Model name: model_name=MEAM_LAMMPS_KimSeolJi_2017_PtCu__MO_070797404269_002
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=3.917371600866318
cohesive_energy=5.770453839330309
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=[3.11370211404828e-19, 4.1219358480581393e-19, 4.877778696913979e-19, 5.491364282436959e-19, 6.0086750740228795e-19, 6.454272439470959e-19, 6.84310468677642e-19, 7.185185419901759e-19, 7.48759625956926e-19, 7.755592345138439e-19, 7.993211161726979e-19, 8.20365706260288e-19, 8.389509552146879e-19, 8.5528995252822e-19, 8.69562141983892e-19, 8.819165260086658e-19, 8.9248448308653e-19, 9.01381369935132e-19, 9.08703317152512e-19, 9.145384444535399e-19, 9.18965258493282e-19, 9.22052652867e-19, 9.2386311246342e-19, 9.24455917818e-19, 9.23816649341034e-19, 9.21738626246736e-19, 9.17955887213862e-19, 9.121447925623439e-19, 9.0391601337012e-19, 8.9280491841333e-19, 8.7824113281027e-19, 8.595325162550519e-19, 8.358283129550219e-19, 8.060774950382759e-19, 7.68971084194836e-19, 7.228716559047539e-19, 6.657108001335359e-19, 5.94843323258448e-19, 5.06871008638776e-19, 3.97360633528242e-19, 2.60475468449184e-19, 8.840153773992059e-20, -1.2944786114403e-19, -4.07710694583882e-19, -7.66979578638774e-19, -1.236923620217118e-18, -1.86137676984852e-18, -2.7071017278717598e-18, -3.8795265233339396e-18, -5.552391190426019e-18, -8.027609894058959e-18, -1.1865816282002038e-17, -1.82013674328936e-17, -2.9612389855568397e-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: 0.021443149519953263
Energy: 0.7524680364633168
Energy: 0.1553827453438577
Energy: 0.15486984609047533
Energy: 0.026730118017634766
Energy: 0.023165099209836726
Energy: 0.15210699206284378
Energy: 1.2805076992287188
Energy: 1.0471559909443529
Energy: 0.025803152933326155
Energy: 0.021850636384689644
Energy: 0.1568867257445317
Energy: 0.15258339873629576
Energy: 1.0055130044817284
Energy: 0.15184297760887508
Energy: 0.1517020833147719
Energy: 0.15708322034881383
Energy: 0.1522235169532949
Energy: 1.0025745545956335
Energy: 0.15336033072773003
Energy: 0.15300019303946433
Energy: 0.02727664932690615
Energy: 0.021935437746596544
Energy: 0.1511255965352795
Energy: 1.005613739015703
Energy: 0.1545209454342357
Energy: 0.025968375787131796
Energy: 0.022026157564859452
Energy: 1.0542685916055483
Energy: 0.1535759456434159
Energy: 1.0155763992094686
Energy: 0.023262802318532526
Energy: 0.023375525684691572
Energy: 0.15050351387369035
Energy: 1.036701541700387
Energy: 1.025231978655817
Energy: 0.023423321963492564
Energy: 0.02236580707834376
Energy: 0.15133260029090487
Energy: 1.0260194001720797
Energy: 1.019394941611473
Energy: 1.0430703577599634
Energy: 0.15520878680715644
Energy: 0.02385992705749261
Energy: 0.022638095142181017
Energy: 1.010471156157874
Energy: 0.1549571695182215
Energy: 0.155076036156782
Energy: 0.02489395327552313
Energy: 0.15110354851738023
Energy: 0.15327146375634162
Energy: 1.0011308585291645
Energy: 0.15309457547191255
Energy: 0.02299079599147184
Energy: 0.021768767132914806
Energy: 0.15051395255358851
Energy: 0.9998584364311901
Energy: 0.1537293220696511
Energy: 0.02387172681380119
Energy: 0.021810760481352092
Energy: 0.02185273628512902
Energy: 0.15148294489811798
Energy: 1.006455335242237
Energy: 0.1540200254305319
Energy: 0.15583936725981345
Energy: 0.021821911351509102
Energy: 1.0470402095905416
Energy: 1.0130624967674997
Energy: 0.1551406315027398
Energy: 0.1560234901073988

minimum gb energy = 0.021443149519953263 eV
minimum distance =  2.7320325375326 Angstroms
sigma value = 3


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

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Energy: 1.729896061167705
Energy: 1.4669017457117643
Energy: 1.467810341394795
Energy: 1.7355557862174857
Energy: 1.7757396676940271
Energy: 1.7522134676722274
Energy: 1.462514396421324
Energy: 1.4766944166715767
Energy: 1.811003039002359
Energy: 1.9694261757755542
Energy: 2.1998737284472023
Energy: 1.6285238496873162
Energy: 1.8741345358691623
Energy: 1.6873139024281312
Energy: 2.3041449735985085
Energy: 2.136905168593244
Energy: 1.7146327152372782
Energy: 1.8822325199811765
Energy: 1.7222050261317696
Energy: 1.6141994994803854
Energy: 2.216315826050525
Energy: 2.2358634385431717
Energy: 1.6239742629449374
Energy: 1.448830385508196
Energy: 1.5725016411105495
Energy: 2.203620751329174
Energy: 2.2204190309791096
Energy: 1.6216952527677597
Energy: 1.466204913085434
Energy: 1.651489888150963
Energy: 2.125150876700822
Energy: 2.16736502030846
Energy: 1.6505348941686646
Energy: 1.4979797405457853
Energy: 1.648642510312571
Energy: 2.1503545264629818
Energy: 2.1510795993442398
Energy: 1.6198879770798247
Energy: 1.4990040250744405
Energy: 2.015110570097777
Energy: 1.995604818006899
Energy: 2.009855394341753
Energy: 1.90896477547103
Energy: 1.8097784098857284
Energy: 2.021548327027716
Energy: 2.011930552924472
Energy: 1.986750562925156
Energy: 1.8977622484687808
Energy: 1.8686915749431245
Energy: 1.9185671771572939
Energy: 1.8297239977649706
Energy: 1.8345070044651335
Energy: 1.9274052369091097
Energy: 2.013099138615713
Energy: 1.8284822981015978
Energy: 1.833645965415798
Energy: 1.8401068007362302
Energy: 1.9276190061880454
Energy: 1.983570761898738
Energy: 1.9196106730564435
Energy: 2.0374916749291465
Energy: 2.294986176271939
Energy: 1.824378870138078
Energy: 1.9664697760222662
Energy: 1.9118431254554298
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Energy: 2.2923232288588316
Energy: 1.835864799192805
Energy: 1.9211295307762088
Energy: 1.4561223421667924
Energy: 1.7473955779424912
Energy: 2.4312954090000476
Energy: 1.9680367988983092
Energy: 1.6155668712274702
Energy: 1.4572466515264864
Energy: 1.7712864085511866
Energy: 1.7878165949436418
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Energy: 1.714728599996613
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Energy: 1.8442634133079547
Energy: 2.2021818435107696
Energy: 1.8034141058888729
Energy: 1.7260136861023998
Energy: 1.8899243229035245
Energy: 1.82914470844473
Energy: 2.1480350224408227
Energy: 1.7964392744348026
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Energy: 1.5773788355174443
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Energy: 1.9318507779792076
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Energy: 1.9581187935460402
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Energy: 1.9816722248256808
Energy: 2.105751700233475
Energy: 1.926667746963024
Energy: 1.7234891636460878
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Energy: 1.9000412561776163
Energy: 1.9536144038494756
Energy: 1.9159158148131885
Energy: 1.6679228534855415
Energy: 2.1171828767754666
Energy: 1.778121329525952
Energy: 1.715398908145953
Energy: 1.4751225297148556
Energy: 1.482185471275854
Energy: 1.8342199883778432
Energy: 1.7798878998492822
Energy: 1.7153844103751916
Energy: 1.4771524109831036
Energy: 1.4796341182492472
Energy: 1.809204683044883
Energy: 2.3124324479431912
Energy: 2.153569335404463
Energy: 1.634610136384413
Energy: 1.803599288033048
Energy: 1.6797278555602855
Energy: 2.304791027539221
Energy: 2.111619569530131
Energy: 1.6388879442322877
Energy: 1.8217065199430365
Energy: 1.6772825586717541
Energy: 1.5121878236390813
Energy: 2.2017124257682856
Energy: 2.287329005360857
Energy: 1.6117562419972964
Energy: 1.4848091974910984
Energy: 1.496665334963436
Energy: 2.19948414055969
Energy: 2.286317761627734
Energy: 1.6101014436313914
Energy: 1.468214699126132
Energy: 1.5962498832153433
Energy: 2.0452619823075766
Energy: 2.1990047479991897
Energy: 1.668511382282674
Energy: 1.39127175282142
Energy: 1.599402447223742
Energy: 2.0582871780974696
Energy: 2.171345412877396
Energy: 1.5913761043075991
Energy: 1.392676159137169
Energy: 2.0150891971024394
Energy: 2.0636846804653666
Energy: 1.9876456626540393
Energy: 1.9809318624338432
Energy: 1.8042429144121157
Energy: 2.0182170885556876
Energy: 2.0426945266201804
Energy: 2.0473798642856944
Energy: 2.021806585739241
Energy: 1.8112739322253377
Energy: 1.8990901288466873
Energy: 1.8275530189921292
Energy: 1.8458762458895974
Energy: 1.9326550478795954
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Energy: 1.8316033054150938
Energy: 1.8366445550790378
Energy: 1.487529959863868
Energy: 1.979569707663854
Energy: 1.9313624910241727
Energy: 2.042321870538113
Energy: 2.2892776911800348
Energy: 1.8222919198583003
Energy: 1.965019283947334
Energy: 1.9325812000119627
Energy: 2.0268617533679367
Energy: 2.2865161728067216
Energy: 1.8470855638557688
Energy: 1.9234263594236365
Energy: 1.458294676954652
Energy: 1.7510295783533132
Energy: 2.439739212611142
Energy: 1.7961447706589773
Energy: 1.6188877829353092
Energy: 1.4553353800104039
Energy: 1.7568445966228443
Energy: 2.4369612625276136
Energy: 1.7288301176633112
Energy: 1.616799455193445
Energy: 1.705798509844899
Energy: 1.8652305150900974
Energy: 1.8849303895996365
Energy: 2.154174438632751
Energy: 1.847217900416011
Energy: 1.7163946607818903
Energy: 1.8761661093276132
Energy: 1.832218773471214
Energy: 2.152653400715434
Energy: 1.8116919681834067
Energy: 1.85726224965386
Energy: 1.6147378092429603
Energy: 1.4052277956240513
Energy: 1.578976619933056
Energy: 2.232830202524222
Energy: 1.8774855105631432
Energy: 1.6135899286099231
Energy: 1.5869276905023944
Energy: 1.9137322220454527
Energy: 2.2721927439728633
Energy: 2.175066964722728
Energy: 1.4137553298658923
Energy: 1.5097180104518186
Energy: 1.905240729621491
Energy: 2.253899257850763
Energy: 1.859895556128491
Energy: 1.3927743096931333
Energy: 1.5929959697296237
Energy: 1.9188752183264595
Energy: 2.276820031678537
Energy: 2.060684141272601
Energy: 2.034063201071573
Energy: 1.9704004957023789
Energy: 2.02964565356356
Energy: 2.1058063144677264
Energy: 2.090941170419685
Energy: 1.8474668197492803
Energy: 1.952027758002363
Energy: 2.08200646942258
Energy: 2.1221131684524535
Energy: 1.8409261296558117
Energy: 1.4828056544135686
Energy: 1.987681110507425
Energy: 1.8311982638201567
Energy: 1.8300316959104312
Energy: 1.8044549219124981
Energy: 1.89780779722048
Energy: 1.989131919586005
Energy: 1.8268571712623387
Energy: 2.0529636842664223
Energy: 1.9322980291208605
Energy: 2.0426499817345913
Energy: 1.9244720324482318
Energy: 1.6287256548831353
Energy: 2.0499056050693114
Energy: 1.8811621836571668
Energy: 1.976814534385374
Energy: 1.9032039475495481
Energy: 1.7444042481648565
Energy: 2.1149582444239643
Energy: 1.8293481680358503
Energy: 1.6837857110172711
Energy: 1.4552480363273252
Energy: 1.4654374459323227
Energy: 1.8240690271936084
Energy: 1.7806764198566294
Energy: 1.7325847291448533
Energy: 1.44778242163322
Energy: 1.4664693688934434
Energy: 1.8274288177416471

minimum gb energy = 1.39127175282142 eV
minimum distance =  2.40826212400534 Angstroms
sigma value = 75


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

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Energy: 1.9011501928946186
Energy: 1.8210568387374908
Energy: 1.8012088418393053
Energy: 2.016661593172048
Energy: 1.9912010540791616
Energy: 1.9233107102184275
Energy: 1.7704510691186695
Energy: 1.852946011680807
Energy: 2.1877540474471595
Energy: 2.0763712365516254
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Energy: 1.8435476810932534
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Energy: 1.6329013627959725
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Energy: 1.8280784025124786
Energy: 1.772785980406374
Energy: 1.7734822670804984
Energy: 1.6923046376427762
Energy: 1.6742324769855383
Energy: 1.7575387754314962
Energy: 1.4969997242204751
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Energy: 2.010995818160965
Energy: 1.9248129265671297
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Energy: 2.019641299816076
Energy: 1.466217354143245
Energy: 1.9840292020941603
Energy: 2.0132619009639234
Energy: 2.022500707798762
Energy: 1.9984923379936492
Energy: 1.470817792246543
Energy: 2.1220640777531985
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Energy: 1.8706265756467424
Energy: 1.83467470467382
Energy: 1.8881316927273795
Energy: 2.004528839499974
Energy: 2.0043434063385126
Energy: 1.9770322846392412
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Energy: 1.905226035187715
Energy: 1.9179358983748105
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Energy: 1.9027250751584195
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Energy: 1.6907510075762044
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Energy: 1.9935383055429579
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Energy: 1.980200816075252
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Energy: 2.0027859951164295
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Energy: 2.0825597466721524
Energy: 2.004588337072765
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Energy: 1.843042566663954
Energy: 1.587688437622362
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Energy: 2.001736000932154
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Energy: 2.0079919843921017
Energy: 2.3882469503392625
Energy: 1.8311254032658788
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Energy: 1.4882756950593259
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Energy: 1.6754151353459892
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Energy: 1.906420349505857
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Energy: 1.9702616758345195
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Energy: 1.952164745424879
Energy: 1.7477568767639629
Energy: 1.9992293789519826
Energy: 2.1189180636466936
Energy: 1.9699922878156957
Energy: 1.862972728275888
Energy: 1.7642317551494902
Energy: 2.014904311901642
Energy: 2.09991905566907
Energy: 1.9779468580010962
Energy: 1.8197322932294309
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Energy: 1.9814758822364935
Energy: 1.9484840567533936
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Energy: 1.9132058700572998
Energy: 1.8125724619132342
Energy: 1.7003382939901155
Energy: 2.020546515538563
Energy: 2.0970991713607496
Energy: 1.9224684828088563
Energy: 1.8395939094519713
Energy: 1.730608684376779
Energy: 1.6482837255708571
Energy: 2.0694419785091345
Energy: 1.673322258098826
Energy: 1.834841537528512
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Energy: 1.6413503287402686
Energy: 2.0057019374109335
Energy: 1.6797674244021
Energy: 2.013403373299714
Energy: 1.465259116208664
Energy: 1.472540871796441
Energy: 1.7184862961266023
Energy: 1.6843747603810184
Energy: 2.016490557624449
Energy: 1.4679639226015644
Energy: 1.5334023265873666
Energy: 1.7263724552239508
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Energy: 1.889690049265091
Energy: 1.8675941513649876
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Energy: 1.950937419928092
Energy: 1.870854284164349
Energy: 1.886779724678754
Energy: 1.977235481713583
Energy: 2.139281180850112
Energy: 1.7737619430654212
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minimum gb energy = 1.4635568694141492 eV
minimum distance =  2.46417909032907 Angstroms
sigma value = 105


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

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Energy: 1.706992141867084
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Energy: 1.5362806759818828
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Energy: 1.9751595105012307
Energy: 2.221741477172398
Energy: 1.7448884776027305
Energy: 1.7741316098989597
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Energy: 1.818790761676752
Energy: 1.8545523282523597
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Energy: 1.9883495500753958
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Energy: 1.6560905753962551
Energy: 1.5693860598094012
Energy: 1.5281275224826099
Energy: 1.989852348081506
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Energy: 2.0762368346059583
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Energy: 1.6053455475363916
Energy: 1.648842087486599
Energy: 2.239609994495116
Energy: 1.976631697663804
Energy: 1.6091844056826934
Energy: 1.6282458280299195
Energy: 1.6574330031040216
Energy: 2.235255903863606
Energy: 1.9367817232725644
Energy: 2.0459832913637297
Energy: 1.6041201757532924
Energy: 1.7960853178621647
Energy: 1.8476728339528712
Energy: 1.915070052398442
Energy: 2.0876861347497075
Energy: 1.6439023512613142
Energy: 1.787760731604325
Energy: 1.8937414260563066
Energy: 2.008649043345969
Energy: 1.9871471346393352
Energy: 2.12219720660162
Energy: 1.5955197447806702
Energy: 1.7535092074770224
Energy: 1.9966059144995196
Energy: 1.9874173526035828
Energy: 2.08422818615572
Energy: 1.5952380250630669
Energy: 1.8037379008534624
Energy: 1.9196001504170106
Energy: 1.7117471146681105
Energy: 1.6325283062331597
Energy: 1.9267750464321074
Energy: 1.7707071781065176
Energy: 1.9714461050821503
Energy: 1.8161509578435577
Energy: 1.6304739469266574
Energy: 1.8986520384866061
Energy: 1.9372574031284944
Energy: 2.1755829428887834
Energy: 1.5782445888797882
Energy: 1.524494151136169
Energy: 1.4755013782425987
Energy: 1.9354690209218304
Energy: 2.072067737365196
Energy: 1.5736724463076028
Energy: 1.4554284122440913
Energy: 1.424206779588339
Energy: 2.074310648719129

minimum gb energy = 1.424206779588339 eV
minimum distance =  2.45901086997526 Angstroms
sigma value = 165


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

Energy: 1.6122940302860225
Energy: 1.9137036091454775
Energy: 1.4815677807312306
Energy: 1.6983461176837833
Energy: 2.150141694446176
Energy: 1.5073897062441883
Energy: 1.913916149174326
Energy: 1.5341620323260892
Energy: 1.5935439477017315
Energy: 2.190305069988189
Energy: 2.037843702262564
Energy: 1.7361456255532022
Energy: 1.5807352286961582
Energy: 1.5079710253765968
Energy: 1.6014444727229262
Energy: 2.029169340609367
Energy: 1.6649055184321229
Energy: 1.6193286169080727
Energy: 1.5450992602169404
Energy: 1.7284153131428226
Energy: 1.7851617967997575
Energy: 2.0278150474517203
Energy: 1.4330887026650687
Energy: 1.6625323959089793
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Energy: 1.6216299669919538
Energy: 1.5152296318866079
Energy: 1.524735867657482
Energy: 1.8901441902569975
Energy: 1.6019781680077598
Energy: 1.9741978241767177
Energy: 1.6040365251620843
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Energy: 1.9978658512411076
Energy: 1.7490218955276402
Energy: 1.6601130052087132
Energy: 1.5981691821349322
Energy: 1.6757806691929402
Energy: 1.6202625515974272
Energy: 1.7093587349892434
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Energy: 1.6189191220423
Energy: 1.9909624883590276
Energy: 1.7116892317707517
Energy: 2.1215895490818357
Energy: 1.8523215493370913
Energy: 1.6189641818142742
Energy: 1.8301099670501195
Energy: 1.736644590673465
Energy: 1.5088699356387987
Energy: 1.5280130475475453
Energy: 1.809361840969495
Energy: 1.826802028813084
Energy: 1.7047900819031094
Energy: 1.612187969238619
Energy: 1.5411461408794005
Energy: 1.7557838689592158
Energy: 2.015329409587467
Energy: 2.038265001987416
Energy: 1.5098620261552556
Energy: 1.5258055214926705
Energy: 1.5275975392283745
Energy: 2.1094305431637728
Energy: 2.038763071024721
Energy: 1.4967489512918932
Energy: 1.5491824790606936
Energy: 1.5758019013960518
Energy: 1.6467240667740504
Energy: 2.0138416401245367
Energy: 1.7601884744050467
Energy: 1.3389056472720942
Energy: 1.656242342414256
Energy: 2.0582426539222327
Energy: 2.0141563296200826
Energy: 1.795147870266927
Energy: 1.3428475131604918
Energy: 1.688484753525032
Energy: 2.0761730421668276
Energy: 1.816064370928941
Energy: 1.6523447095027837
Energy: 1.488086311210292
Energy: 1.6300648294277909
Energy: 1.9837894316709122
Energy: 1.8285503324777872
Energy: 1.4850763234127085
Energy: 1.5284343648632428
Energy: 1.693438859359979

minimum gb energy = 1.329166084954374 eV
minimum distance =  2.45768149152819 Angstroms
sigma value = 41


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

Energy: 2.312203727179234
Energy: 1.256513964218585
Energy: 1.3334036225467707
Energy: 1.505288554646526
Energy: 1.3767906683033653
Energy: 2.183834136299222
Energy: 1.2557995821465002
Energy: 1.491318915525849
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Energy: 1.8197351265103212
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Energy: 1.5775247039630136
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Energy: 1.7108637947321654
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Energy: 1.3672307000411075
Energy: 1.378342177135886
Energy: 1.862940490169181
Energy: 1.8213168226851955
Energy: 1.799511555098597
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Energy: 1.387793432057171
Energy: 1.589115277320763
Energy: 1.906639185886408
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Energy: 1.7261356782841302
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Energy: 1.5064100348998288
Energy: 1.7838882539411443
Energy: 2.0691432457953725
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Energy: 1.596636212929485
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Energy: 1.2690198202723466
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Energy: 2.071944247576242
Energy: 1.3960333374714535
Energy: 1.2468996290078862
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Energy: 2.1316424221358083
Energy: 1.373984055607095
Energy: 1.273723524686807
Energy: 1.292652498012146
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Energy: 1.3779110900647875
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Energy: 1.8241961068485846
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Energy: 1.6554102740429015
Energy: 1.650128237347991
Energy: 1.7818149342866891
Energy: 1.854178644416499
Energy: 1.6940282004536975
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Energy: 1.3630368532774577
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Energy: 1.8529123180973506
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Energy: 1.3818176183150608
Energy: 1.6306393834496076
Energy: 1.9991796511538813
Energy: 2.074531060594517
Energy: 1.3861349471184377
Energy: 1.5124064990393122
Energy: 1.722731713054896
Energy: 2.0275199211105934
Energy: 2.067990484434622
Energy: 1.3758541738702887
Energy: 1.5495327325905914
Energy: 1.5469676176189546
Energy: 1.5788094662869288
Energy: 1.5657931211040867
Energy: 1.5178776042594924
Energy: 1.3551703892575153
Energy: 1.5351433351045396
Energy: 1.9259819766815072
Energy: 1.3333874495759235
Energy: 1.5217639635148306
Energy: 1.3540828468593789
Energy: 1.5415142649716407
Energy: 2.1505938179547064
Energy: 1.3345699714290233
Energy: 1.2357164935677123
Energy: 1.2405701695684321
Energy: 1.564234722338822
Energy: 1.94623059478447
Energy: 1.3112099341013768
Energy: 1.2430955294360364
Energy: 1.2401440378744129
Energy: 1.3165130112097223
Energy: 2.0614867638864363
Energy: 1.386285112564712
Energy: 1.32456436283435
Energy: 1.3271058235480373
Energy: 1.3935476121423132
Energy: 2.065604439386996
Energy: 1.4563535729826365
Energy: 1.248795743366697
Energy: 1.333481982675348
Energy: 1.3330594834132934
Energy: 1.3740496188227986
Energy: 1.4268636874328573
Energy: 1.3244586820142688
Energy: 1.3867700099556899
Energy: 1.578833366746596
Energy: 1.327700764643891
Energy: 1.3898097277754848
Energy: 1.2533553780877247
Energy: 1.2459409774538133
Energy: 2.187076434894724
Energy: 1.5345617371892375
Energy: 1.275488788150204
Energy: 1.2742411849301978
Energy: 1.6947646867186672
Energy: 2.0880187888746327
Energy: 1.3846997642467658
Energy: 1.219933115803023
Energy: 1.213038002454717
Energy: 1.7586440813218682

minimum gb energy = 1.213038002454717 eV
minimum distance =  2.50745975483481 Angstroms
sigma value = 185


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

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Energy: 0.7143651073499991
Energy: 2.0502123131953747
Energy: 1.0388836986136347
Energy: 0.4128930054888723
Energy: 0.4125889630134564
Energy: 0.893694324051362
Energy: 2.036988871957815
Energy: 1.16512980333018
Energy: 0.7631730461788784
Energy: 0.8074147596115127
Energy: 1.1760782991742744
Energy: 2.009309129580997
Energy: 1.0537472736248439
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Energy: 1.100584570093458
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Energy: 0.5638685756931541
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Energy: 1.1259183797910632
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Energy: 1.033756745289762
Energy: 1.0532905574765006
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Energy: 1.1689613954297422
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Energy: 1.1901283893620558
Energy: 1.1260352643692968
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Energy: 0.5045417539446962
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Energy: 1.118575629507059
Energy: 1.3569665397618058
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Energy: 1.1611177050068724
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Energy: 1.163855081966535
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Energy: 1.190934669918773
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Energy: 1.1798146413553832
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Energy: 0.46327319032301567
Energy: 1.2058815785490162
Energy: 2.0314149613940224
Energy: 1.274580416653859
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Energy: 0.5636857500805111
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Energy: 2.318334190348623
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Energy: 0.46337114657938533
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Energy: 2.317629999438498
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Energy: 1.315322648445493
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Energy: 1.9831610747712822
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Energy: 1.1009834779069871
Energy: 1.1316452078693011
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Energy: 1.1260080476616237
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Energy: 1.1435163185714057
Energy: 1.1870080892185804
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Energy: 1.1905467701579393
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Energy: 1.144885323380425
Energy: 0.5889093574779921
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Energy: 2.007341948571151
Energy: 1.1820055242785645
Energy: 0.6422973074457781
Energy: 0.5639807277299026
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Energy: 2.048644629394313
Energy: 1.1857015770254675
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Energy: 0.5629075248511628
Energy: 1.269701467117597
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Energy: 1.273437868380152
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Energy: 1.1490471107169207
Energy: 1.2571820134022276
Energy: 0.6404353527288252
Energy: 0.46407507343568233
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Energy: 1.2354924161535534
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Energy: 1.1865128868609667
Energy: 1.0904719989108602
Energy: 1.1035987284061852
Energy: 1.2105146969037006
Energy: 2.033303254347702
Energy: 1.179458111120476
Energy: 0.5144273115434552
Energy: 0.5143552013481596
Energy: 1.2326576501503226
Energy: 2.0264212150670664
Energy: 1.1753308217908525
Energy: 0.5143254629996086
Energy: 0.5144650589958755
Energy: 1.1940751726619516
Energy: 2.040697288697878
Energy: 0.9607300262791895
Energy: 0.9825877774163648
Energy: 0.5599361449204119
Energy: 1.1976483029700127
Energy: 2.002882487202621
Energy: 1.2747958702020792
Energy: 1.0127664627301947
Energy: 1.0829110427887385
Energy: 1.1764159709976896
Energy: 1.1112473136587193
Energy: 1.007064811428462
Energy: 0.641871054827359
Energy: 1.235078981578196
Energy: 2.3128075657641425
Energy: 1.1732370675168862
Energy: 1.0711779520599947
Energy: 0.5334496846039081
Energy: 0.9641011603983451
Energy: 2.29826228662898
Energy: 1.204732337269577
Energy: 0.5643864028849178
Energy: 0.5641895168871148
Energy: 1.0138899738186433
Energy: 2.031042082893254
Energy: 1.170645726900866
Energy: 0.5145626318760468
Energy: 0.5139785350476954
Energy: 1.2223609266588735
Energy: 2.0388711999779825
Energy: 1.1413445340423973
Energy: 1.0747165753423118
Energy: 0.904446930609175
Energy: 1.1130471801867592
Energy: 2.020368550730831
Energy: 0.9939810230257664
Energy: 0.9777739482694309
Energy: 0.9639319764354568
Energy: 1.1706184138454774
Energy: 2.033727239730619
Energy: 1.0811102280299276
Energy: 0.7629618095565469
Energy: 1.1200658984660534
Energy: 2.0068506158437738
Energy: 2.309892162865555
Energy: 0.8908225888433557
Energy: 0.41242600272579755
Energy: 0.9198905385622397
Energy: 1.9792956112975528
Energy: 1.157149894173089
Energy: 0.7633419226175826

minimum gb energy = 0.41237568072287856 eV
minimum distance =  2.60017658775641 Angstroms
sigma value = 33


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

Energy: 1.9224393002580678
Energy: 1.5603924637416675
Energy: 1.3114036871308241
Energy: 1.323417194273933
Energy: 1.5697042921857958
Energy: 1.8960736414803963
Energy: 1.4916664850518395
Energy: 1.3121742646963963
Energy: 1.3161327158297604
Energy: 1.4876104297704271
Energy: 1.1441180887371918
Energy: 1.0322803571644739
Energy: 1.0441589335608028
Energy: 1.0491365146988885
Energy: 1.0718832894988204
Energy: 1.0828202154592395
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Energy: 1.1017729255205333
Energy: 1.0295826199967013
Energy: 1.0214120247101335
Energy: 1.1095897841831825
Energy: 1.5301051961376924
Energy: 1.09770261633786
Energy: 1.0255823113514189
Energy: 1.026275106148546
Energy: 1.1173783628231166
Energy: 2.185460311581581
Energy: 1.3419940622447137
Energy: 1.1263239411616879
Energy: 1.121389443326686
Energy: 1.1850401470873668
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Energy: 1.2943311811115734
Energy: 1.1188906045274898
Energy: 1.1478225612994162
Energy: 1.1882923012577233
Energy: 2.114469716277331
Energy: 1.1015343958851223
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Energy: 1.1851695264650552
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Energy: 1.1899223317617182
Energy: 1.0974038637462384
Energy: 1.0958105013495776
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Energy: 1.2872046336178977
Energy: 2.0961824801342432
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Energy: 1.9616212056037448
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Energy: 1.4141695315756546
Energy: 1.265274962607098
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Energy: 1.3099965075033104
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Energy: 1.270736797111298
Energy: 1.1024265276850447
Energy: 1.1034132650850075
Energy: 1.3072471571737647
Energy: 1.5456643818121234
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Energy: 1.7715666115129252
Energy: 1.1245719012883044
Energy: 1.3328407881964508
Energy: 1.526248183890422
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Energy: 1.6823857887851934
Energy: 1.136717813981891
Energy: 1.2892041049204155
Energy: 1.5069948207528039
Energy: 1.8975873149001725
Energy: 1.113213992005455
Energy: 1.4608741093968447
Energy: 1.6082600965045415
Energy: 1.5147808577979347
Energy: 1.893909326781748
Energy: 1.2250930347401094
Energy: 1.4778213564420684
Energy: 1.6452358241644036
Energy: 1.351750388410595
Energy: 1.8417676350455963
Energy: 1.1056058158047268
Energy: 1.1747825383824557
Energy: 1.6873615875513273
Energy: 1.3583693860220882
Energy: 1.8157079610969493
Energy: 1.1028312866892966
Energy: 1.1945389557648842
Energy: 1.610379380160453
Energy: 1.7912869798035966
Energy: 1.7710925415534204
Energy: 1.4879644860234944
Energy: 1.845858350992441
Energy: 1.546416099178208
Energy: 1.71464993845036
Energy: 1.8149656094093454
Energy: 1.48084666594092
Energy: 1.8442478870478811
Energy: 1.6586080664847553
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Energy: 1.0990942631725567
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Energy: 2.0038955642923035
Energy: 1.4078866024093375
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Energy: 1.3815337377537613
Energy: 1.1610315692543371
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Energy: 1.0842102300979002
Energy: 1.1249137029793181
Energy: 1.6044724848154053
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Energy: 1.09231197066493
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Energy: 1.185244789571595
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Energy: 1.1956147699189799
Energy: 1.0889335897049377
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Energy: 1.1780554920104214
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Energy: 2.2297106165672558
Energy: 1.143693870098326
Energy: 1.160910345847911
Energy: 1.1705725287381572
Energy: 1.5320030537825449

minimum gb energy = 1.0156713877513581 eV
minimum distance =  2.52252001319056 Angstroms
sigma value = 219


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

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Energy: 1.7088767008990158
Energy: 1.6976820747055847
Energy: 1.387189028157143
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Energy: 2.0565637124151026
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Energy: 1.8696809519191642
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Energy: 1.8700356636536708
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Energy: 1.6982734907118924
Energy: 1.5009085303862715
Energy: 1.69163846503058
Energy: 1.7900098758121357
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Energy: 1.6182092260394918
Energy: 2.1015245125773343
Energy: 1.776939365532014
Energy: 1.527066795415948
Energy: 1.6289267914822385
Energy: 1.520127953675594

minimum gb energy = 1.2155136692781434 eV
minimum distance =  2.52487911924629 Angstroms
sigma value = 15


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

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Energy: 1.9794574813352506
Energy: 1.7054741647608123
Energy: 1.8150104134946954
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Energy: 1.9480771678464832
Energy: 1.4822027537589195
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Energy: 1.8128099989203885
Energy: 2.1356318998208823
Energy: 1.9576624961059579
Energy: 1.500478648568329
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Energy: 2.4381055122663176
Energy: 2.3653036573684663
Energy: 1.5505097685973457
Energy: 1.4809033651109114
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minimum gb energy = 1.4126801180719022 eV
minimum distance =  2.50077115805435 Angstroms
sigma value = 293


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

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Energy: 1.695978833595514
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Energy: 1.7288357680312876
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Energy: 1.9891309556406216
Energy: 1.9873161355772457
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Energy: 2.1120997532540264
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Energy: 1.9894412145653437
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Energy: 1.664458035078362
Energy: 1.7965338178389196
Energy: 2.1404084091896602
Energy: 2.054616162661603
Energy: 1.539161209462393
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Energy: 2.11979996885379
Energy: 2.2419788686524105
Energy: 1.5391497105462264
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Energy: 1.825983602991626
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Energy: 2.28905432021937
Energy: 1.9329072777337148
Energy: 1.7484634177969987
Energy: 2.0208599784730463
Energy: 2.331566584914179
Energy: 2.3062478777919964
Energy: 1.932589137920259
Energy: 1.7641990227139237
Energy: 2.021125063821772
Energy: 2.3286598136181196
Energy: 2.202583589145302
Energy: 1.5187202497963712
Energy: 1.4068239055209275
Energy: 2.1812691318120483
Energy: 2.03915285004135
Energy: 1.9469493085298586
Energy: 1.4061738227917253
Energy: 1.40508615552509
Energy: 2.181582604671283
Energy: 2.1001960243532
Energy: 1.9226276033797822
Energy: 2.034516605057433
Energy: 1.8311323724661788
Energy: 1.7448205926600018
Energy: 1.9144182623214128
Energy: 1.956086380210514
Energy: 2.050279902736446
Energy: 1.8303286526570839
Energy: 1.898534627928436
Energy: 1.9162889883292338
Energy: 1.9538809600423255
Energy: 2.054861195176892
Energy: 1.834476558685134
Energy: 1.8406404473922284
Energy: 1.7851689286181054
Energy: 1.8730803934239113
Energy: 2.0536640791442853
Energy: 2.089388286935352
Energy: 1.8608105234044523
Energy: 1.7731441568664588
Energy: 1.798589993202895

minimum gb energy = 1.4036557524923234 eV
minimum distance =  2.49529380729136 Angstroms
sigma value = 293


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

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Energy: 1.3492490519803158
Energy: 1.4260718706037194
Energy: 1.6954093986278347
Energy: 1.26461075789858
Energy: 1.2596251144654087
Energy: 1.3861055808183975
Energy: 1.4261413424822305
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Energy: 1.8469885438211904
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Energy: 1.6950542333165068
Energy: 1.2636090756319316
Energy: 1.2606820942681318
Energy: 1.2900979950638614
Energy: 1.2927020182535984
Energy: 1.6953908417093781
Energy: 1.2634750932820642
Energy: 1.2615054889061357
Energy: 1.2898317419451037
Energy: 1.29398047614357
Energy: 1.693172584892394
Energy: 1.425356859657926
Energy: 1.9665807697934967
Energy: 1.7984626627579734
Energy: 1.3087713729462787
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Energy: 1.4251061721105838
Energy: 1.6945509906784735
Energy: 1.7962768709171155
Energy: 1.3084466328709827
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Energy: 1.8461791841818331
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Energy: 1.2895520728305534
Energy: 1.9294975359812503
Energy: 1.2669983431473129
Energy: 1.69631885934453
Energy: 1.2953071426799405
Energy: 1.4341603212023044
Energy: 1.9368475767947193
Energy: 1.7903793617620498
Energy: 1.3861321907760367
Energy: 1.2607221293862707
Energy: 1.2634768692749214
Energy: 1.9361275606335484
Energy: 1.789114678209461
Energy: 1.3863218894533045
Energy: 1.2596240534227465
Energy: 1.26331630595112
Energy: 1.2906181353598907
Energy: 1.3101318946787723
Energy: 1.695408581687732
Energy: 1.2629635399054158
Energy: 1.4338194560460797
Energy: 1.2886654418878887
Energy: 1.2958424779088287
Energy: 1.3890942211607735
Energy: 1.2627661850229381
Energy: 1.5882653012582157
Energy: 1.7972726884013812
Energy: 1.29227979399636
Energy: 1.788835126560333
Energy: 1.9344368652904542
Energy: 1.6956543618918245
Energy: 1.2935690962540334
Energy: 1.2912948498906793
Energy: 1.7890483925257998
Energy: 1.935352585218538
Energy: 1.6951508978300394
Energy: 1.2614053152369173
Energy: 1.3829891296550272
Energy: 1.3874340385911716
Energy: 1.9298027635984414
Energy: 1.4334724342859306
Energy: 1.2622776175691506
Energy: 1.3833333749835075
Energy: 1.2670941738301336
Energy: 1.9306894822119436
Energy: 1.4339268011942399

minimum gb energy = 1.2583165176381235 eV
minimum distance =  2.53307690350257 Angstroms
sigma value = 15


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

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Energy: 2.2811141505368306
Energy: 2.2308634389340884
Energy: 2.10682305449265
Energy: 2.0899745227334217
Energy: 2.3765488587672516
Energy: 2.3063177763401255
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Energy: 1.9943888570648742
Energy: 1.5902615873018295
Energy: 1.5332528723970804
Energy: 1.9973838386552565
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Energy: 1.8311740354711579
Energy: 1.5885430635045468
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Energy: 1.9991752894901862
Energy: 2.0939937755072706
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Energy: 1.6911566984607287
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Energy: 2.1979719876625663
Energy: 2.0180053010749734
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Energy: 2.3838023893171463
Energy: 2.0340887689051477
Energy: 1.5494184438892387
Energy: 1.627423651793839
Energy: 2.081676765269091
Energy: 2.072093032564495
Energy: 1.9383727934001551
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Energy: 1.959167766322772
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Energy: 1.6020850341070902
Energy: 1.7574790866578558
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Energy: 1.9742000055481457
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Energy: 1.5010029566056848
Energy: 1.9809252831835618
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Energy: 1.8281979359274545
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Energy: 1.4624166593540415
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Energy: 1.4821274692269477
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Energy: 1.9128358297690404
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Energy: 2.1181797905512525
Energy: 2.0951870154339334
Energy: 2.3082230951342533
Energy: 1.8233196531634759
Energy: 1.936420517886353
Energy: 1.5106467225327613
Energy: 1.8777926633978705
Energy: 2.24055318198141
Energy: 1.8244368523018177
Energy: 1.6981031539487186
Energy: 1.5403538939412287
Energy: 1.8683905122593096
Energy: 2.1663752505967424
Energy: 2.12053964009858
Energy: 1.8185511644792172
Energy: 1.4867507324714517
Energy: 1.7703855716901806
Energy: 2.168635249314737
Energy: 2.1243752806959773
Energy: 1.8062669979086754
Energy: 1.4865300813219517
Energy: 1.7930740444024065
Energy: 1.5993616533337975
Energy: 2.0917792648942917
Energy: 1.8836543192402067
Energy: 1.8574264805785017
Energy: 2.1130752904309196
Energy: 1.5998212402512841
Energy: 2.0931597753010927
Energy: 1.865310900650492
Energy: 1.8569265045482808
Energy: 2.1042615058643057
Energy: 1.9894308177458921
Energy: 2.2726861401172647
Energy: 2.378673024602573
Energy: 2.285492902674687
Energy: 2.1515176201575263
Energy: 2.067059625420072
Energy: 2.120003197921519
Energy: 2.3737827978963155
Energy: 2.2893080145994724
Energy: 2.159063411614611
Energy: 1.4991890292377346
Energy: 1.843667607172917
Energy: 2.4829196662291713
Energy: 2.2285101917947503
Energy: 1.6185231057127014
Energy: 1.502431920310162
Energy: 1.8940514546742937
Energy: 2.3527970549873154
Energy: 2.2433823681449616
Energy: 1.6248220116645293
Energy: 1.638796230828517
Energy: 1.9827024967163542
Energy: 1.7555018293895233
Energy: 2.0234337136740734
Energy: 1.7871716425573363
Energy: 1.5368580931598714
Energy: 1.8870320561212688
Energy: 1.7565811416469244
Energy: 2.002475368482248
Energy: 1.7817686384934797
Energy: 2.082614310490715
Energy: 1.7216959881670881
Energy: 1.580814376108925
Energy: 2.053404350782381
Energy: 1.9420482340122263
Energy: 2.145915092334248
Energy: 1.710775158527861
Energy: 1.7151102558706783
Energy: 2.0780889223858967
Energy: 1.8913999721333923
Energy: 2.453356500672221
Energy: 2.122325203377914
Energy: 2.1039321442467678
Energy: 2.2264524993141874
Energy: 2.127535834448604
Energy: 2.441808402110507
Energy: 2.0959702031659724
Energy: 2.108361109700805
Energy: 2.2282080383646794
Energy: 2.1273503252159913
Energy: 2.204317551290387
Energy: 1.9411448934827915
Energy: 1.8372811098431614
Energy: 2.1256485483166925
Energy: 1.7975289519682072
Energy: 2.2097854387532383
Energy: 1.926763280782059
Energy: 1.8195258123469262
Energy: 2.110071637045212
Energy: 1.8548571496390456
Energy: 1.90947021498738
Energy: 2.0943925202553326
Energy: 2.079575846120839
Energy: 1.5075848829123997
Energy: 1.5633203495272412
Energy: 1.9155386598818942
Energy: 2.0879566891001935
Energy: 2.016647107309415
Energy: 1.4981744759546336
Energy: 1.5659577675891994
Energy: 2.050335495933429
Energy: 2.162441887560246
Energy: 1.9198276842830997
Energy: 1.5273710610004216
Energy: 1.50968158464903
Energy: 2.0236620061325783
Energy: 2.1831452373994122
Energy: 1.8202327370971036
Energy: 1.524868066492088
Energy: 1.515675712207171
Energy: 2.181629639574096
Energy: 2.1300580731774965
Energy: 2.0018133795539583
Energy: 2.085680634775065
Energy: 2.29712914025555
Energy: 2.224021676447653
Energy: 2.177040273963732
Energy: 2.0953657147326794
Energy: 2.1122316045370635
Energy: 2.2584162662321328
Energy: 1.6859864856115947
Energy: 1.6936386760521653
Energy: 1.795714196643009
Energy: 1.831391728428939
Energy: 2.3238503869629876
Energy: 1.550155110819962
Energy: 1.7841380795679078
Energy: 2.0573778650895784
Energy: 1.8344113772213022
Energy: 2.084150904364977
Energy: 1.5578017945854896
Energy: 1.5299572277980382
Energy: 1.9989743445063757
Energy: 2.177055824859212
Energy: 1.8587808785207074
Energy: 1.555467589485862
Energy: 1.5425354854680842
Energy: 2.009660092948425
Energy: 2.1370537114921375
Energy: 1.8652897623761922
Energy: 1.632896328086287
Energy: 1.4756324094191131
Energy: 1.6014640888842908
Energy: 1.6004189328396026
Energy: 1.9569468997609727
Energy: 1.631774509670462
Energy: 1.5524547569009948
Energy: 1.60883405175934
Energy: 2.0690481383121604
Energy: 1.964775377842941
Energy: 2.4309369214657135
Energy: 2.1236479177185967
Energy: 2.183116253903054
Energy: 2.0428143637535965
Energy: 2.071918966517974
Energy: 2.3977481426345832
Energy: 2.1397248136327502
Energy: 2.1246159400040745
Energy: 2.0703751642652106
Energy: 2.1609833481734557

minimum gb energy = 1.4536231216516582 eV
minimum distance =  2.45142973584845 Angstroms
sigma value = 437


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

Energy: 1.7670417963126883
Energy: 2.2099540914319484
Energy: 2.1826165722013315
Energy: 2.073833066149022
Energy: 2.2880828620785296
Energy: 1.7686835098244968
Energy: 2.15406458953129
Energy: 2.109617813182014
Energy: 2.1254333306234585
Energy: 2.272666179078748
Energy: 1.9196655615838638
Energy: 2.005010924719539
Energy: 1.5744820730794076
Energy: 1.727373217126906
Energy: 2.050154629714094
Energy: 1.8831359310238764
Energy: 1.9663321261851197
Energy: 1.580789693140863
Energy: 1.8741390439397072
Energy: 2.064855756232749
Energy: 1.6608481613289894
Energy: 1.791356827871059
Energy: 1.9821482112058626
Energy: 1.9416276076576748
Energy: 1.5116198885441516
Energy: 1.6894169111077262
Energy: 1.7999087548927348
Energy: 1.9768275867751668
Energy: 1.9394035851590135
Energy: 1.5184345810108262
Energy: 1.5911884061190724
Energy: 2.0337450059121656
Energy: 2.1682702289878337
Energy: 1.8375962432421133
Energy: 1.5449483059904359
Energy: 1.657136944256517
Energy: 2.0339368858070994
Energy: 2.1673646023240414
Energy: 1.8828420973134627
Energy: 1.5418738541877408
Energy: 1.9526661109439838
Energy: 2.1470318843240257
Energy: 2.0727406626577
Energy: 2.089078605326939
Energy: 2.1317186524009983
Energy: 1.9524066012589103
Energy: 2.175318244199418
Energy: 2.0746553569252755
Energy: 1.9586611933990348
Energy: 2.1326612271165426
Energy: 2.2733132080615865
Energy: 1.7306827469366546
Energy: 1.7452450073855452
Energy: 1.9349257092497119
Energy: 1.7724532718454624
Energy: 1.985649036253116
Energy: 1.7467356994485437
Energy: 1.7607014757937494
Energy: 1.9260688363011955
Energy: 1.7716355915130344
Energy: 1.8253869195991486
Energy: 1.6474420763003206
Energy: 1.5264284204597096
Energy: 2.0396242915325837
Energy: 1.9675409504051837
Energy: 1.8066869411374942
Energy: 1.628086209139591
Energy: 1.592107253335163
Energy: 2.0845001527979123
Energy: 1.9781428644447776
Energy: 1.9581708449482178
Energy: 1.7383653757973516
Energy: 1.9639771868313942
Energy: 1.6809572641292259
Energy: 1.8764853018174197
Energy: 1.8868713573388367
Energy: 1.7379682287411684
Energy: 1.8116740997802518
Energy: 1.6793527136027662
Energy: 1.8790371566510047
Energy: 1.710704962501429
Energy: 2.049939877618102
Energy: 2.031307495928238
Energy: 2.0485098931681502
Energy: 1.8834262394932513
Energy: 1.8519873639649993
Energy: 2.0503358298665675
Energy: 2.0276749476371188
Energy: 2.0441468325390546
Energy: 1.8848960182996926
Energy: 2.0547590018071413
Energy: 2.0476330512155307
Energy: 2.078261016732199
Energy: 1.7750413837468804
Energy: 1.9679834761192125
Energy: 2.1991889994759135
Energy: 2.0744173508935915
Energy: 2.0789748926098426
Energy: 1.7760800033671904
Energy: 1.96925088963526
Energy: 1.478441990839623
Energy: 1.617778164958818
Energy: 1.8582343076341026
Energy: 1.7834216642124148
Energy: 2.0321821560517024
Energy: 1.4832206466853832
Energy: 1.7415760362701944
Energy: 1.8314472862571864
Energy: 1.781859286088196
Energy: 2.0154995367187567
Energy: 1.5106301792074388
Energy: 1.5008669503049157
Energy: 1.9889658066530185
Energy: 2.1158001736741965
Energy: 1.7454044401563336
Energy: 1.510522797872111
Energy: 1.5118272471081942
Energy: 2.02562370782227
Energy: 2.1426677178394504
Energy: 1.7463953680507305
Energy: 1.80132580676242
Energy: 1.4739608108827031
Energy: 1.6838681972065395
Energy: 1.8320020302315005
Energy: 1.8824049516025776
Energy: 1.6525912635618059
Energy: 2.15256298885182
Energy: 1.6877960717874372
Energy: 1.8558077057153117
Energy: 1.763070418526205
Energy: 2.3327319621734377
Energy: 2.1848343914328257
Energy: 2.2137923439886484
Energy: 2.022270335536054
Energy: 2.105502701910047
Energy: 2.332435765467373
Energy: 2.1895379564162196
Energy: 2.206743963959146
Energy: 2.03473110179465
Energy: 2.274883380254596

minimum gb energy = 1.4739608108827031 eV
minimum distance =  2.43149857991379 Angstroms
sigma value = 33