351792332442981
Energy: 0.8317496858411538
Energy: 0.8414901052036575
Energy: 0.8416685518776266
Energy: 0.856096328060646
Energy: 0.8335095345233714
Energy: 0.8316427468584161
Energy: 0.800852269551195
Energy: 0.8411462488567935
Energy: 0.8068005331253514
Energy: 0.839366233933998
Energy: 0.8514299527582111
Energy: 0.8873217825069996
Energy: 0.8585856563437989
Energy: 0.831733489364278
Energy: 0.8487742220816715
Energy: 0.851757793729264
Energy: 0.8359306131918729
Energy: 0.8585049556313187
Energy: 0.9131686330434361
Energy: 0.8640772511006101
Energy: 0.8630723360350214
Energy: 0.8624039587306248
Energy: 0.8759284752203741
Energy: 0.9098072769744945
Energy: 0.8620160918676336
Energy: 0.8657593088755311
Energy: 0.8662239984613074
Energy: 0.8692147836120533
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Energy: 0.851503464850087
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Energy: 0.8638103379306197
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Energy: 0.8280961855673422
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Energy: 0.8120904520573974
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Energy: 0.8197399832163856
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Energy: 0.866498331847872
Energy: 0.8279655382359635
Energy: 0.8294828632954051
Energy: 0.8460558711331368
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Energy: 0.8198343822512696
Energy: 0.7841139646046955
Energy: 0.8270848416703235
Energy: 0.8504937535349286
Energy: 0.8563909125813935
Energy: 0.8209218490709628
Energy: 0.8056212615773048
Energy: 0.8364096533556126
Energy: 0.8586813315424506
Energy: 0.78270953922233
Energy: 0.7852667175949506
Energy: 0.8018651833774445
Energy: 0.8373030597076636
Energy: 0.9722271699011058
Energy: 0.8054312862513248
Energy: 0.8045873022018974
Energy: 0.8062972409645591
Energy: 0.8302374857715372
Energy: 0.7946974763795067
Energy: 0.7945436847013361
Energy: 0.7887505954845996
Energy: 0.7916772598324003
Energy: 0.8298129256120375
Energy: 0.7978142633011789
Energy: 0.7928919287810382
Energy: 0.8015251097960966
Energy: 0.7981339854261836
Energy: 0.8572896369374383
Energy: 0.8721192076518278
Energy: 0.7940373910348328
Energy: 0.7908860898129509
Energy: 0.7991593875974143
Energy: 0.8444384565698629
Energy: 0.852465739139453
Energy: 0.7980241212873335
Energy: 0.7953738487265208
Energy: 0.8253617853299494
Energy: 0.8029901662717216
Energy: 0.7919002287393323
Energy: 0.8138623186176007
Energy: 0.8032690487350679
Energy: 0.7849081324639522
Energy: 0.9414759066118611
Energy: 0.7860391582457974
Energy: 0.8773056304366705
Energy: 0.809039250734175
Energy: 0.8162075840041921

minimum gb energy = 0.7717722411606034 eV
minimum distance =  2.31595876259892 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

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Energy: 0.5787441256872128
Energy: 0.778425145792714
Energy: 0.6864821701670186
Energy: 0.4525249247933661
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Energy: 0.7232723812362788
Energy: 0.7632661215756067
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Energy: 0.790488385925053
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Energy: 0.7190940621168604
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Energy: 0.7278575799675622
Energy: 0.7772089225601143
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Energy: 0.79402847241193
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Energy: 0.4893803096570392
Energy: 0.782618351750915
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Energy: 0.7791351366371756
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Energy: 0.8023999118961411
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Energy: 0.7998221880904921
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Energy: 0.6486852231703144
Energy: 0.7980382312180512
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Energy: 0.7520526156454046
Energy: 0.7701054966375739
Energy: 0.7307591037193729
Energy: 0.6900948151008739
Energy: 0.7012243416616187
Energy: 0.6696619048953979
Energy: 0.7795176578014849
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Energy: 0.42285281261176844
Energy: 0.7287882242286601
Energy: 0.6611102589196663
Energy: 0.7247150220861601
Energy: 0.7292805591229761
Energy: 0.4535581885086808
Energy: 0.6107909084695498
Energy: 0.6411371625696834
Energy: 0.7070529144560672
Energy: 0.42249845098753047
Energy: 0.41092515920695516
Energy: 0.7409032605318454
Energy: 0.8050937972737274
Energy: 0.7243783263943518
Energy: 0.45279476206681485
Energy: 0.4523021578914657
Energy: 0.6551243544211699
Energy: 0.7562503454056864
Energy: 0.7395999590233301
Energy: 0.7151393819504197
Energy: 0.5591877958847179
Energy: 0.7493544984933221
Energy: 0.7798952067110244
Energy: 0.6926973716253132
Energy: 0.6635921532283107
Energy: 0.6871055594724861
Energy: 0.7140449255484493
Energy: 0.7629769035914665
Energy: 0.7638454878361113
Energy: 0.5834576467165795
Energy: 0.7546217033968232
Energy: 0.7772856561009553
Energy: 0.7139997451487099
Energy: 0.5432547493084429
Energy: 0.45422481528236264
Energy: 0.7498450450135961
Energy: 0.7657548940249225
Energy: 0.7240823168453624
Energy: 0.5605322082664398

minimum gb energy = 0.3684342090045688 eV
minimum distance =  2.39442977467632 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 1.4390611299075091
Energy: 0.7306207137045547
Energy: 0.7523363007166729
Energy: 0.750389605979174
Energy: 0.7166238118790317
Energy: 0.7186792156157706
Energy: 0.7265138431024593
Energy: 0.7678585774343767
Energy: 0.7554067830383566
Energy: 0.7459580075916752
Energy: 0.7306296690356602
Energy: 0.7606177706609808
Energy: 0.7464877164304496
Energy: 0.7420956179289627
Energy: 0.75327345724564
Energy: 0.7436677157467956
Energy: 0.7486628471686145
Energy: 0.7719916368768761
Energy: 0.7375232136478923
Energy: 0.752021601176424
Energy: 0.7368983464728327
Energy: 0.7477397559941307
Energy: 0.7440984587856361
Energy: 0.761520240898379
Energy: 0.725153699718485
Energy: 0.7362934433566063
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Energy: 0.7436476703452288
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Energy: 0.725323230606253
Energy: 0.775008664395344
Energy: 0.767257623094629
Energy: 0.7526939905232002
Energy: 0.7444410832307907
Energy: 0.7469888992029565
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Energy: 0.7565721640534236
Energy: 0.7817753643174067
Energy: 0.7724805316039565
Energy: 0.743205740815955
Energy: 0.7439211448340249
Energy: 0.7441835317712902
Energy: 0.75736271462007
Energy: 0.7371292373924999
Energy: 0.7209247915588421
Energy: 0.7465455182980449
Energy: 0.7627921009549352
Energy: 0.7571220140632583
Energy: 0.7385805966332883
Energy: 0.7655250635833333
Energy: 0.7525440330019003
Energy: 0.744635462258776
Energy: 0.7835903014225452
Energy: 0.7834109998863875
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Energy: 0.7530066124376772
Energy: 0.7568930296240918
Energy: 0.8096059838988703
Energy: 0.7767360032062622
Energy: 0.7399324342602424
Energy: 0.7742468127463951
Energy: 0.7708586356810339
Energy: 0.7561939729318851
Energy: 0.7419433707748585
Energy: 0.7656548218863097
Energy: 0.7998841651407682
Energy: 0.7707179056293813
Energy: 0.7584611575643503
Energy: 0.7374063368274272
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Energy: 0.7380859437130596
Energy: 0.7508521652787179
Energy: 0.7341333956054662
Energy: 0.7470140893955746
Energy: 0.7371100534697562
Energy: 0.7373835066688987
Energy: 0.7508653529158855
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Energy: 0.7445262272231795
Energy: 0.7379494060805905
Energy: 0.7377046760154813
Energy: 0.7496666915287551
Energy: 0.754374828793217
Energy: 0.7503925038097917
Energy: 0.7427672188585348
Energy: 0.7369828106630579
Energy: 0.7356904241174571
Energy: 0.7548734240733451
Energy: 0.7463471626641938
Energy: 0.7440279933833749
Energy: 0.8132436692375438
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Energy: 0.7393447881992232
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Energy: 0.7362073775652064
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Energy: 0.7328874514076671
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Energy: 0.7369240366233651
Energy: 0.7658070760278891
Energy: 0.7473994433210669
Energy: 0.7561228846305033
Energy: 0.7398440946996319
Energy: 0.7367419847201967
Energy: 0.743321615231265
Energy: 0.7522277010343578
Energy: 0.7409936599003804
Energy: 0.7468695587928109
Energy: 0.7495985787118554
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Energy: 0.7302386793586537
Energy: 0.7405032658172854
Energy: 0.7701554226618363
Energy: 0.7458737885254105
Energy: 0.7398833832647063
Energy: 0.7454194130175656
Energy: 0.7497400625470331
Energy: 0.7379714771907954
Energy: 0.7297203467478901
Energy: 0.7582164443720592
Energy: 0.7266007389122382
Energy: 0.725560925835818
Energy: 0.7368071680891156
Energy: 0.7982224506819348
Energy: 0.7506547665378384
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Energy: 0.74879207450905
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Energy: 0.7172087120424042
Energy: 0.7266364720917299
Energy: 0.7530055700517289
Energy: 0.7459598401865509
Energy: 0.7473516391598981

minimum gb energy = 0.7164003185685568 eV
minimum distance =  2.31707149190686 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 1.3811120443119826
Energy: 0.9429666174541
Energy: 0.9606515453562751
Energy: 0.9427612710468591
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Energy: 0.9414923664117011
Energy: 0.9385211616785663
Energy: 0.9449446315126382
Energy: 0.9472059876521851
Energy: 0.9348397700123544
Energy: 0.9633466328389947
Energy: 0.9368209438916362
Energy: 0.9446325299973896
Energy: 0.9441509605836451
Energy: 0.9352549106563098
Energy: 0.9380702016001027
Energy: 0.936418531664043
Energy: 0.9430740191138379
Energy: 0.9791435132678025
Energy: 0.9364365750026812
Energy: 0.9370046206734212
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Energy: 0.9555271984074096
Energy: 0.9368716748762994
Energy: 0.9370327029752621
Energy: 0.9369977725692458
Energy: 0.9379405844724629
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Energy: 0.9373577958390447
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Energy: 0.9404520429781622
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Energy: 0.9386092855053666
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Energy: 0.9435852566485776
Energy: 0.9739345311532491
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Energy: 0.9611031871303534
Energy: 0.9427619646183901
Energy: 0.9737581693447962
Energy: 0.9377635431789794
Energy: 0.9248599315798185
Energy: 0.9254952748034481
Energy: 0.9431279760858391
Energy: 0.9962317556562725
Energy: 0.9399128627545649
Energy: 0.9789547252669195
Energy: 0.9257830658722863
Energy: 0.9391100122023388
Energy: 0.973304439854245
Energy: 0.9394069318676253
Energy: 0.9379998842770233
Energy: 0.9407935616454632
Energy: 0.9435383950731489
Energy: 0.9388609772220824
Energy: 0.9379875817816201
Energy: 0.9378996312629326
Energy: 0.940936334322308
Energy: 0.9431536974869018
Energy: 0.9382388779355929
Energy: 0.9391909374510098
Energy: 0.9259850540322971
Energy: 0.9431316212254346
Energy: 0.941665474947967
Energy: 0.9370210678657417
Energy: 0.9372062595769138
Energy: 0.9269676403589802
Energy: 0.9432692655603644
Energy: 0.9404862964913131
Energy: 0.9372083332510699
Energy: 0.9370594663393312

minimum gb energy = 0.9248599315798185 eV
minimum distance =  2.31967974675567 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

Energy: 1.600712757271888
Energy: 1.0898622770683106
Energy: 1.0945194983085336
Energy: 1.077324382432039
Energy: 1.121634069406121
Energy: 1.0558418866731694
Energy: 1.0927109673753208
Energy: 1.092959330489099
Energy: 1.087279655518155
Energy: 1.126277446755634
Energy: 1.1025584912718813
Energy: 1.0713914516979146
Energy: 1.072135381786048
Energy: 1.0729981874930508
Energy: 1.075526853262279
Energy: 1.1223350336988591
Energy: 1.070563643018398
Energy: 1.0768709418377602
Energy: 1.0748968296112014
Energy: 1.0760734953811635
Energy: 1.1034357760329327
Energy: 1.0749269407129123
Energy: 1.0706466256351768
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minimum gb energy = 1.0420183527364002 eV
minimum distance =  2.32592002199625 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 1.099337333001909
Energy: 1.1160063112373422
Energy: 1.1021002414099306
Energy: 1.1003550267775664
Energy: 1.0670104865974397
Energy: 1.1008584113749074
Energy: 1.1159059082931664
Energy: 1.0711940374021405
Energy: 1.105477533777735
Energy: 1.1617995478356722
Energy: 1.1206818902548008
Energy: 1.1161447518328937
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Energy: 1.1633363868156075
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Energy: 1.0749251350139504
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Energy: 1.1403562557633704
Energy: 1.1159021321492102
Energy: 1.1365641707917278
Energy: 1.096910686570657
Energy: 1.0681104461844955
Energy: 1.0674202248486022
Energy: 1.0854578984263126
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Energy: 1.1388026577997723
Energy: 1.110911705014722
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Energy: 1.0587995621729878
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Energy: 1.0690365965666706
Energy: 1.0692882834380393
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Energy: 1.0684979172121514
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Energy: 1.058668677448403
Energy: 1.12548253774448
Energy: 1.090010484518303
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Energy: 1.065771911158885
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Energy: 1.1163376657654411
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Energy: 1.0789426648435254
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Energy: 1.0805088717655387
Energy: 1.0660086190841105
Energy: 1.0667340467407418
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Energy: 1.069151620322521
Energy: 1.0715309486116196
Energy: 1.1363809001491498
Energy: 1.099695602974737
Energy: 1.05991874884045
Energy: 1.06916435906434
Energy: 1.07207701019614
Energy: 1.1361114712153288
Energy: 1.1004192373789579
Energy: 1.0590774908707854
Energy: 1.110609079546378
Energy: 1.0960815027710884
Energy: 1.1054253461083923
Energy: 1.1466416194611997
Energy: 1.0343389665028933
Energy: 1.0974805515808077
Energy: 1.0674150340268462
Energy: 1.1277394230467346
Energy: 1.1270165603673097
Energy: 1.0337949238083557
Energy: 1.1306185116541398
Energy: 1.0598917570097552
Energy: 1.0599922203486256
Energy: 1.100174919041382
Energy: 1.0386323743637667
Energy: 1.0757343313548804
Energy: 1.0590024768567468
Energy: 1.0600308925591608
Energy: 1.1002231358014263
Energy: 1.0395612316928575
Energy: 1.0666603843574793
Energy: 1.0655621946753382
Energy: 1.0581410107312035
Energy: 1.11646007644484
Energy: 1.0583395741513733
Energy: 1.0768743389382571
Energy: 1.0676285074491374
Energy: 1.0579667196681273
Energy: 1.1156382016829358
Energy: 1.1080013905465793
Energy: 1.0710326856988324
Energy: 1.1029037483783146
Energy: 1.0663331842649626
Energy: 1.0970147737303702
Energy: 1.1260720130522441
Energy: 1.069727050539345
Energy: 1.1023098037731405
Energy: 1.0666848215761506
Energy: 1.0899022842365866
Energy: 1.12538647196369
Energy: 1.0684786022123212
Energy: 1.0956266375188066
Energy: 1.1183717390027743
Energy: 1.0593315940603683
Energy: 1.1159965030582881
Energy: 1.094131520345121
Energy: 1.1010371819128886
Energy: 1.1171166537485022
Energy: 1.0686876422308105
Energy: 1.1155655588536775
Energy: 1.1169586914886798
Energy: 1.10322018137004
Energy: 1.17637083285938
Energy: 1.120160685047926
Energy: 1.1178200592944383
Energy: 1.0713790907487277
Energy: 1.10372131381623
Energy: 1.1662116416536834
Energy: 1.1199331403699222
Energy: 1.1165356996752367
Energy: 1.0319203952838392
Energy: 1.06633230957926
Energy: 1.1189861448921998
Energy: 1.0870618306087783
Energy: 1.11609418736479
Energy: 1.0321467936240434
Energy: 1.066403263211212
Energy: 1.1191761799746056
Energy: 1.0844069074156784
Energy: 1.1365017435468068

minimum gb energy = 1.0319203952838392 eV
minimum distance =  2.28226142878235 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 1.047831158469574
Energy: 1.0302144233497128
Energy: 1.1194718314358605
Energy: 1.045527884755822
Energy: 1.0305299737999607
Energy: 1.0490777829224136
Energy: 1.0447232980175971
Energy: 1.1197262493645854
Energy: 1.044369262171506
Energy: 1.0312357581934757
Energy: 1.0307383684725606
Energy: 1.0440143131079371
Energy: 1.0431663085921967
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Energy: 1.043326688215205
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Energy: 1.043959961518305
Energy: 1.0320015224171348
Energy: 1.043588904912729
Energy: 1.0429718445579736
Energy: 1.044068860502983
Energy: 1.043995310160548
Energy: 1.049374420834624
Energy: 1.0470019271379751
Energy: 1.1252035003695626
Energy: 1.0433846408428402
Energy: 1.0430820050075689
Energy: 1.0448252945724918
Energy: 1.0464925152583933
Energy: 1.1256000157053843
Energy: 1.121993594642643
Energy: 1.0307754075606226
Energy: 1.0328811574820214
Energy: 1.0434978790461165
Energy: 1.123960189357993
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Energy: 1.0311124094908033
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Energy: 1.0435913500085643
Energy: 1.0382412736187747
Energy: 1.0437356114390046
Energy: 1.0313117335840403
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Energy: 1.0326712067124524
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Energy: 1.043705375338866
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Energy: 1.0432093990490543
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Energy: 1.0441099263997702
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Energy: 1.0490741585653438
Energy: 1.0302129235646538
Energy: 1.1200503847554506
Energy: 1.0409686993232468
Energy: 1.0433080085861761
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Energy: 1.1206876490414814
Energy: 1.0419705712530938
Energy: 1.0433782182501081
Energy: 1.0437058507375476
Energy: 1.0449557892332808
Energy: 1.0437623181485853
Energy: 1.1268025094214733
Energy: 1.045950680965201
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Energy: 1.0304265657587306
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Energy: 1.0331601801931134
Energy: 1.0432846539750922
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Energy: 1.0432958353160344
Energy: 1.0436066738498146
Energy: 1.0433877799480147
Energy: 1.0308897605651859
Energy: 1.124758289544297
Energy: 1.0502405054011668
Energy: 1.0469275073343298
Energy: 1.1273305281847674
Energy: 1.1192962656295096
Energy: 1.0460265617762878
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Energy: 1.0435632360485074
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Energy: 1.0398154207219557
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Energy: 1.1274179437355965
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Energy: 1.045161859526302
Energy: 1.0303440436689233
Energy: 1.0492775156701033
Energy: 1.044644346645947
Energy: 1.0473177556060773
Energy: 1.0442960599853666
Energy: 1.0309814217433215
Energy: 1.1252260902208642
Energy: 1.0437968826165072
Energy: 1.0432000666470673
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Energy: 1.0322932633455582
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Energy: 1.0487805167973314
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Energy: 1.0454390608892559
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Energy: 1.1222867870365039
Energy: 1.0311455637906968
Energy: 1.0331148140713926
Energy: 1.0434604765148303
Energy: 1.124004983545547
Energy: 1.1209701992763814
Energy: 1.0310757431141464
Energy: 1.031784939027753
Energy: 1.043564610605886
Energy: 1.126249956009352
Energy: 1.0437355188895117
Energy: 1.031176009839406
Energy: 1.0313975427888724
Energy: 1.0465895973118415
Energy: 1.044109502106632
Energy: 1.0432360297002208
Energy: 1.0320647024139022
Energy: 1.0313465411153258
Energy: 1.0453033004519747
Energy: 1.043683209347748
Energy: 1.04359670232532
Energy: 1.1208125036259151
Energy: 1.0431081367865305
Energy: 1.0442497107317923
Energy: 1.0311901927313105
Energy: 1.0439314378461848
Energy: 1.1199151655495374
Energy: 1.0438238434923885
Energy: 1.0472492504590103
Energy: 1.0303864589464808
Energy: 1.1197536680547922
Energy: 1.0406143629662528
Energy: 1.0432104199708307
Energy: 1.0438143434098093
Energy: 1.045709688152888
Energy: 1.1209759832160675
Energy: 1.0415814615750791
Energy: 1.0433511264191784
Energy: 1.043882789507815
Energy: 1.0453120235528999
Energy: 1.0436083418580433
Energy: 1.127092518244922
Energy: 1.1234322565693933
Energy: 1.0316131907467805
Energy: 1.0311056554903912
Energy: 1.0443994499827056
Energy: 1.1280542881377973
Energy: 1.0468580326952437
Energy: 1.0486821714984578
Energy: 1.030947626588999
Energy: 1.043721611369824
Energy: 1.03278944110326
Energy: 1.0432810637878214
Energy: 1.032478453926359
Energy: 1.125822417937485
Energy: 1.043395287549814
Energy: 1.0436912774416327
Energy: 1.0435783658468853
Energy: 1.0308808953972717
Energy: 1.0448854025962093
Energy: 1.0474577665852638
Energy: 1.046153452285738
Energy: 1.128103000505252
Energy: 1.1201120805797151
Energy: 1.0451864042677914
Energy: 1.048218585139216
Energy: 1.0474226908175552
Energy: 1.1401129428994359
Energy: 1.0445216643797832
Energy: 1.0451896737827087
Energy: 1.0309432783146149
Energy: 1.043518521540927
Energy: 1.0519233523465592
Energy: 1.121528639157583
Energy: 1.1257560037608856
Energy: 1.0306732596204726
Energy: 1.0435014289051932
Energy: 1.0397560561050934
Energy: 1.121246461452785
Energy: 1.1269285613023576

minimum gb energy = 1.0302129235646538 eV
minimum distance =  2.27284004257047 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.0177523657402905
Energy: 1.125506961284217
Energy: 1.1240459785127552
Energy: 1.0654747912945781
Energy: 1.1255502058452533
Energy: 1.0180910265834155
Energy: 1.1384199396582442
Energy: 1.155459202026143
Energy: 1.1104833164390453
Energy: 1.1259877000635823
Energy: 1.0084922822275952
Energy: 1.069046507120196
Energy: 1.0848033523733285
Energy: 1.0801156491409252
Energy: 1.139751150282592
Energy: 1.0116929710612697
Energy: 1.0719998572389304
Energy: 1.0796818325662247
Energy: 1.0760901566168946
Energy: 1.1182206913889627
Energy: 1.1337851027964154
Energy: 1.052172592880923
Energy: 1.1010356079999555
Energy: 1.0904757852268439
Energy: 1.1951125760834862
Energy: 1.1396179855010398
Energy: 1.0660140551309258
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Energy: 1.0258812791663998
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Energy: 1.0646823550168245
Energy: 1.1378120309978534
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Energy: 1.0496517534838627
Energy: 1.073103057905261
Energy: 1.062703542856024
Energy: 1.1261229578972702
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Energy: 1.111506054442356
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Energy: 1.048100324690545
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Energy: 1.065882614674928
Energy: 1.0473827337614432
Energy: 1.2163664986763871
Energy: 1.0601224193017302
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Energy: 1.0238199165897162
Energy: 1.104387588086437
Energy: 1.2155482952226484
Energy: 1.058758527334335
Energy: 1.0369550426882357
Energy: 1.0199743513594706
Energy: 1.1056467309114495
Energy: 1.1554643643207014
Energy: 1.1146914333522226
Energy: 1.020796274128089
Energy: 1.084051300296798
Energy: 1.1084877362578442
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Energy: 1.0199536735591557
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Energy: 1.0609644144097712
Energy: 1.0584721181474237
Energy: 1.086356531689239
Energy: 1.0796022713965516
Energy: 1.0748056158281858
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Energy: 1.0648979099406233
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Energy: 1.1182297078414367
Energy: 1.1281816138194414
Energy: 1.0737175174628202
Energy: 1.0200150958789693
Energy: 1.0186231529176082
Energy: 1.1574100048218714
Energy: 1.1557198793352925
Energy: 1.0742853339894618
Energy: 1.1765301653787037
Energy: 1.1525914652077855
Energy: 1.010953741412065
Energy: 1.1458486046555802
Energy: 1.0636610930413057
Energy: 1.1782500860523608
Energy: 1.1570606181771745
Energy: 1.018495917591661
Energy: 1.144460130930458
Energy: 1.0523395064817356
Energy: 1.0070923894601684
Energy: 1.1175908407017825
Energy: 1.2031081949151907
Energy: 1.177842633783694
Energy: 1.0860063729021405
Energy: 1.0075793311480918
Energy: 1.1285079192364529
Energy: 1.1901137136984954
Energy: 1.1734514843987265
Energy: 1.088772958086821
Energy: 1.160111831654379
Energy: 1.1613065029558127
Energy: 1.199302655066368
Energy: 1.0823188727378221
Energy: 1.0288197116512452
Energy: 1.1579447413228845
Energy: 1.1747737742120512
Energy: 1.1794072789849166
Energy: 1.0814412982711137
Energy: 1.0235297588162517
Energy: 1.0231088318894703
Energy: 1.0467816179031355
Energy: 1.0296117121868025
Energy: 1.021179831779654
Energy: 1.028698579882941
Energy: 1.0228016378510754
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Energy: 1.0258306318401584
Energy: 1.0240982812043218
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Energy: 1.097244164851465
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Energy: 1.016518717140901
Energy: 1.0269254228780569
Energy: 1.191398576491638
Energy: 1.1344335128958527
Energy: 1.0432364107046685
Energy: 1.0768465138773484
Energy: 1.1174732781863654
Energy: 1.1916153808319438
Energy: 1.0347344234660851
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Energy: 1.0420802392045172
Energy: 1.0561212961495576
Energy: 1.0397625520122769
Energy: 1.0989860541789507
Energy: 1.0427938143241542
Energy: 1.0125931385421885
Energy: 1.0727722185106119
Energy: 1.179565567950928
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Energy: 1.0258977795319546
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Energy: 1.1341574289113943
Energy: 1.068291371887906
Energy: 1.0267893802491785
Energy: 1.1079498168486783
Energy: 1.0847338256397545
Energy: 1.0793075884730088
Energy: 1.1005989290988865
Energy: 1.144426814885748
Energy: 1.1075177338872508
Energy: 1.0827672022307353
Energy: 1.095117975472072
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Energy: 1.08167742188208
Energy: 1.1190678457290506
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Energy: 1.0789231088269735
Energy: 1.0894965755415038
Energy: 1.13439740548633
Energy: 1.194123127954362
Energy: 1.1250297609643114
Energy: 1.1271078079280492
Energy: 1.1171679491590694
Energy: 1.1448016547489126
Energy: 1.1832170121266374
Energy: 1.1236039059307301
Energy: 1.1259876016261805
Energy: 1.0636119483160469
Energy: 1.152004193168897
Energy: 1.1831166362957026
Energy: 1.1736556257917599
Energy: 1.1247479303225718
Energy: 1.093336114107198
Energy: 1.0217257845109053
Energy: 1.1902815982314519
Energy: 1.1797975735243078
Energy: 1.0939006667647906
Energy: 1.0899143420634738
Energy: 1.0216956576100045
Energy: 1.190366390868552
Energy: 1.1742042980634044
Energy: 1.0215687082296692
Energy: 1.0214454672100806
Energy: 1.179448700756556
Energy: 1.2048424047624573
Energy: 1.177290679968843
Energy: 1.022851155756913
Energy: 1.0222031474843438
Energy: 1.178344988742224
Energy: 1.2188369146392204
Energy: 1.0226914818330497
Energy: 1.020396658189898
Energy: 1.0214868171511646
Energy: 1.1086606763078544
Energy: 1.190612467278241
Energy: 1.0219275410599262
Energy: 1.0240882395943598
Energy: 1.0212054755882929
Energy: 1.1808459980092312
Energy: 1.1884483160856953
Energy: 1.0245702833525452
Energy: 1.0231280753165846
Energy: 1.0257189762611632
Energy: 1.0164657931547363
Energy: 1.1357882376886645
Energy: 1.0239401721603953
Energy: 1.0227320868194856
Energy: 1.0269849893775789
Energy: 1.0674545585264095
Energy: 1.1405794444612398
Energy: 1.1071237847122084
Energy: 1.2217084903989528
Energy: 1.1347884371501078
Energy: 1.103806954988738
Energy: 1.1323513667290892
Energy: 1.0840228893369461
Energy: 1.0408485526071418
Energy: 1.1426671273359479
Energy: 1.1957492587655578
Energy: 1.0681059233764914
Energy: 1.128113342308737
Energy: 1.180202414259695
Energy: 1.056697310378996
Energy: 1.0724440442282281
Energy: 1.0420909908321814
Energy: 1.1293427783469867
Energy: 1.2304352685410758
Energy: 1.0128237329359482
Energy: 1.035172945648935
Energy: 1.0395580448496724
Energy: 1.1237260716332083
Energy: 1.1351863056954898
Energy: 1.0449462661370106
Energy: 1.0529223298895667
Energy: 1.0410477708323185
Energy: 1.1070721341200096
Energy: 1.0624717337061391
Energy: 1.0461741525200816
Energy: 1.0512552849519248
Energy: 1.0362747506655283
Energy: 1.2146683537371785
Energy: 1.1130779981083456
Energy: 1.0488839394293903
Energy: 1.019182145393318
Energy: 1.064576693460617
Energy: 1.210789624727879
Energy: 1.1044463569733882
Energy: 1.038628931848986
Energy: 1.0319093280575575
Energy: 1.0581168338724687
Energy: 1.1060204261519504
Energy: 1.00596149774761
Energy: 1.0404797271529407
Energy: 1.0738761174553328
Energy: 1.128509802159227
Energy: 1.1116857648631397
Energy: 1.0198850783348752
Energy: 1.0397054564021027
Energy: 1.1232104679936505
Energy: 1.1480637773567437
Energy: 1.1024687212230015
Energy: 1.0745383585233024
Energy: 1.0974678394514905
Energy: 1.0418173182633645
Energy: 1.057352943338697
Energy: 1.091158149210582
Energy: 1.0718710138735466
Energy: 1.0326269314271062
Energy: 1.0455015083997299
Energy: 1.0558597897501198
Energy: 1.0455341648245837
Energy: 1.0939721783774186
Energy: 1.195161942414651
Energy: 1.1612810042718784
Energy: 1.0744904535594189
Energy: 1.0599616324518066
Energy: 1.1698865920495813
Energy: 1.1824695470450861
Energy: 1.070936001915785
Energy: 1.065748186529319
Energy: 1.182551121321704
Energy: 1.1655389622304795
Energy: 1.1958244821441655
Energy: 1.149924660897793
Energy: 1.0618967478188241
Energy: 1.1655776813951806
Energy: 1.1608278818399047
Energy: 1.1779129011911011
Energy: 1.1452793561193457
Energy: 1.0633855239661947
Energy: 1.0083817133220636
Energy: 1.176522175809223
Energy: 1.1087240950598727
Energy: 1.1787688766708508
Energy: 1.086883287071211
Energy: 1.0614143478118785
Energy: 1.1819121360764535
Energy: 1.1161515530636632
Energy: 1.192645358444225
Energy: 1.6017233069223127
Energy: 1.1571808416137754
Energy: 1.1745023605776437
Energy: 1.1916952682680486
Energy: 1.1501473057332317
Energy: 1.028432559046321
Energy: 1.1777648362104036
Energy: 1.1765288776103118
Energy: 1.1754926075214285
Energy: 1.1642757467777518
Energy: 1.0231239905818466
Energy: 1.0219553854661674
Energy: 1.1474858962061758
Energy: 1.028746564995915
Energy: 1.0201787671430684
Energy: 1.0302550439168021
Energy: 1.0225604285373482
Energy: 1.1675359032246548
Energy: 1.0241485344008994
Energy: 1.0192063089381982
Energy: 1.029596388189491
Energy: 1.0228833733192697
Energy: 1.0809493956665577
Energy: 1.143692566962622
Energy: 1.019879328840588
Energy: 1.0215995010667054
Energy: 1.0221831131278676
Energy: 1.096995893715726
Energy: 1.0999439714387533
Energy: 1.0204847719579453
Energy: 1.0225686025719762
Energy: 1.1326399763561878
Energy: 1.0703413351526574
Energy: 1.0345271074427507
Energy: 1.0989686728418484
Energy: 1.1299568497140786
Energy: 1.1267371269647053
Energy: 1.0166722554916343
Energy: 1.0314919842938766
Energy: 1.1262976823253292
Energy: 1.134736935791696
Energy: 1.0259274551843909
Energy: 1.0412260970664475
Energy: 1.1134426388355927
Energy: 1.1892442314195242
Energy: 1.0226568021887115
Energy: 1.0361696178056419
Energy: 1.0372347428080446
Energy: 1.118136153922975
Energy: 1.1944410932949006
Energy: 1.0228530136047476
Energy: 1.0299157711704026
Energy: 1.0229594555685277
Energy: 1.0284638411251437
Energy: 1.0744533353032804
Energy: 1.0359723084081316
Energy: 1.0333778489805712
Energy: 1.0439744593304843
Energy: 1.0369550018940543
Energy: 1.0894781470369772
Energy: 1.0309872392086101
Energy: 1.0265745608700367
Energy: 1.095848509948152
Energy: 1.1801052427077057
Energy: 1.1848318772941797
Energy: 1.121338489506794
Energy: 1.0352139716408586
Energy: 1.0575381229241927
Energy: 1.1796737415263205
Energy: 1.0838979732582157
Energy: 1.1133823423301743
Energy: 1.0912293444587242
Energy: 1.117111043585417
Energy: 1.1586811836695023
Energy: 1.0805782090821796
Energy: 0.9990831200074062
Energy: 1.0293526100820243
Energy: 1.1403403335899933
Energy: 1.1299758424534938
Energy: 1.097223059901078
Energy: 1.0042620838056235

minimum gb energy = 0.9990831200074062 eV
minimum distance =  2.17015608593195 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.3634776310439944
Energy: 1.029127366978575
Energy: 1.1039327919580957
Energy: 1.1144813555459039
Energy: 0.9430271713802856
Energy: 1.3628198578562438
Energy: 0.9381160415698089
Energy: 1.1035703598384257
Energy: 1.1166701783815867
Energy: 1.0970173452824916
Energy: 0.9234320085391146
Energy: 1.1420497323845062
Energy: 1.1213416695998328
Energy: 1.1015074924030546
Energy: 1.1412768011357852
Energy: 0.9280617771584734
Energy: 1.141228884646005
Energy: 1.1050596080955788
Energy: 1.143509444142758
Energy: 1.0410762527236421
Energy: 1.0214261204093258
Energy: 1.0268614489676402
Energy: 1.079635453513048
Energy: 0.9748694768009468
Energy: 1.056174754813951
Energy: 1.023497396138716
Energy: 1.0282978860283811
Energy: 1.163968539202259
Energy: 0.9740015090454779
Energy: 1.0566141556418596
Energy: 0.9692295933879698
Energy: 0.9773210347101181
Energy: 1.049306869584234
Energy: 1.0691281190016098
Energy: 1.0426986736489086
Energy: 0.9752899963385444
Energy: 0.9741556833764026
Energy: 1.0499995879278616
Energy: 1.0174762362377188
Energy: 1.0518199895545361
Energy: 1.0909641843674072
Energy: 1.0562118469526605
Energy: 0.9663510330755556
Energy: 0.9674529843430975
Energy: 1.0050344972868273
Energy: 1.0907796431590548
Energy: 1.050274581235454
Energy: 0.9672403176855179
Energy: 0.9667728669205834
Energy: 1.0056886062945662
Energy: 1.0519343520473343
Energy: 0.9695734534331126
Energy: 0.930494308809576
Energy: 1.091985899973585
Energy: 1.0024372630377452
Energy: 0.9988830718720737
Energy: 0.9692696721598504
Energy: 0.9312901532547881
Energy: 1.0933600272506485
Energy: 1.3676641011951407
Energy: 1.0144549250856063
Energy: 1.018175911995326
Energy: 1.0154672476607847
Energy: 1.0249998525640167
Energy: 1.05271303036558
Energy: 1.0128903513010448
Energy: 1.0177193778156772
Energy: 1.0175606008531857
Energy: 0.9773379440349731
Energy: 1.0534478320843248
Energy: 1.0221006806590966
Energy: 1.0187743053008138
Energy: 0.9675618296116233
Energy: 1.2491826810418512
Energy: 1.146024120129374
Energy: 1.0266689290412594
Energy: 1.0151236405420483
Energy: 0.9693729181199902
Energy: 1.2516025426999324
Energy: 1.1444674753821937
Energy: 0.9756634599453475
Energy: 1.0667996802701172
Energy: 1.1389898478457468
Energy: 1.1688798041343775
Energy: 0.9743281829419665
Energy: 0.9732262079506169
Energy: 1.0515433420411777
Energy: 1.1390120403662385
Energy: 1.1764710034579193
Energy: 0.9715899527602561
Energy: 1.014586491932183
Energy: 0.9639430881042013
Energy: 0.9318020725566338
Energy: 1.0887250923633809
Energy: 1.0500080027236485
Energy: 1.091953683812105
Energy: 0.9643359849737592
Energy: 0.968373250415884
Energy: 1.0880154112596323
Energy: 1.1414873638549807
Energy: 0.9341680701821677
Energy: 0.9281692078719235
Energy: 1.137363964311919
Energy: 1.0013330437497239
Energy: 0.9424653866953816
Energy: 0.9280090273463707
Energy: 0.9279798671684851
Energy: 1.136830555573102
Energy: 1.0018494372525282
Energy: 0.9735965377024938
Energy: 0.9341349868745814
Energy: 0.9349716980766017
Energy: 0.9347565851369039
Energy: 1.104022321250518
Energy: 0.9340695712858633
Energy: 0.9344406774796182
Energy: 0.9285568142511406
Energy: 0.9356964552354474
Energy: 1.0512702932666107
Energy: 0.9345913224724726
Energy: 0.9332837112165685
Energy: 0.9673048236930742
Energy: 1.1531459949562455
Energy: 1.0508183570762377
Energy: 1.1352968426762844
Energy: 0.9299618887564006
Energy: 0.9673901364926449
Energy: 1.0552714454310932
Energy: 1.1425336450142363
Energy: 1.0148926902542852
Energy: 1.2186155036176574
Energy: 1.0141743199515219
Energy: 1.1055867042344365
Energy: 0.9352838276412092
Energy: 0.9418764801237904
Energy: 1.1169287775844292
Energy: 1.0149117865852637
Energy: 1.190334638183656
Energy: 0.9339218165077356
Energy: 0.9967930618415747

minimum gb energy = 0.9234320085391146 eV
minimum distance =  2.31689619759238 Angstroms
sigma value = 33