Model name: model_name=MEAM_LAMMPS_LeeBaskesKim_2001_Fe__MO_196726067688_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.863657340407371
cohesive_energy=4.290337440834254
mass=55.845
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=[0.0, 2.4558483881278797e-19, 2.90855941783092e-19, 3.2776528490055e-19, 3.5962136291437197e-19, 4.79688479866332e-19, 5.086766617052939e-19, 5.34122431006482e-19, 5.56616990947842e-19, 5.765528748047039e-19, 5.94229689607626e-19, 6.09886159675074e-19, 6.23712944026494e-19, 6.35868658148652e-19, 6.4648628270216995e-19, 6.55679572228062e-19, 6.63543055147734e-19, 6.70161646822788e-19, 6.756106495550219e-19, 6.799525482331619e-19, 6.83246623392666e-19, 6.85544144685822e-19, 6.8689317741165e-19, 6.87333775986e-19, 6.868579295257019e-19, 6.85311829073892e-19, 6.82496804727954e-19, 6.78172529992788e-19, 6.7204901089764e-19, 6.63780177289566e-19, 6.52939850183922e-19, 6.39015333057828e-19, 6.213721639642199e-19, 5.992284807057059e-19, 5.716085577121799e-19, 5.37293138565168e-19, 4.94750542402566e-19, 4.4202451155426e-19, 3.7653714381614393e-19, 2.95007181441786e-19, 1.9309593010631396e-19, 6.49823616630792e-20, -9.72234427220514e-20, -3.0442157134317e-19, -5.71948219158588e-19, -9.21913263499842e-19, -1.3869658598145839e-18, -2.01685199041188e-18, -2.8901183647735795e-18, -4.13624328539976e-18, -5.9802043952366996e-18, -8.83983333866526e-18, -1.3560662812512598e-17, -2.2064695950457802e-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: 0.014917206430725562
Energy: 0.015241183520183615
Energy: 0.09738413673464107
Energy: 0.09695787007689669
Energy: 0.11073129397966648
Energy: 0.10899840763569285
Energy: 0.11039833256694914
Energy: 0.09612790314923743
Energy: 0.09609990676430633
Energy: 0.017610706676779383
Energy: 0.015185787614238222
Energy: 0.09566441102151688
Energy: 0.10944578790111162
Energy: 0.01564111876099317
Energy: 0.016295286586163752
Energy: 0.09608874302546104
Energy: 0.09582618912891226
Energy: 0.1090993223373318
Energy: 0.0955507966818136
Energy: 0.11006332375166161
Energy: 0.09636626941178378
Energy: 0.0958597245954628
Energy: 0.1090272354000745
Energy: 0.015194536418300767
Energy: 0.09692139315333885
Energy: 0.1091031672797058
Energy: 0.01535208545292369
Energy: 0.01528397756515759
Energy: 0.1091959168954703
Energy: 0.09721823294974395
Energy: 0.01655159138641239
Energy: 0.10945582020697338
Energy: 0.09560730738664233
Energy: 0.09621940515387899
Energy: 0.095954085570579
Energy: 0.11065002438623998
Energy: 0.016064442604159738
Energy: 0.015494715294863383
Energy: 0.09602795545198989
Energy: 0.015211485432698941
Energy: 0.01679202877576912
Energy: 0.09760067170679167
Energy: 0.09592747196283599
Energy: 0.015777655894979148
Energy: 0.015174118377921103
Energy: 0.09588672519009896
Energy: 0.09638459469966423
Energy: 0.0974588220731701
Energy: 0.09572254777348915
Energy: 0.015097167463650165
Energy: 0.09603494549870563
Energy: 0.09935239547060162
Energy: 0.11037444891823033
Energy: 0.01535558501167759
Energy: 0.015102907561489869
Energy: 0.09679865901898732
Energy: 0.015558402602363243
Energy: 0.016881733199404905
Energy: 0.10980257671456956
Energy: 0.09623689357676796
Energy: 0.015227992496318616
Energy: 0.10933537748495045
Energy: 0.09563258144697914
Energy: 0.10912157240852906
Energy: 0.09632336092292211
Energy: 0.10904563038355651
Energy: 0.015192034961575396
Energy: 0.016638432471694633
Energy: 0.10906538278795427
Energy: 0.09604008569355213

minimum gb energy = 0.014917206430725562 eV
minimum distance =  2.47838968169238 Angstroms
sigma value = 3


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

Energy: 1.5271069239818487
Energy: 1.3544277988038795
Energy: 1.3288918977407131
Energy: 1.2917230152690433
Energy: 1.3549612086759029
Energy: 1.3421237363809317
Energy: 1.3388247600505119
Energy: 1.31114718562175
Energy: 1.3367943742781623
Energy: 1.3470802118292853
Energy: 1.4481572681737278
Energy: 1.326614529813056
Energy: 1.3417270105862649
Energy: 1.3927781867202276
Energy: 1.3810392993793792
Energy: 1.320808840911058
Energy: 1.3010416596819363
Energy: 1.3449950710828134
Energy: 1.3218290465301485
Energy: 1.338321710455767
Energy: 1.3467103491887689
Energy: 1.2793371437017096
Energy: 1.32665124134456
Energy: 1.302730468627191
Energy: 1.4422117039090714
Energy: 1.319514718924784
Energy: 1.4074646258546584
Energy: 1.2774685169018654
Energy: 1.31664490684965
Energy: 1.3742009023791772
Energy: 1.5167102145183857
Energy: 1.3107090513305686
Energy: 1.3214844911568162
Energy: 1.3059460260670726
Energy: 1.241602161470646
Energy: 1.323504857251615
Energy: 1.3519485827105224
Energy: 1.379838553068676
Energy: 1.5087784662255632
Energy: 1.4574101269719526
Energy: 1.5916783508288794
Energy: 1.3141018836339198
Energy: 1.4854377897439777
Energy: 1.4254892575181808
Energy: 1.2730680521871525
Energy: 1.3371680497087097
Energy: 1.3025861688064937
Energy: 1.3048076662753418
Energy: 1.3421811933755272
Energy: 1.2696435146353242
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Energy: 1.3268419788038421
Energy: 1.2544136202837999
Energy: 1.2515828458296507
Energy: 1.399927493847909
Energy: 1.4164125608481237
Energy: 1.4009056958954231
Energy: 1.2462074192236356
Energy: 1.302698515907815
Energy: 1.2849471001238766
Energy: 1.3649930129753427
Energy: 1.2419132026409951
Energy: 1.2373124243297287
Energy: 1.274535345150734
Energy: 1.3594529560552326
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Energy: 1.412177549699713
Energy: 1.3713094107532005
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Energy: 1.2353739515373834
Energy: 1.2458957928476218
Energy: 1.3218083504559985
Energy: 1.3045489478016619
Energy: 1.2973901880605394
Energy: 1.2328001578360264
Energy: 1.262212641432663
Energy: 1.4456890941279452
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Energy: 1.235950072269179
Energy: 1.262978246180893
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Energy: 1.2383377682308105
Energy: 1.3129165373957985
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Energy: 1.232437297935675
Energy: 1.3283336850020802
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Energy: 1.344369349503228
Energy: 1.283367214367924
Energy: 1.2868935571201943
Energy: 1.5678217254784332
Energy: 1.3108395557195047
Energy: 1.4222844976397027
Energy: 1.3096868842599902
Energy: 1.299132088324873
Energy: 1.479016085330912
Energy: 1.334740027393624
Energy: 1.3135412792533119
Energy: 1.3409995792918268
Energy: 1.2971005120181975
Energy: 1.3339506180812448
Energy: 1.3333361121284366
Energy: 1.3678367640139397
Energy: 1.2995804087551552
Energy: 1.32042771678318
Energy: 1.374367864181855
Energy: 1.3112303269369683
Energy: 1.29207475987183
Energy: 1.6618370345971756
Energy: 1.4024049560502085
Energy: 1.337388448558344
Energy: 1.4363887109765228
Energy: 1.3536276528770304
Energy: 1.2919624331335158
Energy: 1.3185373182638727
Energy: 1.370830546112145
Energy: 1.3550672148185579
Energy: 1.2868787382584914
Energy: 1.3058031305904036
Energy: 1.3148801537634744
Energy: 1.3542763459585618
Energy: 1.3266220716858859
Energy: 1.2869336396879163
Energy: 1.368702079402125
Energy: 1.6067495870507742
Energy: 1.378401819515784
Energy: 1.3146850631927238
Energy: 1.2789300029268291
Energy: 1.3125586591853369
Energy: 1.3701170353560193
Energy: 1.285476384431412
Energy: 1.340071990861159
Energy: 1.292029039853779
Energy: 1.3353012207848904
Energy: 1.3591304909579442
Energy: 1.2665466381312123
Energy: 1.3614560811880445
Energy: 1.3949539670378246
Energy: 1.3811464168461987
Energy: 1.5604842957429346
Energy: 1.2687287316514109
Energy: 1.3352638072174843
Energy: 1.4125647696687935
Energy: 1.238797032196596
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Energy: 1.2799538357073976
Energy: 1.343650923778935
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Energy: 1.3120446501440641
Energy: 1.246121913830765
Energy: 1.5068254334545212
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Energy: 1.259701511058937
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Energy: 1.2770753159880326
Energy: 1.306006679528938
Energy: 1.4019126344287554
Energy: 1.320965913091618
Energy: 1.2372560407995696
Energy: 1.3017211037447218
Energy: 1.3792978097772048
Energy: 1.2330807528220593
Energy: 1.2270126866874764
Energy: 1.4628793415251953
Energy: 1.33422580524437
Energy: 1.2426169316754214
Energy: 1.2391969267735632
Energy: 1.2578592080506208
Energy: 1.310361697901287
Energy: 1.2920000437980061
Energy: 1.3031511348143825
Energy: 1.3567684575390973
Energy: 1.2884387855627026
Energy: 1.3555873151415863
Energy: 1.3538698970857073
Energy: 1.240066938734298
Energy: 1.3560542205655786
Energy: 1.396209302989138
Energy: 1.2625849783568783
Energy: 1.2668086527201199
Energy: 1.2346856313310544
Energy: 1.2858248611792706
Energy: 1.2886151264920003
Energy: 1.2368725272846124
Energy: 1.2394099699148555
Energy: 1.3435154842808308
Energy: 1.2926763036221491
Energy: 1.3095521740835254
Energy: 1.2396103286820195
Energy: 1.2525254886667307
Energy: 1.3106488347600675
Energy: 1.3949824448611052
Energy: 1.2492323774487275
Energy: 1.3184776174843036
Energy: 1.3324846494404987
Energy: 1.2909045173145202
Energy: 1.2728270715232424
Energy: 1.2610817935078795
Energy: 1.4227807493573943
Energy: 1.2794232689849392
Energy: 1.4632913329356574
Energy: 1.3078948214753698
Energy: 1.3048560425040636
Energy: 1.3476953083006835
Energy: 1.326937774054013
Energy: 1.2727960208935216
Energy: 1.3443448547599124
Energy: 1.2599864482723668
Energy: 1.292714518040992
Energy: 1.3520643852924619
Energy: 1.3053522371855866
Energy: 1.3668535308916463
Energy: 1.5283406227972363
Energy: 1.4990967691097397
Energy: 1.2873591006137404
Energy: 1.3460430509611907
Energy: 1.3271883652094432
Energy: 1.3085516105214294
Energy: 1.2868728796884492
Energy: 1.320280895998702
Energy: 1.2517833828205631
Energy: 1.3371650831032809
Energy: 1.3589486576582872
Energy: 1.2804868500577258
Energy: 1.3104999199481646
Energy: 1.5037070508953634
Energy: 1.5041853595989056
Energy: 1.8081146773155938
Energy: 1.320423672618605
Energy: 1.3347406959011339
Energy: 1.2799238623891176
Energy: 1.3912050934400206
Energy: 1.3280318674546867
Energy: 1.3460041543791714
Energy: 1.2906437285747456
Energy: 1.3020042264189573
Energy: 1.319351922289238
Energy: 1.3211142164447984
Energy: 1.4088022383791794
Energy: 1.6106414812017897
Energy: 1.4114306358393447

minimum gb energy = 1.2270126866874764 eV
minimum distance =  2.2626927993972 Angstroms
sigma value = 75


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

Energy: 2.6715351819295123
Energy: 1.3690647376095064
Energy: 1.4277288710861127
Energy: 1.2429514158306438
Energy: 1.3400783054285064
Energy: 1.3546765227345614
Energy: 1.2996618717067956
Energy: 1.3085392068621138
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Energy: 1.333314113336276
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Energy: 1.2986474129029024
Energy: 1.3228431904269051
Energy: 1.3413944660199735
Energy: 1.3110062920568564
Energy: 1.3182529992905652
Energy: 1.2357302095410385
Energy: 1.3561888990104436
Energy: 1.4078091258670065
Energy: 1.3411369948055996
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Energy: 1.4537717468438345
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Energy: 1.3089934334905629
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Energy: 1.352002809041441
Energy: 1.3091195776303248
Energy: 1.3011185399284693
Energy: 1.3498163044697835
Energy: 1.3137554060799301
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Energy: 1.3791842243476617
Energy: 1.4126338139300658
Energy: 1.3236441527689473
Energy: 1.3547763994868423
Energy: 1.2888701634415458
Energy: 1.3387283051168457
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Energy: 1.3236149578206962
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Energy: 1.3473953750309573
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Energy: 1.3158051301022102
Energy: 1.2704190752788114
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Energy: 1.291946022784149
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Energy: 1.308454602732015
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Energy: 1.3019101609327752
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Energy: 1.26502610249262
Energy: 1.410863508096635
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Energy: 1.3173028526871964
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Energy: 1.3531878202211078
Energy: 1.4037517230737684
Energy: 1.2646413770086031
Energy: 1.331091271767558
Energy: 1.3828272291444177
Energy: 1.2880049756015548
Energy: 1.3762431020581722
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Energy: 1.2616015809217316
Energy: 1.320142875738574
Energy: 1.261850579726668
Energy: 1.2910471786580782
Energy: 1.3287957930118397
Energy: 1.3077485221245975
Energy: 1.3056528895311363
Energy: 1.3067219520697306
Energy: 1.3322806960030824
Energy: 1.3970358647862031
Energy: 1.2542581726004602
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Energy: 1.3392930028885808
Energy: 1.2295565040739873
Energy: 1.3104833022616502
Energy: 1.3495043317871462
Energy: 1.3272722985476666
Energy: 1.3929205750008313
Energy: 1.4193243720135658
Energy: 1.463404125639979
Energy: 1.3001276762615612
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Energy: 1.2974995328661971
Energy: 1.4344191920750895
Energy: 1.2974979930740478
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Energy: 1.3595648044800908
Energy: 1.3092335667664254
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Energy: 1.4346911546098893
Energy: 1.4668142602505052
Energy: 1.295428923448058
Energy: 1.3389203421238631
Energy: 1.4503432853106144
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minimum gb energy = 1.2287802903434404 eV
minimum distance =  2.28416672450147 Angstroms
sigma value = 105


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

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Energy: 1.368197363183575
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Energy: 1.3254284536108787
Energy: 1.326349198957002
Energy: 1.2588383460005663
Energy: 1.3023779640043307
Energy: 1.388928234187349
Energy: 1.3154688188797767
Energy: 1.3012195020281145
Energy: 1.3546389805416643
Energy: 1.4477413110031283
Energy: 1.3707031012886166
Energy: 1.2933071135120464
Energy: 1.3918048045822229
Energy: 1.2743233343873834
Energy: 1.4266143843636159
Energy: 1.2607486801534211
Energy: 1.4584317841496863
Energy: 1.4570872698503214
Energy: 1.4576879965985754
Energy: 1.425947193466983
Energy: 1.355449507040008
Energy: 1.3213868531630983
Energy: 1.3161690259571632
Energy: 1.3035291496397114
Energy: 1.4002390337330974
Energy: 1.2907385853958941
Energy: 1.3198795129333658
Energy: 1.5310934663304656
Energy: 1.278342424100921
Energy: 1.30643161170155
Energy: 1.3052331752078175
Energy: 1.2993500507212827
Energy: 1.3031506982629346
Energy: 1.249405051173652
Energy: 1.3399374389900935
Energy: 1.4310673620056187
Energy: 1.284200183746075
Energy: 1.2019069303253234
Energy: 1.3767610643522337
Energy: 1.3106864000595972
Energy: 1.4366912496390594
Energy: 1.2175140221086151
Energy: 1.2788659860662068
Energy: 1.3384902819898503
Energy: 1.2849704871805785
Energy: 1.350607942521533
Energy: 1.3516927096913152
Energy: 1.422794568056031
Energy: 1.433464771857673
Energy: 1.4185110392534281
Energy: 1.3245121554137518
Energy: 1.283633470181099
Energy: 1.2725784089491532
Energy: 1.2851249979327204
Energy: 1.3149542544464266
Energy: 1.3162285656899144
Energy: 1.4322901429180679
Energy: 1.3841736910321403
Energy: 1.3167699094568632
Energy: 1.3146148269640616
Energy: 1.4661671836444814
Energy: 1.520382185782057
Energy: 1.2332163400621923
Energy: 1.257689322804458
Energy: 1.2470914537419677
Energy: 1.8384674826810714
Energy: 1.3257097611130197
Energy: 1.1934773991828214
Energy: 1.3206966227432497
Energy: 1.3628088081792098
Energy: 1.3144791701387197
Energy: 1.2456830791194098
Energy: 1.325069151427497
Energy: 1.5240171155292686
Energy: 1.2321482848980547

minimum gb energy = 1.083829117143434 eV
minimum distance =  2.25801741609116 Angstroms
sigma value = 165


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

Energy: 2.082625339282991
Energy: 1.2656357817308779
Energy: 1.2282075116481024
Energy: 1.2783596805750561
Energy: 1.3934731874490642
Energy: 1.2414573744654502
Energy: 1.2404446977715071
Energy: 1.2528693888992783
Energy: 1.441757267466916
Energy: 1.2251602004773403
Energy: 1.285783651460172
Energy: 1.5615710236010516
Energy: 1.612424040222575
Energy: 1.5483581721428554
Energy: 1.446410882155898
Energy: 1.5406928348614108
Energy: 1.2442419396762454
Energy: 1.2431868175077505
Energy: 1.2442807970562968
Energy: 1.3985731193755204
Energy: 1.281771560324233
Energy: 1.264821701075137
Energy: 1.2651237769839623
Energy: 1.3641814140282706
Energy: 1.5767077436404227
Energy: 1.406269784338808
Energy: 1.7374041719569562
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Energy: 1.2738268518481521
Energy: 1.3359055715626207
Energy: 1.3076665237273506
Energy: 1.3057246739989272
Energy: 1.299104999932146
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Energy: 1.2443088215138345
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Energy: 1.7449757527252585
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Energy: 1.9039451760217714
Energy: 1.648994778127545
Energy: 1.2651811335955285
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Energy: 1.6705386567966418
Energy: 1.237809652454895
Energy: 1.2599017944812207
Energy: 1.307465185505662
Energy: 1.2903695049373087
Energy: 1.2476479319074656
Energy: 1.5946974097185629
Energy: 1.3650384842709258
Energy: 1.681957062933637
Energy: 1.3727103358968478
Energy: 1.2247400614839827
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Energy: 1.2431425923149297
Energy: 1.2473460674223622
Energy: 1.2617679837853208
Energy: 1.3159967526177299
Energy: 1.321951663044427
Energy: 1.330232493640123
Energy: 1.2803885250451295
Energy: 1.2799244782621597
Energy: 1.236587170473075
Energy: 1.2882620079530436
Energy: 1.472816541393871
Energy: 1.3141577392614538
Energy: 1.2744948556608648
Energy: 1.3052250758977684
Energy: 1.236640452370375
Energy: 1.254540396327314
Energy: 1.270760843030773
Energy: 1.2744157998812524
Energy: 1.2335109089237235
Energy: 1.2398743836571484
Energy: 1.248511179341468
Energy: 1.2610688270252037
Energy: 1.277974696350516
Energy: 1.2579674546811632
Energy: 1.2434319152498092
Energy: 1.255463039181221
Energy: 1.2248213727289703
Energy: 1.2568029698993657
Energy: 1.3403498120488753
Energy: 1.3120261393636679
Energy: 1.2193256708593112
Energy: 1.3050923216396146
Energy: 1.3004755795435954
Energy: 1.3215706666784586
Energy: 1.3377773656369187
Energy: 1.2416576541318887
Energy: 1.2322620909737187
Energy: 1.3342020325228086
Energy: 1.2354584058467493
Energy: 1.277389045757597
Energy: 1.255711830973613
Energy: 1.2664050521894954
Energy: 1.30318730366015
Energy: 1.526737855178979
Energy: 1.3737150633018613
Energy: 1.3017146941764712
Energy: 1.557762753231348

minimum gb energy = 1.2193256708593112 eV
minimum distance =  2.22719810222738 Angstroms
sigma value = 41


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

Energy: 3.0620685218479595
Energy: 1.3203394568967803
Energy: 1.4666268066701742
Energy: 1.3127941783220232
Energy: 1.2112209462639856
Energy: 1.3746961048747144
Energy: 1.4593747023457322
Energy: 1.422138136755185
Energy: 1.3923238053140305
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Energy: 1.1919828695599426
Energy: 1.820642936779032
Energy: 1.5169441866190632
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Energy: 1.6639921549826406
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Energy: 1.9741603627574718
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Energy: 1.2096765025238023
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Energy: 1.6158715713922662
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Energy: 1.3637990197516519
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Energy: 1.3967787037079942
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Energy: 1.4969155084175692
Energy: 1.2201637196873638
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Energy: 1.3171268794255913
Energy: 1.3704947367769404
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Energy: 1.1824565170693893
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Energy: 1.3960198555400383
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Energy: 1.1867637876151693
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Energy: 1.418038400847911
Energy: 1.3364669612031872
Energy: 1.2893529822110488
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Energy: 1.5230440548026816
Energy: 1.406663816232965
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Energy: 1.3048492647906378
Energy: 1.6990864292273662
Energy: 1.5131630652439305
Energy: 1.3295419177010275
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Energy: 1.2374111029803647
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Energy: 1.3833689598928354
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Energy: 1.3637959856444388
Energy: 1.2809275297545324
Energy: 1.3934402300037532
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Energy: 1.2113994691745147
Energy: 1.2113152441681636
Energy: 1.1710449626713841
Energy: 1.290618803580022
Energy: 1.2622530743485103
Energy: 1.2020365720447022
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Energy: 1.3581876921545057
Energy: 1.479950875865399
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Energy: 1.1562679709060542
Energy: 1.4512211141531166
Energy: 1.3743209514791406
Energy: 1.265328732138801
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Energy: 1.3633907558998002
Energy: 1.5845684870451753
Energy: 1.6850501738613644
Energy: 1.1454587605694093
Energy: 1.4432190229798243
Energy: 1.3678406052780117
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Energy: 1.5261825148207873
Energy: 1.369474171249193
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Energy: 1.4225311729543462
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Energy: 1.160567680485341
Energy: 1.3217400533525718
Energy: 1.2547219112953096
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Energy: 1.2581867737693064
Energy: 1.267861258392366
Energy: 1.1677251611723563
Energy: 1.6889580632711347
Energy: 1.1844558902962132
Energy: 1.1447809613014126
Energy: 1.5688052614628036
Energy: 1.5845478163450306
Energy: 1.3949944787816593
Energy: 1.208505187891514
Energy: 1.4173949653961808
Energy: 1.44662845112194
Energy: 1.2556503570764597
Energy: 1.528535117813592
Energy: 1.5633140019943308
Energy: 1.5950048562418147
Energy: 1.5855642476842224
Energy: 1.672944183744452
Energy: 1.5585025775625996
Energy: 1.4968332216142755
Energy: 1.5632404525750834
Energy: 1.4527837327468804
Energy: 1.373478136471477
Energy: 1.1453485062257232
Energy: 1.195470073777103
Energy: 1.8203197077910385
Energy: 1.482671882359873
Energy: 1.194084969338856
Energy: 1.3058768530469473
Energy: 1.2719277773667619
Energy: 1.448231285898566
Energy: 1.362306627939212
Energy: 1.5015053627008954
Energy: 1.1813839689611514
Energy: 1.223831468340759
Energy: 1.3660858867514571
Energy: 1.1983985578393073
Energy: 1.2317768906648996
Energy: 1.2237442179046139
Energy: 1.393626849263231
Energy: 1.2403237424548534
Energy: 1.619375570978473
Energy: 1.5725783012133057
Energy: 1.2083479721283596
Energy: 1.2117024892280803
Energy: 1.19474700309167
Energy: 1.1893953002089075
Energy: 1.2290666336343155
Energy: 1.2396391074994446
Energy: 1.2438211324451969
Energy: 1.3454992074050924
Energy: 1.4795143722636783
Energy: 1.4030994789975961
Energy: 1.40598247813804
Energy: 1.3589442557867109
Energy: 1.1847464937065635
Energy: 1.1920009977768553
Energy: 1.2780723920249233
Energy: 1.2361195468206352
Energy: 1.3923403456074328
Energy: 1.24610016063541
Energy: 1.3951997916823904
Energy: 1.3300765791846518
Energy: 1.4347765739399925
Energy: 1.514405140831123
Energy: 1.195962698185291
Energy: 1.5420101813142157
Energy: 1.3367065366291009
Energy: 1.4178273863758086
Energy: 1.3736680850984655
Energy: 1.184104216784478
Energy: 1.2663288048996684
Energy: 1.5617532403810968
Energy: 1.3517696512505468
Energy: 1.4049876650461737
Energy: 1.4222962266875026

minimum gb energy = 1.1432013602120745 eV
minimum distance =  2.27059710413503 Angstroms
sigma value = 185


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

Energy: 3.20733874210553
Energy: 1.170625228569351
Energy: 1.6947402921954853
Energy: 1.3236888259344821
Energy: 1.3159423087275999
Energy: 1.4895196979451026
Energy: 1.435556937372961
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Energy: 1.2501644036213257
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Energy: 1.241350275571689
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Energy: 1.3299667952815883
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Energy: 1.1938439432962409
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Energy: 1.2756656681411402
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Energy: 1.4960570344422963
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Energy: 1.2292385628005484
Energy: 1.3852333880173815
Energy: 1.5242270989296056
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Energy: 1.3150090981673364
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Energy: 1.5020524880728645
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Energy: 1.3603100396096934
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Energy: 1.3662789263224482
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Energy: 1.3808715440663606
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Energy: 1.4055499389629784
Energy: 1.3208032413598554
Energy: 1.4276208249781492
Energy: 1.3658607147546227
Energy: 1.1890927518636243
Energy: 1.3954993927967032
Energy: 1.328646342973456
Energy: 1.3713685173465762
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Energy: 1.3426746276785313
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Energy: 1.452360977410489
Energy: 1.4318376151445051
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Energy: 1.4493297945240984
Energy: 1.3632795115215945
Energy: 1.2373595124266823
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Energy: 1.381530978523529
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Energy: 1.3135135049856723
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Energy: 1.3892171252585694
Energy: 1.4728267973560034
Energy: 1.5477863979950475
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Energy: 1.4209970809056667
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Energy: 1.3482650254374875
Energy: 1.2703349686825802
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Energy: 1.3052355599156082
Energy: 1.3070665632289653
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Energy: 1.4699665171906555
Energy: 1.217056627729766
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Energy: 1.3706420586937538
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Energy: 1.2272673333908382
Energy: 1.1970079140121455
Energy: 1.3873133082518818
Energy: 1.4549503227146443
Energy: 1.4270961314692951
Energy: 1.2486589600610576
Energy: 1.179712001901512
Energy: 1.1889966489732746
Energy: 1.2299975290964729
Energy: 1.47349778332431
Energy: 1.3861367215829463
Energy: 1.329705345004087
Energy: 1.494645584364788
Energy: 1.4857508420454322
Energy: 1.4166826978068026
Energy: 1.388948509176078
Energy: 1.363913731614166
Energy: 1.363842690423884
Energy: 1.5916774758728611
Energy: 1.4202413996517436
Energy: 1.3375366059504474
Energy: 1.4171316941577583
Energy: 1.390711830284718
Energy: 1.4462711952374319
Energy: 1.4366438148170126
Energy: 1.1929511791075498
Energy: 1.2725018537655925
Energy: 1.3638222766843593
Energy: 1.4675388603150556
Energy: 1.3580624337349663
Energy: 1.2997795139776471
Energy: 1.3999939548784834
Energy: 1.200743743245248
Energy: 1.5194888342916861
Energy: 1.2191686740487788
Energy: 1.2007101342048072
Energy: 1.2587637235341913
Energy: 1.254833321315464
Energy: 1.266802794835546
Energy: 1.2687744248188482
Energy: 1.33534359360751
Energy: 1.5220573413913832
Energy: 1.4460945022334615
Energy: 1.4757503879276241
Energy: 1.3392877657060238
Energy: 1.3399589120535844
Energy: 1.3449095297634217
Energy: 1.3983915946322012
Energy: 1.2714778676583305
Energy: 1.2984238931322463
Energy: 1.2672862612343003
Energy: 1.5277582118010864
Energy: 1.4827143546550603
Energy: 1.4559600721096866
Energy: 1.3790117960056587
Energy: 1.3197406719221898
Energy: 1.5185585925671188
Energy: 1.4919415127276696
Energy: 1.3164296914283595
Energy: 1.2896526333534513
Energy: 1.3035543047928326
Energy: 1.4745766784464305
Energy: 1.3400627782015444
Energy: 1.2734734093095914
Energy: 1.1894644376054893

minimum gb energy = 1.1684257211071845 eV
minimum distance =  2.23482651684675 Angstroms
sigma value = 33


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

Energy: 2.517972038320824
Energy: 1.3639694172735
Energy: 1.3605826021995246
Energy: 1.24194904527613
Energy: 1.333460904157905
Energy: 1.4220151263956382
Energy: 1.4005074316774688
Energy: 1.4421048450266631
Energy: 1.3488813005943907
Energy: 1.298538086909888
Energy: 1.2288483127609215
Energy: 1.4248166985162711
Energy: 1.3555454159866744
Energy: 1.2510204476436253
Energy: 1.2539388662674804
Energy: 1.357878542607687
Energy: 1.4784214024575533
Energy: 1.311016030978134
Energy: 1.2093031978630533
Energy: 1.230012134183553
Energy: 1.253936798995811
Energy: 1.5400644736940734
Energy: 1.3350549070332076
Energy: 1.344663854891204
Energy: 1.4994021407371299
Energy: 1.3303436914176563
Energy: 1.2708764192815518
Energy: 1.20745531397206
Energy: 1.2461071594076782
Energy: 1.260213759000539
Energy: 1.2100749101573764
Energy: 1.2454194844793958
Energy: 1.4315300930557608
Energy: 1.2292431332545228
Energy: 1.219355350735516
Energy: 1.334992119128421
Energy: 1.3371795814112877
Energy: 1.5015739772242829
Energy: 1.2415706445940033
Energy: 1.2794085923684255
Energy: 1.2038507386256314
Energy: 1.465594172905244
Energy: 1.265410360030227
Energy: 1.2691506103503214
Energy: 1.2928614263255218
Energy: 1.4011000531718771
Energy: 1.4498766554010294
Energy: 1.5097935599444396
Energy: 1.2306129322784825
Energy: 1.2092675325521385
Energy: 1.334171214946997
Energy: 1.328734651805763
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Energy: 1.4489079837295373
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Energy: 1.3746256018767353
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Energy: 1.2419553976183775
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Energy: 1.354710630020309
Energy: 1.3340016528507366
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Energy: 1.5306950689637167
Energy: 1.3403639645112897
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Energy: 1.208742837192076
Energy: 1.2999174243974705
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Energy: 1.410001364988147
Energy: 1.4245599753087699
Energy: 1.3224383712689938
Energy: 1.2260447627004243
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Energy: 1.3401029425293278
Energy: 1.2430884923543362
Energy: 1.2510098122832833
Energy: 1.2355588170338847
Energy: 1.2438215246379876
Energy: 1.3769035501229603
Energy: 1.2470567063181652
Energy: 1.3608753639239553
Energy: 1.160691830143984
Energy: 1.1969694958592738
Energy: 1.4452188524471705
Energy: 1.208815022162648
Energy: 1.3474809199533764
Energy: 1.2461083563382092
Energy: 1.2175161483307901
Energy: 1.4770653764809358
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Energy: 1.3395185254528397
Energy: 1.283344094347916
Energy: 1.2806782267275472
Energy: 1.4034330921350622
Energy: 1.3829632232100368
Energy: 1.3077643371139278
Energy: 1.4304000883447596
Energy: 1.403763204396172
Energy: 1.4747162692669762
Energy: 1.3669717556383807
Energy: 1.2176902612652405
Energy: 1.214152857987641
Energy: 1.4915769539850998
Energy: 1.377572560636479
Energy: 1.247277028666422
Energy: 1.2636076066680157
Energy: 1.3258318785129013
Energy: 1.333710141812019
Energy: 1.4839076537938525
Energy: 1.2438163791245977
Energy: 1.2095244068296753
Energy: 1.2987587444367408
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Energy: 1.3395979308052681
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Energy: 1.478752097324081
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Energy: 1.2131273984233237
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Energy: 1.2450448411254595
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Energy: 1.2470862789125552
Energy: 1.2207683548035206
Energy: 1.5753657753655566
Energy: 1.4126109812562049
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Energy: 1.27991107531457
Energy: 1.2250291528291053
Energy: 1.2108813335050372
Energy: 1.3991923976893168
Energy: 1.2388831060375805
Energy: 1.2456621991150632
Energy: 1.2496261390553955
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Energy: 1.214318931057207
Energy: 1.2954863542717678
Energy: 1.3086906826006628
Energy: 1.5977420301508038
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Energy: 1.315403483701551
Energy: 1.397645913801017
Energy: 1.3222006882926
Energy: 1.4202902097949548
Energy: 1.2665270445770802

minimum gb energy = 1.160691830143984 eV
minimum distance =  2.24945976698885 Angstroms
sigma value = 219


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

Energy: 2.2776247246628114
Energy: 1.1434754670507175
Energy: 1.1990566229184187
Energy: 1.1781094187606562
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Energy: 1.1684233812202693
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Energy: 1.1811190403917522
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Energy: 1.1769809191377747
Energy: 1.224669430054707
Energy: 1.1718579468304533
Energy: 1.1321515817741559
Energy: 1.213669245303581
Energy: 1.2156718876094113
Energy: 1.2220686805806102
Energy: 1.1659833707199827
Energy: 1.284585132109256
Energy: 1.1500625863653022
Energy: 1.2248004854985957
Energy: 1.209023398699439
Energy: 1.1582748374300889
Energy: 1.2151066127389276
Energy: 1.1554232992666027
Energy: 1.1223540917477546
Energy: 1.1224287355693305
Energy: 1.1726231086164502
Energy: 1.2008445185221155

minimum gb energy = 1.1223540917477546 eV
minimum distance =  2.26723530387355 Angstroms
sigma value = 15


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

Energy: 2.1824533755897852
Energy: 1.5369680556722236
Energy: 1.4875222328768016
Energy: 1.350956593381249
Energy: 1.4006020048723196
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Energy: 1.458717729567691
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Energy: 1.3665630893497875
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Energy: 1.450799352044154
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Energy: 1.483698087446412
Energy: 1.4444806184782724
Energy: 1.4021159312179612
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Energy: 1.5074185570717147
Energy: 1.5188319010511548
Energy: 1.358877714772213
Energy: 1.4167728732974696
Energy: 1.3936824072023044
Energy: 1.4571271211923396
Energy: 1.3849288469306893
Energy: 1.4413072886168286
Energy: 1.460787134448369
Energy: 1.5048309633888763
Energy: 1.5331123239339235
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minimum gb energy = 1.334036359782137 eV
minimum distance =  2.26691586693213 Angstroms
sigma value = 293


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

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Energy: 1.5052825435776152
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Energy: 1.4781630085213497
Energy: 1.4647585632473479
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Energy: 1.4973663297689908
Energy: 1.4353358045709608
Energy: 1.5056547347695737
Energy: 1.4965632027733555
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Energy: 1.4550070719532433
Energy: 1.4890843555672852
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Energy: 1.4546025263228965
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Energy: 1.6837680688958785
Energy: 1.4830078218869556
Energy: 1.4632755948641605
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Energy: 1.3912176783087784
Energy: 1.4543468491459572
Energy: 1.374780373256361
Energy: 1.4665472456677033
Energy: 1.59263710133481
Energy: 1.381032337631159
Energy: 1.5317003146111747
Energy: 1.4636022549792873
Energy: 1.4537042977689612
Energy: 1.473184524582841
Energy: 1.4894938198177199
Energy: 1.5269112054782736
Energy: 1.5695536456718027
Energy: 1.3823451438696144
Energy: 1.3803752072144473
Energy: 1.4088539338697776
Energy: 1.3672005877128814
Energy: 1.4949725043821827
Energy: 1.450636042875044
Energy: 1.5179506133307956
Energy: 1.6173758420443052
Energy: 1.5855925960556463
Energy: 1.4637715957278725
Energy: 1.3712762472041649
Energy: 1.3469788440496349
Energy: 1.423431768771489
Energy: 1.3662509987744422
Energy: 1.4350189709696928
Energy: 1.4587126344569694
Energy: 1.5091921718134864
Energy: 1.4683455515464288
Energy: 1.5902580280028389
Energy: 1.5093684817438506
Energy: 1.5569518250198964
Energy: 1.4462492409752516
Energy: 1.3402606002387656
Energy: 1.3391531440540083
Energy: 1.4990208487376162
Energy: 1.4600352747613279
Energy: 1.4062023480290964
Energy: 1.4477321148197346

minimum gb energy = 1.3254620265240944 eV
minimum distance =  2.26189411584731 Angstroms
sigma value = 293


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

Energy: 1.7896304314546503
Energy: 1.436033098444924
Energy: 1.2748416816205335
Energy: 1.5020329006785829
Energy: 1.2886247586305302
Energy: 1.4558397170642285
Energy: 1.2615671710746559
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Energy: 1.3768575315969214
Energy: 1.497612961803636
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Energy: 1.2579653020598551
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Energy: 1.3406791785555365
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Energy: 1.1518658718189883
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Energy: 1.2262052363428844
Energy: 1.7522286214958962
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Energy: 1.424110036916413
Energy: 1.1613245825463585
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Energy: 1.23697703898615
Energy: 1.2576485756722755
Energy: 1.2163755720998728
Energy: 1.5569043207253066
Energy: 1.4901373618583313
Energy: 1.2382325191174874
Energy: 1.378445482187942
Energy: 1.393591869749049
Energy: 1.2523411926145054
Energy: 1.2556889021842172
Energy: 1.371677744752871
Energy: 1.5554393820710075
Energy: 1.1569391713465895
Energy: 1.2674894810617607
Energy: 1.2754304750100043
Energy: 1.4754789787036247
Energy: 1.4778763466573215
Energy: 1.2563939429869988
Energy: 1.2459621235283675
Energy: 1.3748968238504118
Energy: 1.3807162410201232
Energy: 1.2573347088042215
Energy: 1.4813070725924762
Energy: 1.4820418822536292
Energy: 1.3288763413039058
Energy: 1.4410921041226066
Energy: 1.443072124448157
Energy: 1.3700924348258854
Energy: 1.2501985020118422
Energy: 1.2604205513483286
Energy: 1.2414756441522754
Energy: 1.3822475498802669
Energy: 1.3747076285069588
Energy: 1.2480404753832255
Energy: 1.2732037404869145
Energy: 1.285228458466552
Energy: 1.4805390581045377
Energy: 1.26744454732273
Energy: 1.4043201686092137
Energy: 1.3893754033997288
Energy: 1.243043350605331
Energy: 1.2565009585734206
Energy: 1.2670874593263244
Energy: 1.2280999558883774
Energy: 1.551643789355376
Energy: 1.2458476043457476
Energy: 1.2576382902998404
Energy: 1.3690350612516162
Energy: 1.2454114876589928
Energy: 1.2573592837169056
Energy: 1.2391704854226309
Energy: 1.4273291739293434
Energy: 1.3915797779067132
Energy: 1.2189590606933614
Energy: 1.2724163590773943
Energy: 1.4722398329102444
Energy: 1.253006317318455
Energy: 1.4848874893973771
Energy: 1.4733372371049132
Energy: 1.3690352224946172
Energy: 1.2437543331519807
Energy: 1.2678736328568474
Energy: 1.2731859882784826
Energy: 1.3810865326288093
Energy: 1.48591210945833
Energy: 1.262539396518024
Energy: 1.3686525100580413
Energy: 1.4766402798388814
Energy: 1.4856283876969847
Energy: 1.2704376968667639
Energy: 1.2563878732054274
Energy: 1.2451058548454836
Energy: 1.5134988567082883
Energy: 1.2680522283087499
Energy: 1.414513855266136

minimum gb energy = 1.1518658718189883 eV
minimum distance =  2.29769445348915 Angstroms
sigma value = 15


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

Energy: 2.6718783903257144
Energy: 1.3395992818730165
Energy: 1.3785133963858518
Energy: 1.3450295439990412
Energy: 1.3363906645575632
Energy: 1.417918234205732
Energy: 1.318553521259468
Energy: 1.3244096475879181
Energy: 1.3742392549717806
Energy: 1.3674834096548882
Energy: 1.362645063706063
Energy: 1.6347279812084718
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Energy: 1.4285714209552585
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Energy: 1.4141357401982237
Energy: 1.3973264135000034
Energy: 1.3326338142738001
Energy: 1.4110919814421958
Energy: 1.4508269987908329
Energy: 1.4851352684879149
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Energy: 1.4756515373050048
Energy: 1.3520818814214952
Energy: 1.461361454872762
Energy: 1.3434733605769373
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Energy: 1.3439250895190546
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Energy: 1.37260140211461
Energy: 1.3358290408587878
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Energy: 1.4366555547611075
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Energy: 1.3422123844906049
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Energy: 1.366381085294518
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Energy: 1.3825163000148966
Energy: 1.3593623252253735
Energy: 1.3729421345548376
Energy: 1.3270528253073826
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Energy: 1.3257578259850584
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Energy: 1.549561479726054
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Energy: 1.3252546651443675
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Energy: 1.3282486790894221
Energy: 1.4084109169593833
Energy: 1.3642052505038569
Energy: 1.3638631696681598
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Energy: 1.4014294367565472
Energy: 1.4398909354689462
Energy: 1.4448264929297614
Energy: 1.4962310142433868
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Energy: 1.3776550033628951
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Energy: 1.3504503077982621
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Energy: 1.4014636660053874
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Energy: 1.403947870970598
Energy: 1.4145071084158376
Energy: 1.4370472619851267
Energy: 1.3980435221349188
Energy: 1.4590658097866376
Energy: 1.3556509587570382
Energy: 1.3363785600947449
Energy: 1.4988269858500889
Energy: 1.4441753847516456
Energy: 1.3980967084429652
Energy: 1.4531630586724438
Energy: 1.440491259591537
Energy: 1.4085218417995518
Energy: 1.466002507595079
Energy: 1.5014990823076553
Energy: 1.6188932999321268
Energy: 1.5224164342487245
Energy: 1.4242222943523182
Energy: 1.3223435291423418
Energy: 1.4440906986909392
Energy: 1.400113591375951
Energy: 1.3222297571491413
Energy: 1.3404544467502828
Energy: 1.3601004027824926
Energy: 1.497803533593118
Energy: 1.4506511861849707
Energy: 1.3283370172224536
Energy: 1.3653290858935578
Energy: 1.3542410131841096
Energy: 1.417634123829607
Energy: 1.4638754371121667
Energy: 1.3224964755446822
Energy: 1.3699496769260993
Energy: 1.4558947786105474
Energy: 1.3310424028891585
Energy: 1.3201194087249721
Energy: 1.3596868961163069
Energy: 1.3790719457562959
Energy: 1.3608996269713114
Energy: 1.4490195757030924
Energy: 1.399293256466691
Energy: 1.4409250560681364
Energy: 1.4537835283792933
Energy: 1.337357088487575
Energy: 1.3320443114356022
Energy: 1.301522030798933
Energy: 1.345101903028942
Energy: 1.3681974371830512
Energy: 1.3248400211656055
Energy: 1.4533100380513277
Energy: 1.6721144806349417
Energy: 1.4011586354311618
Energy: 1.432032742573573
Energy: 1.3450849133076321
Energy: 1.3366543147532364
Energy: 1.320693663792022
Energy: 1.5631609240199846
Energy: 1.3741687607905844
Energy: 1.347789261047682
Energy: 1.392655070119067
Energy: 1.338218044475695
Energy: 1.354708010745564
Energy: 1.3315674699273305
Energy: 1.493551899288322
Energy: 1.5729134734787311
Energy: 1.3191998025226763
Energy: 1.3555813420835239
Energy: 1.3390612318891368
Energy: 1.3164906737583555
Energy: 1.358937302676881
Energy: 1.4341583058148266
Energy: 1.4336690165339683
Energy: 1.6919232308109335
Energy: 1.348234267084844
Energy: 1.362976665597482
Energy: 1.3274121208788154
Energy: 1.357460169921192
Energy: 1.4581849117463268
Energy: 1.3404774411744866
Energy: 1.4160778609143156
Energy: 1.432754878891612
Energy: 1.4632635035742423
Energy: 1.4854629225632332
Energy: 1.4935042694848095
Energy: 1.3460559488885477
Energy: 1.4362936224943132
Energy: 1.349337997234606
Energy: 1.4063617875112833
Energy: 1.3242206102866123
Energy: 1.5174834256079293
Energy: 1.5385507220853791
Energy: 1.4379416722729397
Energy: 1.449444233374717
Energy: 1.4979789734821203
Energy: 1.3359575800914922
Energy: 1.3427919736793545
Energy: 1.3499146193778526
Energy: 1.4949092280080718
Energy: 1.4406033400505736
Energy: 1.466051959986002
Energy: 1.3812616754701887
Energy: 1.3500541407116058
Energy: 1.4030368380631861
Energy: 1.3864144206104492
Energy: 1.4713782147698868
Energy: 1.486215559800821
Energy: 1.3435201200336537
Energy: 1.3989285434857468
Energy: 1.3471015660762078
Energy: 1.4577687099269154
Energy: 1.4524601021483508
Energy: 1.4639815161203515
Energy: 1.431093427044996
Energy: 1.3351797213030296
Energy: 1.478955007738079
Energy: 1.4264468842458007
Energy: 1.3842854043455728
Energy: 1.492670895418313
Energy: 1.502713206657902
Energy: 1.3550764121934236
Energy: 1.5038130582364138
Energy: 1.3626208095853756
Energy: 1.367081014653216
Energy: 1.3398553378390894
Energy: 1.337966546751064
Energy: 1.4744802854236994
Energy: 1.4640166661181477
Energy: 1.375554023837718
Energy: 1.3469932270080915
Energy: 1.3839721269952079
Energy: 1.338150489794771
Energy: 1.479960478219651
Energy: 1.346079881409633
Energy: 1.4926655196307947
Energy: 1.5043405967896086
Energy: 1.3555533769009318
Energy: 1.339066452343878
Energy: 1.4534690171433036
Energy: 1.4497920076573214
Energy: 1.4191205121019645
Energy: 1.3977595258257174
Energy: 1.3717326957196645
Energy: 1.4796423617845051
Energy: 1.3781032227329655
Energy: 1.430329160893362
Energy: 1.4010428259335295
Energy: 1.3156827509789917
Energy: 1.3510806553149193
Energy: 1.3468555335541699
Energy: 1.3428241517429735
Energy: 1.321866249002989
Energy: 1.4998308317366664
Energy: 1.4228031091576065
Energy: 1.4167271698266048
Energy: 1.3313760625456486
Energy: 1.3476467821246374
Energy: 1.339087139654091
Energy: 1.3417067832562126
Energy: 1.3865109953945087
Energy: 1.3144010711012126
Energy: 1.3208063537027535
Energy: 1.3628536268879041
Energy: 1.323324975103561

minimum gb energy = 1.3007357220606224 eV
minimum distance =  2.26100666582637 Angstroms
sigma value = 437


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

Energy: 1.8823898501687177
Energy: 1.2157798474948147
Energy: 1.2568542388978596
Energy: 1.3038918311937666
Energy: 1.3624278919757897
Energy: 1.3382374127289425
Energy: 1.407296192473837
Energy: 1.2762234646560708
Energy: 1.2158330383105338
Energy: 1.158643317208799
Energy: 1.4949622819234725
Energy: 1.2979940413145594
Energy: 1.3682879833513146
Energy: 1.433868654043389
Energy: 1.3161134883205252
Energy: 1.2113923021475212
Energy: 1.3207611305295932
Energy: 1.3366976041657144
Energy: 1.24718189972605
Energy: 1.596223279406465
Energy: 1.4870563032475426
Energy: 1.2836199398735844
Energy: 1.5859898280247744
Energy: 1.447249037031084
Energy: 1.2997019846971645
Energy: 1.2747200890148516
Energy: 1.326184454841091
Energy: 1.2821446072862228
Energy: 1.3053327500490233
Energy: 1.4753190111227532
Energy: 1.3675798070887935
Energy: 1.3150867670233122
Energy: 1.42680158645446
Energy: 1.2787813866921405
Energy: 1.3351137541406586
Energy: 1.2699228252477128
Energy: 1.2340338352647489
Energy: 1.2478128621805171
Energy: 1.5088282786905363
Energy: 1.5350452564071488
Energy: 1.3226228926047958
Energy: 1.522891867789246
Energy: 1.2945866337131402
Energy: 1.227413217671311
Energy: 1.1861930714977973
Energy: 1.2734285354081072
Energy: 1.3526360456808333
Energy: 1.3379779528207696
Energy: 1.4551716154098773
Energy: 1.3013305638066537
Energy: 1.284632657676445
Energy: 1.429210600366523
Energy: 1.2857015768610607
Energy: 1.454963188317959
Energy: 1.3766083336591415
Energy: 1.2684639890368359
Energy: 1.2726351008625258
Energy: 1.2669706550882296
Energy: 1.4538707570263527
Energy: 1.2823632283299016
Energy: 1.7263303670880086
Energy: 1.3309268285168105
Energy: 1.3018869505444193
Energy: 1.2991998988151907
Energy: 1.4189966147192754
Energy: 1.2817418260117988
Energy: 1.4758864928974107
Energy: 1.4811484877031964
Energy: 1.3717351676617966
Energy: 1.241075309599626
Energy: 1.6287041073294335
Energy: 1.2213006530127795
Energy: 1.2166646043718414
Energy: 1.297014042003734
Energy: 1.3799729439277992
Energy: 1.2539326816215326
Energy: 1.279408392407137
Energy: 1.279844313937952
Energy: 1.3598590332463445
Energy: 1.4178916114340847
Energy: 1.4459766794358349
Energy: 1.2881859613208955
Energy: 1.3709299429726762
Energy: 1.4368752027946596
Energy: 1.3297942304499948
Energy: 1.2502155888575062
Energy: 1.3410065348715468
Energy: 1.3345789446406222
Energy: 1.305922865461106
Energy: 1.591794963239046
Energy: 1.3828293256160524
Energy: 1.30120778075239
Energy: 1.4647010087479961
Energy: 1.2860387548069006
Energy: 1.2374886700974108
Energy: 1.346452813637951
Energy: 1.2133781685128888
Energy: 1.2260356676391755
Energy: 1.2711591231076929
Energy: 1.5661114273767858
Energy: 1.245709728748037
Energy: 1.3301752753198939
Energy: 1.4207616041346218
Energy: 1.2199781971843904
Energy: 1.3710992937774023
Energy: 1.2766826500383002
Energy: 1.4249174679893402
Energy: 1.3604114687626758
Energy: 1.2708972271596166
Energy: 1.2410451488330587
Energy: 1.3017201569059924
Energy: 1.3387578662362158
Energy: 1.2983001888963877
Energy: 1.4385386859547156
Energy: 1.3695912219786168
Energy: 1.2757025439582637
Energy: 1.2754540728709256
Energy: 1.3025734904807902
Energy: 1.4472340886113388
Energy: 1.2910102710267322
Energy: 1.2992944270544746
Energy: 1.5756416751318303
Energy: 1.2868997951472947
Energy: 1.4448306230116648
Energy: 1.3785560044325682
Energy: 1.2724706088263615
Energy: 1.2789941228150812
Energy: 1.2851113387810114
Energy: 1.477196382803187
Energy: 1.312720178379382
Energy: 1.6408033099486954
Energy: 1.2611091582475882
Energy: 1.3330618543420585
Energy: 1.3037797684374768
Energy: 1.4287651191370119
Energy: 1.2556715928314823
Energy: 1.4200185481202938
Energy: 1.2731517916661825
Energy: 1.2224434533149993
Energy: 1.1589479519534949

minimum gb energy = 1.158643317208799 eV
minimum distance =  2.29409399304651 Angstroms
sigma value = 33