Model name: model_name=MEAM_LAMMPS_KoLee_2013_VPdY__MO_046547823135_002
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Pd
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.889087237417698
cohesive_energy=3.910307542081986
mass=106.42
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.4797334890998178e-19, 2.1216824075744998e-19, 2.63700650013426e-19, 3.0766918338028797e-19, 3.4625920978681194e-19, 3.8065633994215797e-19, 4.1158796203816196e-19, 4.39537933418292e-19, 4.6485392641212595e-19, 4.87793891457738e-19, 5.08556498457744e-19, 5.272987607222759e-19, 5.4414725020542e-19, 5.59209312741654e-19, 5.72574670222482e-19, 5.843202271263359e-19, 5.94510070518576e-19, 6.032034809346599e-19, 6.10451728026876e-19, 6.162996727409759e-19, 6.2078736949281e-19, 6.23953270521594e-19, 6.258310215366419e-19, 6.264510638939999e-19, 6.257717410011839e-19, 6.235495220098259e-19, 6.19454358533322e-19, 6.13092115119708e-19, 6.03978934425516e-19, 5.91518806742898e-19, 5.749763329968479e-19, 5.5343987468262e-19, 5.25768682036806e-19, 4.905272047953419e-19, 4.45898574655272e-19, 3.8956123767392994e-19, 3.1852072572237e-19, 2.2887734087343597e-19, 1.155068415986058e-19, -2.84163649982874e-20, -2.12107358045358e-19, -4.48165654592382e-19, -7.54146143800434e-19, -1.154927424442266e-18, -1.6865312337801e-18, -2.40241579738398e-18, -3.3841174863347997e-18, -4.7601468884456995e-18, -6.741094100489639e-18, -9.688314040498979e-18, -1.425844278015228e-17, -2.17332056048832e-17, -3.4857755937620996e-17, -6.030048110320439e-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: 0.013031028796230705
Energy: 0.898923815296865
Energy: 0.8991262536720244
Energy: 0.01328772269349278
Energy: 0.9047367306319785
Energy: 0.01348972905923409
Energy: 0.8989238152973769
Energy: 0.9513502996457996
Energy: 0.5045129138848715
Energy: 0.5045435444739952
Energy: 0.9369956361506253
Energy: 0.5021731850458903
Energy: 0.8991262536712414
Energy: 0.5045129138846005
Energy: 0.09754830232948553
Energy: 0.8995153814570187
Energy: 0.5036500775834561
Energy: 0.5023307344530303
Energy: 0.013287722694004597
Energy: 0.5045435444737243
Energy: 0.8995153814578316
Energy: 0.013293598925566702
Energy: 0.5027970236854796
Energy: 0.013525745599036403
Energy: 0.904736730642305
Energy: 0.9369956361519499
Energy: 0.503650077584239
Energy: 0.5027970236846668
Energy: 0.9250293636105151
Energy: 0.5055952576310654
Energy: 0.01348972905923409
Energy: 0.5021731850464022
Energy: 0.5023307344527894
Energy: 0.013525745599036403
Energy: 0.5055952576307944
Energy: 0.013816908279336721

minimum gb energy = 0.013031028796230705 eV
minimum distance =  2.74455681734761 Angstroms
sigma value = 1


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

Energy: 1.6741774421368685
Energy: 1.7324568013914032
Energy: 1.4839812777811898
Energy: 1.623252523391958
Energy: 1.9077270882140427
Energy: 1.4803159723999286
Energy: 1.7743975945603734
Energy: 1.1624831105729008
Energy: 1.1868489734581684
Energy: 1.6627397727864253
Energy: 1.1629873972080016
Energy: 1.1383835873567096
Energy: 1.6260483960934982
Energy: 1.1620860214287112
Energy: 1.1819480481524252
Energy: 1.6378475216062354
Energy: 1.2064629619798886
Energy: 1.196413343044804
Energy: 1.8085270292213327
Energy: 1.6810331351533563
Energy: 1.487180522739071
Energy: 1.8490841419678827
Energy: 1.6839332750613762
Energy: 1.6499491264983277
Energy: 1.5858368126606495
Energy: 1.2572458740723729
Energy: 1.1755318041377658
Energy: 1.5862707466598231
Energy: 1.2579905438994399
Energy: 1.1968607252853478
Energy: 1.5237144576940613
Energy: 1.2408030947887798
Energy: 1.180500370647491
Energy: 1.491471377674508
Energy: 1.2659239384530754
Energy: 1.1826937786374372
Energy: 1.5528975477576694
Energy: 1.4825745045094187
Energy: 1.3741001034729807
Energy: 1.5552455621636356
Energy: 1.4831301491006619
Energy: 1.4139005403756137
Energy: 1.5376663112461664
Energy: 1.449750619976401
Energy: 1.382356652554542
Energy: 1.539450069201394
Energy: 1.4636034572224248
Energy: 1.3631087830765571
Energy: 1.2514239906936662
Energy: 1.289426401934321
Energy: 1.1979531756366093
Energy: 1.252509625915364
Energy: 1.4878668346630275
Energy: 1.1538767986230691
Energy: 1.3217801143067225
Energy: 1.4114387576053047
Energy: 1.2381117160589925
Energy: 1.2835276148035855
Energy: 1.4484177188229574
Energy: 1.2091286641027308
Energy: 1.6869619538134868
Energy: 1.5855758970263512
Energy: 1.5411155480747514
Energy: 1.6864718321195293
Energy: 1.5874835145505546
Energy: 1.5052305482042592
Energy: 1.2014542944200914
Energy: 1.259847210508252
Energy: 1.160467158391572
Energy: 1.2017861448262854
Energy: 1.6951579779209411
Energy: 1.1417892080373218
Energy: 1.1243758283075906
Energy: 1.3299405903926793
Energy: 1.1903271349180682
Energy: 1.1241699311918347
Energy: 1.7746348019429043
Energy: 1.1723056379917804
Energy: 1.3395646500420118
Energy: 1.743240368891079
Energy: 1.5815828079622063
Energy: 1.1926149543251003
Energy: 1.753738192833574
Energy: 1.6309247850604716
Energy: 1.1675065912590992
Energy: 1.2764036051475953
Energy: 1.1604814027395647
Energy: 1.1682547325680672
Energy: 1.3366008919098373
Energy: 1.1449712946183856
Energy: 1.1740643335658996
Energy: 1.2671311090978332
Energy: 1.2113319484421299
Energy: 1.1740852219119253
Energy: 1.6121603493790433
Energy: 1.1351593460610494
Energy: 1.560308343852276
Energy: 1.5843168245772814
Energy: 1.5021140766153376
Energy: 1.5616636708999425
Energy: 1.6045999399902258
Energy: 1.5250704344844144
Energy: 1.3738606400371105
Energy: 1.4487973776403333
Energy: 1.2817784150926896
Energy: 1.3753043661287967
Energy: 1.4484114191364321
Energy: 1.2781837479494875
Energy: 1.3949144774506348
Energy: 1.3528727619659555
Energy: 1.2097374985174725
Energy: 1.4407661782495247
Energy: 1.421787816629497
Energy: 1.1578620270781095
Energy: 1.5534641650831815
Energy: 1.3856506389625836
Energy: 1.3281675772435648
Energy: 1.5531343600564742
Energy: 1.4373973171176033
Energy: 1.2801816445367664
Energy: 1.621366924039459
Energy: 1.5589568867222416
Energy: 1.410261780945092
Energy: 1.6232857062996608
Energy: 1.5614316109415893
Energy: 1.5083924311349435
Energy: 1.5199960466004259
Energy: 1.1332547684933554
Energy: 1.1455447724621877
Energy: 1.5555537350179787
Energy: 1.1760672691942213
Energy: 1.1754715239316202
Energy: 1.774259271196581
Energy: 1.216147651161644
Energy: 1.2448944504709052
Energy: 1.755885056752607
Energy: 1.216048187711446
Energy: 1.1305818608848601

minimum gb energy = 1.1241699311918347 eV
minimum distance =  2.51319583572012 Angstroms
sigma value = 33


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

Energy: 1.834456527077538
Energy: 1.4835783966564984
Energy: 1.4434849926119455
Energy: 1.778807753743997
Energy: 1.743717583284888
Energy: 1.4525140603836053
Energy: 1.6393743681632036
Energy: 1.203610161006457
Energy: 1.0649743359176105
Energy: 1.5663962408798395
Energy: 1.201790859435393
Energy: 1.1205779493950265
Energy: 1.6762879243340099
Energy: 1.0913369895143945
Energy: 1.2623520058630968
Energy: 1.63487779856993
Energy: 1.2058837726869667
Energy: 1.2930586337640113
Energy: 1.563727085979439
Energy: 1.8177928229747968
Energy: 1.8023928277265713
Energy: 1.5642150543559603
Energy: 1.8665821340496587
Energy: 1.4006900464978003
Energy: 1.5556022781168146
Energy: 1.3053093241171563
Energy: 1.3656622391406261
Energy: 1.5844332522722433
Energy: 1.3251828459934276
Energy: 1.368664275345396
Energy: 1.5795095482174706
Energy: 1.2498301169579542
Energy: 1.2728763237829885
Energy: 1.5747962920408112
Energy: 1.26303097763869
Energy: 1.235804269396554
Energy: 1.586630667980284
Energy: 1.4871578989779557
Energy: 1.4775211726015929
Energy: 1.5863424723817292
Energy: 1.5784916546587844
Energy: 1.4803054208292241
Energy: 1.63711747672216
Energy: 1.21327569086821
Energy: 1.2407874040847737
Energy: 1.621290024737224
Energy: 1.2126974110891724
Energy: 1.2529354407379623
Energy: 1.2399438835898347
Energy: 1.4573851435443506
Energy: 1.2893359759230458
Energy: 1.241182982077914
Energy: 1.4183265800690075
Energy: 1.2812157149446304
Energy: 1.321971883506942
Energy: 1.3246015173049561
Energy: 1.3255763713608582
Energy: 1.3239264612559358
Energy: 1.5842685603540365
Energy: 1.213939378548827
Energy: 1.5979749646481158
Energy: 1.589710096471083
Energy: 1.592680563386912
Energy: 1.5530602027133233
Energy: 1.7689015198260838
Energy: 1.495151441072643
Energy: 1.2307931812483774
Energy: 1.3503428202575292
Energy: 1.2229972270529132
Energy: 1.2317498634968673
Energy: 1.6246371312633203
Energy: 1.1308487725486633
Energy: 1.2092131300861135
Energy: 1.393398238442344
Energy: 1.348619879420906
Energy: 1.2082474146741746
Energy: 1.5521455340855
Energy: 1.2874638051191154
Energy: 1.8752286357091825
Energy: 1.5641312664712603
Energy: 1.3401319561216856
Energy: 1.873538605290601
Energy: 1.5649717050996532
Energy: 1.3999315667487946
Energy: 1.33309010138486
Energy: 1.3985645987989628
Energy: 1.3756390213663292
Energy: 1.3258499919966518
Energy: 1.5710228943310578
Energy: 1.3633191096508235
Energy: 1.276836366798766
Energy: 1.4622215746689429
Energy: 1.4209370487395658
Energy: 1.2660671576819817
Energy: 1.572786426618088
Energy: 1.2553615680899157
Energy: 1.5181421531177557
Energy: 1.5217388272198693
Energy: 1.5385630023604167
Energy: 1.5467361770579044
Energy: 1.5796889592008663
Energy: 1.4785080652513454
Energy: 1.2131780321944963
Energy: 1.3715374521004797
Energy: 1.345514645119006
Energy: 1.213403557954066
Energy: 1.573858922802538
Energy: 1.2613976041582438
Energy: 1.2860824932873858
Energy: 1.2998737224450025
Energy: 1.2669643666952515
Energy: 1.2897270281043502
Energy: 1.2420071804192527
Energy: 1.2643894128529323
Energy: 1.6287860349347298
Energy: 1.1755514863006469
Energy: 1.2283616947234095
Energy: 1.5795778634116802
Energy: 1.1733857184597283
Energy: 1.2543303319928372
Energy: 1.760183221448454
Energy: 1.563575531279621
Energy: 1.4946359641669986
Energy: 1.7628165968428822
Energy: 1.562349164844034
Energy: 1.4231501411786867
Energy: 1.657686073266072
Energy: 1.2860316368356977
Energy: 1.2295843227902068
Energy: 1.6744194044430352
Energy: 1.2866770205224456
Energy: 1.144136114979707
Energy: 1.6547788576249927
Energy: 1.2080106235984085
Energy: 1.282611881686688
Energy: 1.61066794875205
Energy: 1.2081406321595223
Energy: 1.2889499517906942
Energy: 1.5618041916238286
Energy: 1.8112374087029461
Energy: 1.8084247006369996
Energy: 1.5628877550115163
Energy: 1.769519152804
Energy: 1.336383405108927
Energy: 1.6505609302244555
Energy: 1.3069024188240521
Energy: 1.3651839023407568
Energy: 1.6073526112383256
Energy: 1.3288036340277039
Energy: 1.3765117617566258
Energy: 1.5200892291310344
Energy: 1.247508902511422
Energy: 1.2586937502019502
Energy: 1.512649669487151
Energy: 1.2644545720555909
Energy: 1.2381324555600688
Energy: 1.5405919124628762
Energy: 1.4829460101426704
Energy: 1.4662200908812946
Energy: 1.5302089430829329
Energy: 1.539273813070055
Energy: 1.478199860227637
Energy: 1.5687545865389798
Energy: 1.3113018574294493
Energy: 1.2462949875126732
Energy: 1.5671095446747005
Energy: 1.2133084688645521
Energy: 1.3491303157835555
Energy: 1.2896896612653246
Energy: 1.3441105928315182
Energy: 1.273562396756213
Energy: 1.2408118790882914
Energy: 1.2863520226001888
Energy: 1.2689337261631515
Energy: 1.1648879109559869
Energy: 1.331203242147885
Energy: 1.3322980239214375
Energy: 1.1701044511453849
Energy: 1.597774055302612
Energy: 1.2449444204947235
Energy: 1.654471385859299
Energy: 1.6846838458684892
Energy: 1.6845643633166452
Energy: 1.5959044184019506
Energy: 1.8804912829859266
Energy: 1.5134620429845766
Energy: 1.286472801125827
Energy: 1.5714926621243621
Energy: 1.3219850688986179
Energy: 1.2309926523734258
Energy: 1.6735667809456376
Energy: 1.240798439453788
Energy: 1.2059699506416792
Energy: 1.3735631349763386
Energy: 1.3606864427780259
Energy: 1.20756840891787
Energy: 1.591341807098343
Energy: 1.3000849363302855
Energy: 1.7705875812422256
Energy: 1.5665733108083222
Energy: 1.326080772375155
Energy: 1.7540495068563549
Energy: 1.5646391999858835
Energy: 1.3835521422030301
Energy: 1.3345098944814822
Energy: 1.394751690531272
Energy: 1.368274442095743
Energy: 1.3244593992935216
Energy: 1.518547095917053
Energy: 1.3741732875202526
Energy: 1.2694669694399945
Energy: 1.4081615335582311
Energy: 1.1768389622022044
Energy: 1.2613241788837803
Energy: 1.5078403601404444
Energy: 1.229906510006285
Energy: 1.5889684817937781
Energy: 1.429462186157122
Energy: 1.4268217299926524
Energy: 1.504494826317629
Energy: 1.5282309368410036
Energy: 1.4454551286668436
Energy: 1.4954590184455947
Energy: 1.3126482230740915
Energy: 1.359405991901999
Energy: 1.4573841696929526
Energy: 1.5465310671709567
Energy: 1.3546466078000199
Energy: 1.2890036560003042
Energy: 1.3148562236304524
Energy: 1.2441724638015983
Energy: 1.2899926368045573
Energy: 1.3171129404345294
Energy: 1.3031348100475035
Energy: 1.62876740891445
Energy: 1.1622392223109168
Energy: 1.225320431609649
Energy: 1.5206433413085554
Energy: 1.1172284021513545
Energy: 1.2253148097896736
Energy: 1.8426736868347813
Energy: 1.3426396488491399
Energy: 1.5054401087736404
Energy: 1.7732748511163308
Energy: 1.343429271040493
Energy: 1.5827569754843342

minimum gb energy = 1.0649743359176105 eV
minimum distance =  2.47145197800204 Angstroms
sigma value = 51


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

Energy: 1.6835866600696594
Energy: 1.7299448839798737
Energy: 1.7075674693130078
Energy: 1.6847134436749303
Energy: 1.9450000678889274
Energy: 1.4061466506489553
Energy: 1.5785587894318005
Energy: 1.1880602404273701
Energy: 1.1880403797794048
Energy: 1.567330765641356
Energy: 1.188704299343
Energy: 1.2908027708616865
Energy: 1.634278223130347
Energy: 1.1230110910013655
Energy: 1.1677686152186137
Energy: 1.6590173704073097
Energy: 1.2388884544736167
Energy: 1.189582517653988
Energy: 1.4908992490707222
Energy: 1.6845240198559377
Energy: 1.646333800750381
Energy: 1.4915361091125363
Energy: 1.6841653505813021
Energy: 1.3504154793324425
Energy: 1.5294364011696364
Energy: 1.3301112582431303
Energy: 1.3590060760361735
Energy: 1.5376622342830466
Energy: 1.3458775352565668
Energy: 1.3592906860676817
Energy: 1.3452012032895537
Energy: 1.41231460008383
Energy: 1.2993793957301252
Energy: 1.3466635560291333
Energy: 1.3661756366284306
Energy: 1.2739596231661587
Energy: 1.2736232831019865
Energy: 1.3695335229759924
Energy: 1.3539930818809998
Energy: 1.2741656284613456
Energy: 1.4185439698130458
Energy: 1.3405001236953225
Energy: 1.584587756308222
Energy: 1.628403812068144
Energy: 1.536749388015388
Energy: 1.585135053212524
Energy: 1.723058595279092
Energy: 1.4674944397481324
Energy: 1.2226307295552266
Energy: 1.581464282555835
Energy: 1.299217141895451
Energy: 1.2256303443697427
Energy: 1.670527777092425
Energy: 1.2043389413819172
Energy: 1.1943441895989302
Energy: 1.3177789217404505
Energy: 1.1141741845425943
Energy: 1.194814650091128
Energy: 1.6007680296360245
Energy: 1.1289837081837704
Energy: 1.9107117819472426
Energy: 1.794956508441576
Energy: 1.6923584257146345
Energy: 1.8717979117690648
Energy: 1.922978275359582
Energy: 1.600199688106715
Energy: 1.2401263246083112
Energy: 1.335812637800243
Energy: 1.1793399387762626
Energy: 1.255580637887866
Energy: 1.5793470751585659
Energy: 1.1853335274178272
Energy: 1.1426976285270933
Energy: 1.4660329391022
Energy: 1.1735888233821996
Energy: 1.1440799874879024
Energy: 1.52177388723242
Energy: 1.178648590381904
Energy: 1.5712903666737021
Energy: 1.4109732732570393
Energy: 1.3375190761410072
Energy: 1.5732094446678135
Energy: 1.465375171539429
Energy: 1.3843368975806107
Energy: 1.5395304167960386
Energy: 1.4568512152797457
Energy: 1.4029765803982057
Energy: 1.4879546740443514
Energy: 1.6222118181770748
Energy: 1.401442062686283
Energy: 1.3337802828429015
Energy: 1.3283650594793452
Energy: 1.326523298824174
Energy: 1.3356150787432814
Energy: 1.355800876948064
Energy: 1.2912914715464952
Energy: 1.5810260838822061
Energy: 1.174224194899085
Energy: 1.1935389697613434
Energy: 1.4965157391871091
Energy: 1.1824727608183374
Energy: 1.2941280435736702
Energy: 1.7751201104670566
Energy: 1.3869701547511029
Energy: 1.439962368771738
Energy: 1.7765796283011024
Energy: 1.3871404567077907
Energy: 1.2963794334686336

minimum gb energy = 1.1141741845425943 eV
minimum distance =  2.52242552377789 Angstroms
sigma value = 19


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

Energy: 1.3457333858075693
Energy: 1.0740279746451924
Energy: 1.075735002876818
Energy: 1.3482552223921915
Energy: 1.8653957809216746
Energy: 1.1920799718879735
Energy: 1.4914925351013641
Energy: 1.0139434738735522
Energy: 0.9792646235275724
Energy: 1.405810367396297
Energy: 1.013605102769292
Energy: 1.352721929943835
Energy: 1.467463059978971
Energy: 1.1375093812313137
Energy: 1.1379883641009811
Energy: 1.285947002923634
Energy: 1.137547226232775
Energy: 1.1382569709245054
Energy: 1.1567982065153661
Energy: 1.5657129427623944
Energy: 1.6334403417979302
Energy: 1.1557265496105933
Energy: 1.5670079038901006
Energy: 1.6356776035402054
Energy: 1.5623486587953193
Energy: 1.3106561399570449
Energy: 1.4087346653243338
Energy: 1.5624015460993328
Energy: 1.3695782829531118
Energy: 1.409358536524982
Energy: 1.2146907075590427
Energy: 1.1220949172216075
Energy: 1.192338123157385
Energy: 1.2149197021543243
Energy: 1.0139839305547234
Energy: 1.148303968185988
Energy: 1.162928860684939
Energy: 1.5264835704384314
Energy: 1.464565547123136
Energy: 1.1621224177769025
Energy: 1.4732233909851125
Energy: 1.0918272637406246
Energy: 1.3193504923911237
Energy: 1.3506544390593365
Energy: 1.1920053315375976
Energy: 1.3194340515976257
Energy: 1.3491251595136389
Energy: 1.215312175770808
Energy: 1.0819300075045803
Energy: 1.3484179276405768
Energy: 1.139261624177768
Energy: 1.0818364536202947
Energy: 1.3487485282201326
Energy: 1.140973513278644
Energy: 1.1360506939781703
Energy: 1.4543781045614639
Energy: 1.410818544458674
Energy: 1.1378146075563487
Energy: 1.4100189855829324
Energy: 1.138536746658289
Energy: 1.5469917692778086
Energy: 1.2107747423523039
Energy: 1.194635798609877
Energy: 1.5480419664396192
Energy: 1.2094706414907535
Energy: 1.620401158393803
Energy: 1.393936329657335
Energy: 1.2184236193893943
Energy: 1.219299052655723
Energy: 1.338130987721536
Energy: 1.4098369382482112
Energy: 1.3283632803187782
Energy: 1.015278211053894
Energy: 1.2170525296570462
Energy: 1.1877985667194886
Energy: 1.0142764641888977
Energy: 1.249556640944729
Energy: 1.1869010901888137
Energy: 1.4813480455345245
Energy: 1.1607270183601035
Energy: 1.0918962421271727
Energy: 1.4826327207874261
Energy: 1.1598389475034723
Energy: 1.3522954835854417
Energy: 1.4801638200437528
Energy: 1.3198910017833252
Energy: 1.2684874330948028
Energy: 1.481799331473367
Energy: 1.3192412291743087
Energy: 1.13942760801231
Energy: 1.347812834725345
Energy: 1.0816442037195815
Energy: 1.2151419202807092
Energy: 1.3485516369299149
Energy: 1.0817869735570629
Energy: 1.1402671993731084
Energy: 1.4669043835819966
Energy: 1.0268160933598196
Energy: 1.0281650896239993
Energy: 1.451045253573551
Energy: 1.1377814497591077
Energy: 1.4967721549340194
Energy: 1.6181337327587455
Energy: 1.1375354746736273
Energy: 1.1379030361015354
Energy: 1.36444028086551
Energy: 1.1374880757769459
Energy: 1.3239518960151408
Energy: 1.3325943588437257
Energy: 1.327796767892002
Energy: 1.3278370249431464
Energy: 1.3315533676700775
Energy: 1.3384476699843868
Energy: 1.3286582147902861
Energy: 1.2497533628856
Energy: 1.0615033660032154
Energy: 1.1874831395571825
Energy: 1.2496381154466787
Energy: 0.9556363443371878
Energy: 1.187480045353059
Energy: 1.1580643126835108
Energy: 1.1913752851340977
Energy: 1.2041949458783974
Energy: 1.1595494640720667
Energy: 1.1901605824257817
Energy: 1.0919663736766616
Energy: 1.268852380018713
Energy: 1.3559719850586427
Energy: 1.487180471848082
Energy: 1.270342541787156
Energy: 1.4503139938853826
Energy: 1.227022656136125
Energy: 1.5784519686101863
Energy: 1.3508965716894408
Energy: 1.1915292770907924
Energy: 1.4395150050523482
Energy: 1.3508496801160303
Energy: 1.2148108425197357
Energy: 1.0799565016715909
Energy: 1.5370683522442816
Energy: 1.2251270228837623
Energy: 1.0136786077038453
Energy: 1.4486929494629261
Energy: 1.014378706509119
Energy: 1.137562944690627
Energy: 1.4161478665947906
Energy: 1.2976913122257445
Energy: 1.1376130371822164
Energy: 1.324505160193255
Energy: 1.1383539719818407
Energy: 1.5606810072423414
Energy: 1.1550455739429484
Energy: 1.195360201160117
Energy: 1.5619740862502691
Energy: 1.1559994518710919
Energy: 1.6308343724888488
Energy: 1.367762765760436
Energy: 1.409010264476686
Energy: 1.4094091999628158
Energy: 1.3693570190934494
Energy: 1.4215261562046317
Energy: 1.4095641823226848
Energy: 1.0137559542255437
Energy: 1.2167620841471818
Energy: 1.1753267978324802
Energy: 1.0152453085420325
Energy: 1.2157895483578762
Energy: 1.147592642462823
Energy: 1.48237008151835
Energy: 1.1600571552840593
Energy: 1.0917652856344873
Energy: 1.473097837648147
Energy: 1.1593155985291317
Energy: 1.3532203521506834
Energy: 1.3476591123005754
Energy: 1.3194581783214474
Energy: 1.2920254223956724
Energy: 1.3484407930771931
Energy: 1.319350769762805
Energy: 1.214787916533881

minimum gb energy = 0.9556363443371878 eV
minimum distance =  2.48250646438501 Angstroms
sigma value = 27


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

Energy: 1.2572050440274096
Energy: 1.4409110457386918
Energy: 1.4424490358161968
Energy: 1.1440404996145497
Energy: 1.837405274969105
Energy: 1.562874420957171
Energy: 1.5685182855098736
Energy: 1.1885057118854467
Energy: 1.1885464250523174
Energy: 1.544392522102468
Energy: 1.1892435012041835
Energy: 1.3100569388855243
Energy: 1.566668426667022
Energy: 1.030047717493456
Energy: 1.0301462559087333
Energy: 1.5676872413713214
Energy: 1.0310090022018943
Energy: 1.1549319516991263
Energy: 1.495998987247718
Energy: 1.2057670907624756
Energy: 1.4300965375355774
Energy: 1.5804530194411825
Energy: 1.2058703895956773
Energy: 1.32324089335999
Energy: 1.449427073223397
Energy: 1.3648814044428987
Energy: 1.4423603304641495
Energy: 1.4048067196147083
Energy: 1.3651206363987396
Energy: 1.4017487081416202
Energy: 1.139680559591857
Energy: 1.06636589592287
Energy: 1.1361318266914233
Energy: 1.063837170742495
Energy: 1.145724153556753
Energy: 1.3256509950991842
Energy: 1.1787639949295712
Energy: 1.094392161410707
Energy: 1.3776891817448078
Energy: 1.1800926081549346
Energy: 1.550032957509809
Energy: 1.2359775548944738
Energy: 1.3945712162277735
Energy: 1.3856853094225379
Energy: 1.4510115895119418
Energy: 1.1806324382435738
Energy: 1.5209824427221603
Energy: 1.4828288617566245
Energy: 1.5703783680046752
Energy: 1.5295571601758877
Energy: 1.5848023875652602
Energy: 1.5223905151843309
Energy: 1.706158491984496
Energy: 1.5593524404433625
Energy: 1.0639988457041574
Energy: 1.0747131312319214
Energy: 1.1608477523568927
Energy: 1.0638344049831756
Energy: 1.2763001347442882
Energy: 1.0549649770180591
Energy: 1.2030015904614246
Energy: 0.9964058295308185
Energy: 0.9977519813308753
Energy: 1.2025167969340076
Energy: 1.0329366525453907
Energy: 1.1783044826483045
Energy: 1.6168348463640538
Energy: 1.352584086717579
Energy: 1.3317351958018369
Energy: 1.5494585670621137
Energy: 1.352637733868774
Energy: 1.4457326343541048

minimum gb energy = 0.9964058295308185 eV
minimum distance =  2.50763386163592 Angstroms
sigma value = 9


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

Energy: 1.7986426794163848
Energy: 1.726568209972545
Energy: 1.381845419888269
Energy: 1.8013199762343135
Energy: 1.9552667570620748
Energy: 1.5305508618548276
Energy: 1.3327672043028722
Energy: 1.1030139700483017
Energy: 1.1036654671632342
Energy: 1.640996653831444
Energy: 1.1031890335249634
Energy: 1.1862541939041948
Energy: 1.1644091565790997
Energy: 0.8788736589071234
Energy: 0.9374155086719868
Energy: 1.1646914669372748
Energy: 0.8789935945005481
Energy: 1.129764930439931
Energy: 1.1364379719191007
Energy: 1.07489805003743
Energy: 1.1043349893068541
Energy: 1.1394492822156144
Energy: 1.1335170382682516
Energy: 1.0614536902513516
Energy: 1.402651297496434
Energy: 1.4312882261053075
Energy: 1.3406509342142576
Energy: 1.4019784756738383
Energy: 1.6134689122231505
Energy: 1.2659008487795622
Energy: 1.2012888416735406
Energy: 1.2551018333600605
Energy: 1.326023508025789
Energy: 1.2023595449041526
Energy: 1.343032304191383
Energy: 1.2110190632896278
Energy: 1.0612865402276697
Energy: 1.3355352738077282
Energy: 1.0920301971325688
Energy: 1.0147154364739872
Energy: 1.398947159506962
Energy: 1.0443847246686018
Energy: 1.0334635798899392
Energy: 1.0757372424308556
Energy: 1.2663100620754846
Energy: 1.0334615912794745
Energy: 1.1385060083358527
Energy: 1.0891910033620273
Energy: 1.427632380696312
Energy: 1.2818666141865624
Energy: 1.2057669847556667
Energy: 1.4183350481385566
Energy: 1.416449776511602
Energy: 1.237221676235168
Energy: 1.3431084922923118
Energy: 1.2047882603578492
Energy: 1.2691813489452535
Energy: 1.3384593866344867
Energy: 1.4565628340622427
Energy: 1.2088243650264403
Energy: 1.4589814071292568
Energy: 0.9519241331200924
Energy: 0.9521438776283052
Energy: 1.4611413811509135
Energy: 1.0345447372825303
Energy: 1.2229938282271384
Energy: 1.5923241398922947
Energy: 0.9970353464722512
Energy: 0.9976410665239596
Energy: 1.5924669615298641
Energy: 0.9988987347297342
Energy: 1.0483737985140258
Energy: 1.5681438413958688
Energy: 1.5699357217834204
Energy: 1.2703878045616595
Energy: 1.5711235578459315
Energy: 1.5698159391601054
Energy: 1.3895694518561041
Energy: 1.1711679250353304
Energy: 1.3604663643241317
Energy: 1.2628300851313028
Energy: 1.1751488755938115
Energy: 1.3830387446670012
Energy: 1.3007245031669799
Energy: 0.9931359626102821
Energy: 0.8927090742850446
Energy: 0.8962726453433014
Energy: 1.0000456917527154
Energy: 0.934417500422141
Energy: 1.1211080468300525
Energy: 0.9533607790242966
Energy: 1.0507634920289346
Energy: 1.1160245777132953
Energy: 0.9525277654928787
Energy: 1.1627553632393752
Energy: 1.0187554855365781
Energy: 1.167108635605065
Energy: 1.4559411755482807
Energy: 1.416602575221052
Energy: 1.1682758415826107
Energy: 1.5522411911947773
Energy: 1.1402160056284771
Energy: 1.6357651034632232
Energy: 1.4646759210197915
Energy: 1.4590230424051718
Energy: 1.4152061717339486
Energy: 1.5607740436978241
Energy: 1.3936099317213964
Energy: 1.0330163125843506
Energy: 1.3772026034244085
Energy: 1.3692867658639691
Energy: 1.1992348141660483
Energy: 1.329017142632053
Energy: 1.1994073341370173
Energy: 0.9215990380946346
Energy: 0.8685085159787097
Energy: 0.961931632723664
Energy: 0.9232078657975687
Energy: 0.8856219947296811
Energy: 0.9877211870298739
Energy: 0.9666025591656965
Energy: 1.0706419777645628
Energy: 1.0982326979375963
Energy: 0.9783219454773765
Energy: 1.0880758294848718
Energy: 1.2101450801598734
Energy: 1.7704695755948017
Energy: 1.4886663448178326
Energy: 1.5503197602219758
Energy: 1.7717097714117058
Energy: 1.517538146021688
Energy: 1.4269536824284725
Energy: 1.8255758097648132
Energy: 1.2924350743956412
Energy: 1.254089735001286
Energy: 1.8239304084506551
Energy: 1.3878597679214688
Energy: 1.3439648969861315
Energy: 1.2778506402911733
Energy: 0.9788428979361478
Energy: 1.0303590902818458
Energy: 1.2881503013919722
Energy: 0.9800168479619906
Energy: 1.1399120046728395
Energy: 1.1348988625634202
Energy: 1.0122360276870856
Energy: 1.0426275609483626
Energy: 1.1372843451909402
Energy: 0.9536150143453793
Energy: 1.1316428762535655
Energy: 1.3011634999509
Energy: 1.2886286782914869
Energy: 1.2269844976768625
Energy: 1.300421074937109
Energy: 1.2636513458279668
Energy: 1.201591987655383
Energy: 1.555551389700376
Energy: 1.2484542944266876
Energy: 1.1688215923882805
Energy: 1.5540094414656067
Energy: 1.341279559440403
Energy: 1.5908876873571467
Energy: 1.0134223169954495
Energy: 1.2915932823718712
Energy: 1.1425395616452618
Energy: 1.0134578433200354
Energy: 1.2858037946665297
Energy: 0.9729188881215637
Energy: 1.0332599233055013
Energy: 1.2796039829659513
Energy: 1.2328789785359913
Energy: 1.0344736957698242
Energy: 1.4186574903392921
Energy: 1.0736518191744597
Energy: 1.5988927744609516
Energy: 1.07563904208329
Energy: 1.2022602043834087
Energy: 1.335359155783584
Energy: 1.1390949370664916
Energy: 1.213663566337511
Energy: 1.4561561098758473
Energy: 1.36616449919518
Energy: 1.2565206846825132
Energy: 1.3306376339235448
Energy: 1.369551558880404
Energy: 1.219544940687092
Energy: 1.3411356907419345
Energy: 1.0319989635062312
Energy: 1.246434854789385
Energy: 1.3420593516945232
Energy: 1.1137388509996975
Energy: 1.2092436348599713
Energy: 1.5422410142397462
Energy: 1.062319349745543
Energy: 1.062732967745783
Energy: 1.4157464339719328
Energy: 1.0630620019461339
Energy: 1.062316969684234
Energy: 1.556398723872453
Energy: 1.2941051863903867
Energy: 1.369759631925451
Energy: 1.5577920397126592
Energy: 1.2941584303312565
Energy: 1.3798587743459019
Energy: 1.6561544057830113
Energy: 1.3572837952090004
Energy: 1.3013802980938576
Energy: 1.6575678644546636
Energy: 1.545891658626198
Energy: 1.2966780338048045
Energy: 1.2554121017789706
Energy: 1.0289474440613904
Energy: 1.1208958674619374
Energy: 1.193478991708438
Energy: 1.0677759560691207
Energy: 1.0745622218603395
Energy: 0.8767489687361695
Energy: 1.0545202415880521
Energy: 1.0767151633957146
Energy: 0.8779258995956858
Energy: 1.0793039490974985
Energy: 0.9832096134444138
Energy: 1.0954926848486342
Energy: 1.3470629588926935
Energy: 1.3050353752947104
Energy: 1.095623326722232
Energy: 1.0325072531793826
Energy: 1.1096149273572433
Energy: 1.9138331075637112
Energy: 1.4617137065612205
Energy: 1.3623297806222148
Energy: 1.9136770425410405
Energy: 1.5549577720779053
Energy: 1.6613229692369265
Energy: 1.2244011860832518
Energy: 1.3263640166449409
Energy: 1.288490952248552
Energy: 1.2245154843083212
Energy: 1.0302627283519967
Energy: 1.2165195585167066
Energy: 0.8825683615799964
Energy: 0.922325012405111
Energy: 0.9616208717468795
Energy: 0.8838131067423386
Energy: 0.8840413338795237
Energy: 0.9502854797297895
Energy: 1.0117004759007262
Energy: 0.9048011362707726
Energy: 0.8820714190752307
Energy: 1.009699900703316
Energy: 0.9230846284857971
Energy: 1.0101839722398451
Energy: 1.8247420167614654
Energy: 1.335631873702009
Energy: 1.336168876964661
Energy: 1.7750624488678162
Energy: 1.3678786050040435
Energy: 1.3310705387273603

minimum gb energy = 0.8685085159787097 eV
minimum distance =  2.55344264854648 Angstroms
sigma value = 57


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

Energy: 0.5263834149625227
Energy: 0.5157020669366276
Energy: 0.49048175616869466
Energy: 0.4087082725050499
Energy: 1.2901685075900478
Energy: 0.5270376152812883
Energy: 0.5271572745612572
Energy: 0.7527946058961795
Energy: 0.7894487364135113
Energy: 0.8249934254691307
Energy: 0.7670850962367705
Energy: 0.7353810387439479
Energy: 0.6967643580332012
Energy: 0.6801605457723183
Energy: 0.7273516421310072
Energy: 0.7235060823536829
Energy: 0.6715617997709169
Energy: 0.7418176731662748
Energy: 1.7214911003938815
Energy: 1.4695767365672219
Energy: 1.4649980219527465
Energy: 1.7031442076331034
Energy: 1.4361033464789907
Energy: 1.4680638259366252
Energy: 0.7193222860612343
Energy: 0.40667939725494573
Energy: 0.40695071125848187
Energy: 0.7587879727613797
Energy: 0.40655754720300985
Energy: 0.7518341127528969
Energy: 0.985540108188805
Energy: 0.40640002625299776
Energy: 0.4064945426777205
Energy: 0.7324927586576395
Energy: 0.4063836101687156
Energy: 0.4345149624648772
Energy: 0.817096029124433
Energy: 0.7683508561339055
Energy: 0.722475894635329
Energy: 0.8249661857397962
Energy: 0.7938840869445485
Energy: 0.7212225716604468
Energy: 1.386497402694501
Energy: 1.4442750657533658
Energy: 1.4448156051241758
Energy: 1.3969152626567412
Energy: 1.7111682834972548
Energy: 1.449715133081742
Energy: 0.8663540256675372
Energy: 0.7218679485316516
Energy: 0.7388421459851692
Energy: 0.7662752276166751
Energy: 0.7071233185072664
Energy: 0.7397932103242549
Energy: 0.4128005891136925
Energy: 0.8056702341392719
Energy: 0.45214882758223096
Energy: 0.4063184170376952
Energy: 0.7781067660836359
Energy: 0.4066786284455547
Energy: 0.4063754712702182
Energy: 0.683342484033723
Energy: 0.7331839726725164
Energy: 0.4064142852169321
Energy: 0.6845000086166302
Energy: 0.6287421865723637
Energy: 0.7070593106494002
Energy: 0.6821160831433161
Energy: 0.7250258430678026
Energy: 0.7698093139101327
Energy: 0.6817947486887752
Energy: 0.7258927393743997
Energy: 1.6974233607330016
Energy: 1.4266089462001192
Energy: 1.4404642395169114
Energy: 1.6948223726169587
Energy: 1.387917309256378
Energy: 1.432940929017473
Energy: 0.8519264142528448
Energy: 0.7441104297920986
Energy: 0.7425210978724007
Energy: 0.8592895247823218
Energy: 0.7862347418418146
Energy: 0.7340927505867763
Energy: 1.0112827251945404
Energy: 0.40616441424483646
Energy: 0.40627230609402704
Energy: 0.9071226675343002
Energy: 0.4088900804019959
Energy: 0.6990675921815619
Energy: 0.6831631681881171
Energy: 0.7723570524009093
Energy: 0.9689954564005924
Energy: 0.7234202651279195
Energy: 0.4067020338899936
Energy: 0.7391932817944686
Energy: 0.682663426161683
Energy: 0.73453162105132
Energy: 0.7391824229064624
Energy: 0.6716434995169719
Energy: 0.7163911104429734
Energy: 0.7341225373869523
Energy: 1.3827730933982312
Energy: 1.4187806805991814
Energy: 1.450359837834495
Energy: 1.3964332080047268
Energy: 1.7050075733278758
Energy: 1.4726506728278708
Energy: 0.5271569321486012
Energy: 0.812062483947562
Energy: 0.8222655307315462
Energy: 0.40646064951332495
Energy: 0.8152062697251578
Energy: 0.8543307045922636

minimum gb energy = 0.40616441424483646 eV
minimum distance =  2.54267194696226 Angstroms
sigma value = 11


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

Energy: 1.4449615383475662
Energy: 1.749502636558268
Energy: 1.4248158404955444
Energy: 1.4476827484019485
Energy: 1.9285616547115154
Energy: 1.5702602770789649
Energy: 1.5452026658940017
Energy: 0.929790331477804
Energy: 0.8610530945467966
Energy: 1.114922001917784
Energy: 0.9246935772391714
Energy: 0.8489138091648738
Energy: 0.8838648397966534
Energy: 0.7920676011187027
Energy: 0.8408513670370585
Energy: 0.8532367857763956
Energy: 0.7740661221431627
Energy: 0.8545968640502362
Energy: 0.8606427848673919
Energy: 0.8810986542279096
Energy: 0.9914667420126461
Energy: 0.8625703038187914
Energy: 0.9807060467058526
Energy: 0.866930706562802
Energy: 1.108639452238621
Energy: 1.456169953749647
Energy: 1.4105502759170334
Energy: 1.1031960031413097
Energy: 1.6805730449166136
Energy: 1.034764090243718
Energy: 1.7922369574817565
Energy: 1.6106633657249105
Energy: 1.4247531421985624
Energy: 1.7801913386980155
Energy: 1.6343126597577973
Energy: 1.6510427406752215
Energy: 1.112194400677796
Energy: 1.1648016828169967
Energy: 0.9864732876642249
Energy: 1.1147486046090311
Energy: 0.9492604260202484
Energy: 0.9761883716035474
Energy: 0.8064513098361155
Energy: 0.841422704113167
Energy: 0.892508132537926
Energy: 0.8127762311125328
Energy: 0.8305104933818315
Energy: 1.0148276352725674
Energy: 1.4760981708308494
Energy: 0.8925377785217882
Energy: 0.8463475868233202
Energy: 1.426311771532838
Energy: 1.0106346765608025
Energy: 0.8596228193751867
Energy: 1.3275009287390958
Energy: 1.4545159475795368
Energy: 1.3909634932645338
Energy: 1.3396202683126015
Energy: 1.456966620482393
Energy: 1.3790131149740963
Energy: 1.6715660745229968
Energy: 1.4718985863502296
Energy: 1.435735670776439
Energy: 1.4617639460489111
Energy: 1.47617601778929
Energy: 1.2996891591778916
Energy: 1.2627710633130198
Energy: 1.118397111887731
Energy: 1.1919120052885226
Energy: 1.2821138878345057
Energy: 1.1147718424374897
Energy: 1.1676041352767665
Energy: 1.0321441388112187
Energy: 1.0923032378555617
Energy: 1.0748140427747264
Energy: 1.0329938934919378
Energy: 1.1183505836563308
Energy: 1.043445436706743
Energy: 1.0663778583125052
Energy: 1.1329129636010693
Energy: 1.0350229008435916
Energy: 1.0593735807418396
Energy: 1.4501007046505743
Energy: 1.0454260145875773
Energy: 1.2855053971090213
Energy: 1.26267461009614
Energy: 1.1964655757569795
Energy: 1.2870412155558746
Energy: 1.283015140749175
Energy: 1.3219881727082061
Energy: 1.4021467823632296
Energy: 1.210895676594079
Energy: 1.2068811754581226
Energy: 1.3366456446828425
Energy: 1.385491267786347
Energy: 1.2072706009686114
Energy: 1.137178862706103
Energy: 1.3223055561157528
Energy: 1.255655348881439
Energy: 1.1391682054977328
Energy: 1.3235180360893575
Energy: 1.2937292155415392
Energy: 1.579877638419296
Energy: 1.079832744904498
Energy: 1.0800939971208294
Energy: 1.4194229498564037
Energy: 1.075212147426994
Energy: 1.1215953997996624
Energy: 1.3734593633881904
Energy: 0.99149223006039
Energy: 0.9875874863361731
Energy: 1.2281538634336526
Energy: 0.9804583496258863
Energy: 1.0197139626355847
Energy: 0.9870550293418608
Energy: 1.0506442303214096
Energy: 1.1620462562308518
Energy: 0.9891809834964754
Energy: 1.0555068074255682
Energy: 1.1974235671102864
Energy: 1.5575455069867041
Energy: 1.2836228674420938
Energy: 1.270697078464106
Energy: 1.3773045418371208
Energy: 1.5566318276945332
Energy: 1.2731681187366475
Energy: 1.5795988902196847
Energy: 1.4450093076402792
Energy: 1.3167590461016945
Energy: 1.5809551366745787
Energy: 1.466946398252196
Energy: 1.478763875433016
Energy: 1.135181948165214
Energy: 1.1866507480433393
Energy: 0.9884974930227094
Energy: 0.9993327420369991
Energy: 1.5792573761359976
Energy: 0.9888132178597224
Energy: 0.8318773534988466
Energy: 0.9751400973219372
Energy: 1.0209393458047467
Energy: 0.8327980836073962
Energy: 0.9713352461950276
Energy: 0.9057844660521898
Energy: 1.0128217358189835
Energy: 0.951015650427893
Energy: 0.9884891593666154
Energy: 0.9646924560224287
Energy: 0.950906248570623
Energy: 1.0179001267497882
Energy: 1.8432163733546578
Energy: 1.2164204848041238
Energy: 1.193635763258286
Energy: 1.7037807560610858
Energy: 1.5291498192489617
Energy: 1.382085308667253

minimum gb energy = 0.7740661221431627 eV
minimum distance =  2.5431312368566 Angstroms
sigma value = 41


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

Energy: 1.3976417612117136
Energy: 1.5338940702070536
Energy: 1.5328577989194512
Energy: 1.3997528956993415
Energy: 1.8184976644664859
Energy: 1.262202359199374
Energy: 1.9000897702816737
Energy: 1.0921726982997386
Energy: 1.1092366218199976
Energy: 1.146225736230351
Energy: 1.091864082334623
Energy: 1.1093405858872605
Energy: 0.8559122752836481
Energy: 0.9145400713949031
Energy: 0.9755049644673374
Energy: 0.8550224084427053
Energy: 0.889449251304827
Energy: 0.9519314227202884
Energy: 0.9961519208168573
Energy: 1.0999855408451604
Energy: 1.0893159730553479
Energy: 0.9344981301797654
Energy: 0.9993453284165094
Energy: 0.9234293401197329
Energy: 1.1051468830520796
Energy: 1.5470734893249272
Energy: 1.5223871802581992
Energy: 1.1051924360023238
Energy: 1.6426506784057235
Energy: 1.0495419646970245
Energy: 1.2291771934668265
Energy: 1.5378793002650015
Energy: 1.3881742788750306
Energy: 1.5930504640024985
Energy: 1.6907387968002594
Energy: 1.3799055602001162
Energy: 1.243100254267505
Energy: 1.2011570983878022
Energy: 1.165949148210591
Energy: 0.998038270495781
Energy: 1.186913992849919
Energy: 1.1133790505495662
Energy: 0.9316380101909931
Energy: 0.991462068562289
Energy: 1.0749752731439313
Energy: 0.9341150415265582
Energy: 1.0014799044312765
Energy: 1.0833218946908674
Energy: 1.5644659430221697
Energy: 0.9504886957748749
Energy: 0.9454500422827066
Energy: 1.3390235563455968
Energy: 0.9593644192372688
Energy: 0.9683674960814133
Energy: 1.1831316579085418
Energy: 1.2872348483318914
Energy: 1.3312353999069073
Energy: 1.1844847461691839
Energy: 1.287527066896582
Energy: 1.3362234581511643
Energy: 1.4524803198929277
Energy: 1.5344966387832177
Energy: 1.4477786715867524
Energy: 1.4515899497524094
Energy: 1.5292917119880751
Energy: 1.1739112266104388
Energy: 1.5524888545351874
Energy: 1.2654350962438805
Energy: 1.2488923745499587
Energy: 1.5350881973371993
Energy: 1.3514410492778994
Energy: 1.2548076829777721
Energy: 1.2381056151357916
Energy: 1.2650586823818912
Energy: 1.225340967282858
Energy: 1.237853030131417
Energy: 1.3512263667686129
Energy: 1.182426619846482
Energy: 0.9905937236623183
Energy: 1.1144890646688559
Energy: 0.9669989439762066
Energy: 0.9919968052790326
Energy: 1.136701128094821
Energy: 0.9670277406383
Energy: 0.9639420667343721
Energy: 1.1741551495541098
Energy: 1.1732946396168278
Energy: 0.9495044198029545
Energy: 1.165485339893968
Energy: 1.125154208552891
Energy: 1.1474579214213074
Energy: 1.1169158480008798
Energy: 1.1171068526081989
Energy: 1.1169967779990955
Energy: 1.261835211136856
Energy: 1.1509549085209865
Energy: 1.4166881473593305
Energy: 1.749185775588804
Energy: 1.5443693139328782
Energy: 1.417826368937399
Energy: 1.6954556040323328
Energy: 1.4029691592056925
Energy: 1.8816618641239282
Energy: 1.0943108579791658
Energy: 1.1493354195767487
Energy: 1.465540193550839
Energy: 1.0776302048454287
Energy: 1.390510814070053
Energy: 1.0983418125933537
Energy: 0.9031367896791039
Energy: 0.8960365188265792
Energy: 1.0997451645102323
Energy: 0.8926573048889397
Energy: 0.9374862632204478
Energy: 0.8741483698604295
Energy: 0.9255881422099957
Energy: 0.9386913777273889
Energy: 0.8757580991636514
Energy: 0.8588351097973347
Energy: 0.9273192639765045
Energy: 0.9980427147154409
Energy: 1.0896068786786135
Energy: 0.8995958212604951
Energy: 0.9348532046052705
Energy: 1.1543097823663198
Energy: 0.9221311025516837
Energy: 1.77304918234019
Energy: 1.6387115899744729
Energy: 1.4624169633936015
Energy: 1.7586706848913427
Energy: 1.680706799005744
Energy: 1.4383788938094342
Energy: 1.2217891719516096
Energy: 1.1205393031583772
Energy: 1.0971600557556873
Energy: 1.2004026196393585
Energy: 1.0789853644402925
Energy: 1.172605120848202
Energy: 0.9314779016409236
Energy: 1.006371894210141
Energy: 1.084298635412752
Energy: 0.9342479740375657
Energy: 1.0046244648327887
Energy: 1.0243684495164735
Energy: 1.4630458204725267
Energy: 0.9506690422677276
Energy: 0.9452752946622336
Energy: 1.2075702681697944
Energy: 0.950159250224549
Energy: 0.968346120681559
Energy: 1.4956701084681274
Energy: 1.169187592329444
Energy: 1.2014758064033841
Energy: 1.2351948975827172
Energy: 1.1691934143326503
Energy: 1.2455990936254726
Energy: 1.1656701622693662
Energy: 1.33379416901691
Energy: 1.3651509679296376
Energy: 1.1826560713681857
Energy: 1.3338554889469365
Energy: 1.5640969033430163
Energy: 1.5512149178054768
Energy: 1.2132646745893991
Energy: 1.153661846898553
Energy: 1.5883944090380282
Energy: 1.175367948058598
Energy: 1.2789002961160547
Energy: 1.3146076967998912
Energy: 1.3686514431854824
Energy: 1.3680664373206055
Energy: 1.3153637343099562
Energy: 1.403226955370161
Energy: 1.2483486608495609
Energy: 0.9919728430008271
Energy: 1.262052849036597
Energy: 0.9673844433098465
Energy: 0.9925477017891023
Energy: 1.5299984280890024
Energy: 0.9889807360727257
Energy: 0.9272532297571715
Energy: 1.1713819573355495
Energy: 1.0750858044378688
Energy: 0.9270445954941557
Energy: 1.1665386634174928
Energy: 1.051687871226744
Energy: 1.1068457441331796
Energy: 1.1564010659968433
Energy: 1.2327073654323832
Energy: 1.1407063259115484
Energy: 0.8884988254238783
Energy: 1.1885352376246694
Energy: 1.490414243339934
Energy: 1.2369570500250213
Energy: 1.4340195039305481
Energy: 1.4266342336862166
Energy: 1.2089524908532943
Energy: 1.479897201573378

minimum gb energy = 0.8550224084427053 eV
minimum distance =  2.49379684991305 Angstroms
sigma value = 33


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

Energy: 1.168310560407367
Energy: 1.332755245294088
Energy: 1.3327913603803707
Energy: 1.169239750364956
Energy: 1.6682463218085228
Energy: 1.4951869318978361
Energy: 1.6611192115953726
Energy: 0.9956254485972359
Energy: 0.9740167933072826
Energy: 1.2672591482533613
Energy: 0.9269547401134866
Energy: 1.0137765374911087
Energy: 0.9639869305107137
Energy: 1.0264984648383808
Energy: 1.027605018512106
Energy: 0.9651177891046836
Energy: 0.9982140114847591
Energy: 1.019356478229106
Energy: 1.0240788448110913
Energy: 1.1205571898406028
Energy: 1.075029212235874
Energy: 1.0251515066938204
Energy: 1.1577561865568353
Energy: 1.006870771408768
Energy: 1.2022361400459254
Energy: 1.474275157960562
Energy: 0.9895234509329359
Energy: 1.196028625192863
Energy: 1.5636968386129122
Energy: 1.254780206591876
Energy: 1.6362950252508102
Energy: 1.3676392270503985
Energy: 1.2980294669110954
Energy: 1.639492638392687
Energy: 1.4107997902166798
Energy: 1.3036852470773908
Energy: 1.2388730930953404
Energy: 1.2375833365464544
Energy: 1.1680276722778289
Energy: 1.2778395068496355
Energy: 0.9852900760958654
Energy: 1.1317751029079501
Energy: 1.0837430882310586
Energy: 1.111272605654603
Energy: 1.1206331470774993
Energy: 1.085988095794407
Energy: 1.2011200544483895
Energy: 1.1571465582460154
Energy: 1.6420068353653685
Energy: 0.9908144522114836
Energy: 0.9890133633133688
Energy: 1.510007828781595
Energy: 0.9668917376917261
Energy: 0.969706817321299
Energy: 1.4083040172301529
Energy: 1.0445721344704808
Energy: 1.097626963596258
Energy: 1.4098326963342427
Energy: 1.0467281632554084
Energy: 1.0977665460754236
Energy: 1.312816689525941
Energy: 1.2996780052852717
Energy: 1.3156492453887088
Energy: 0.9661324237719335
Energy: 1.261228964691388
Energy: 1.3509972157571442
Energy: 1.4189372260531445
Energy: 1.5362028363798366
Energy: 1.4200140280667828
Energy: 1.4188867033093502
Energy: 1.5901862194087035
Energy: 1.411445783954208
Energy: 1.1933113574281045
Energy: 1.6070524776545092
Energy: 1.4120184578939587
Energy: 1.1938135355951465
Energy: 1.6077052486242653
Energy: 1.4114625923457345
Energy: 1.0105446832520195
Energy: 0.9899726218475247
Energy: 1.0172932596681854
Energy: 0.9371639547470694
Energy: 1.2365636517347416
Energy: 0.9948005585136322
Energy: 0.9108211049020504
Energy: 0.9899261553106927
Energy: 1.0343968574802842
Energy: 0.969119574732732
Energy: 0.9803370458100482
Energy: 1.0342826197320887
Energy: 1.3265066500670042
Energy: 1.0257317119191613
Energy: 1.0250857413568242
Energy: 1.4228992838281098
Energy: 1.0269022949626658
Energy: 0.9987957890259196
Energy: 1.4062415008590567
Energy: 1.6298067458827923
Energy: 1.1275809819866318
Energy: 1.4086865581072778
Energy: 1.6184257104469206
Energy: 1.2905059620412445
Energy: 1.6639821029929873
Energy: 1.316533295872057
Energy: 1.3168231124361442
Energy: 1.550578311275991
Energy: 1.3413663927466586
Energy: 1.1032321077929514
Energy: 1.1379240830846566
Energy: 1.1969671916307183
Energy: 1.096463441942087
Energy: 1.2165237691808484
Energy: 1.0604953544869218
Energy: 1.1720556818024248
Energy: 1.0446604864564384
Energy: 1.1471449280761317
Energy: 1.0515942492366546
Energy: 1.067847292735231
Energy: 1.048335180049006
Energy: 1.0981984718053481
Energy: 1.123981581159532
Energy: 0.9743718971094358
Energy: 0.968910380686376
Energy: 0.9980794140472022
Energy: 1.2865193181586332
Energy: 0.9478634406306972
Energy: 1.1031088493085761
Energy: 1.4033687610983094
Energy: 1.3941598985897996
Energy: 1.104560231376384
Energy: 1.4065771785789605
Energy: 1.1670781725993182
Energy: 1.2092229262851446
Energy: 1.0958796789720957
Energy: 1.276297734699901
Energy: 1.2204218364659583
Energy: 1.3044481288738545
Energy: 1.321838340511377
Energy: 1.2413027804447343
Energy: 1.685888845176681
Energy: 1.3370490886518174
Energy: 1.760403148398813
Energy: 1.630168813860226
Energy: 1.4732977686379995
Energy: 1.643126949656702
Energy: 0.9655232080233442
Energy: 0.9657500135017592
Energy: 1.2543321470238524
Energy: 1.1444598531095633
Energy: 1.059049672112805
Energy: 0.9299538451946994
Energy: 0.962859296918537
Energy: 0.9748453090267774
Energy: 0.93052138087119
Energy: 0.9801953563389221
Energy: 0.9734534199024216
Energy: 1.0254547100407805
Energy: 0.9630079433327121
Energy: 0.9787338127259064
Energy: 0.986056017210036
Energy: 0.9825050633443216
Energy: 0.9842793970067951
Energy: 1.024891072659643
Energy: 1.1044338183187288
Energy: 1.0827387595546756
Energy: 1.193967299309221
Energy: 1.4275377376836689
Energy: 1.0169087928882532
Energy: 1.631131932331048
Energy: 1.3658670797266919
Energy: 1.22212808368559
Energy: 1.706085859099343
Energy: 1.4360128246319206
Energy: 1.1904879644875002
Energy: 1.2399037776828037
Energy: 1.042214051367348
Energy: 1.1242926995325533
Energy: 1.279364788434384
Energy: 1.4995004835243764
Energy: 1.1216499835105933
Energy: 1.0830340866042534
Energy: 1.1128955866311714
Energy: 1.0166197226919726
Energy: 1.056277613625118
Energy: 1.182652315618592
Energy: 1.1799442528179482
Energy: 1.7023904255180975
Energy: 0.9900181758687232
Energy: 0.9880812659264707
Energy: 1.681605955619373
Energy: 0.9675529356532346
Energy: 0.9873813796709008
Energy: 1.4060670128249035
Energy: 1.0444148683651167
Energy: 1.096650671640077
Energy: 1.3318211972148697
Energy: 1.044552080855608
Energy: 1.0967016377615335
Energy: 1.351780327550199
Energy: 1.1869400599262308
Energy: 1.2633905399887266
Energy: 1.3621260773563522
Energy: 1.0731819888634746
Energy: 1.282398541707847
Energy: 1.4192786498059398
Energy: 1.43514198081338
Energy: 1.2357329541607551
Energy: 1.331211799634318
Energy: 1.2600410696716549
Energy: 1.2683543531023547
Energy: 1.603222996055085
Energy: 1.5647275051144414
Energy: 1.5658458155239536
Energy: 1.5059733247481064
Energy: 1.7554642926171369
Energy: 1.3110851510263637
Energy: 1.0117302987236965
Energy: 1.4357496880834875
Energy: 0.9918603669439557
Energy: 0.9241741357879171
Energy: 1.2330791439359667
Energy: 0.992215528359262
Energy: 0.938967196592877
Energy: 0.9713880565803563
Energy: 1.0343534592298276
Energy: 0.9400524971248099
Energy: 0.9861173652944536
Energy: 0.9992488470387084
Energy: 1.3239915474628214
Energy: 1.0258776799714224
Energy: 1.0052778886293012
Energy: 1.2900119129930214
Energy: 1.0278170922493857
Energy: 1.0097602385739604
Energy: 1.408580227564703
Energy: 1.2029269770063815
Energy: 1.2975459869017107
Energy: 1.4104413706034187
Energy: 1.4597362514581318
Energy: 1.3660167765181048
Energy: 1.546759209573588
Energy: 1.3126797979591647
Energy: 1.3124896961766528
Energy: 1.5482589754411624
Energy: 1.3434896482216367
Energy: 1.1206313987119363
Energy: 1.1378827812780088
Energy: 1.1994386947491833
Energy: 1.0534328380547502
Energy: 1.3013651013678031
Energy: 1.1985230975718941
Energy: 1.1327100744996286
Energy: 1.1159109537152645
Energy: 1.1569274080536653
Energy: 1.1847356347246196
Energy: 1.1171526873893567
Energy: 1.0578435344504231
Energy: 1.143089688171485
Energy: 0.9936498583880449
Energy: 0.9736960079474133
Energy: 0.9686669796723352
Energy: 0.9949264732354439
Energy: 1.4372504958964052
Energy: 0.9700384127462536
Energy: 1.1080200386003163
Energy: 1.4130326327161715
Energy: 1.4190793184754817
Energy: 1.1094518805195075
Energy: 1.4063374931592683
Energy: 1.2540857702164587
Energy: 1.2063551459509398
Energy: 1.0960371630189685
Energy: 1.2749275746210924
Energy: 1.2071094562881004
Energy: 1.2393848027863057
Energy: 1.3202503565199821
Energy: 1.7562819882777052
Energy: 1.5334229545142553
Energy: 1.3111854863765113
Energy: 1.7546919769545923
Energy: 1.5342448318109108
Energy: 1.411744112689095

minimum gb energy = 0.9108211049020504 eV
minimum distance =  2.48902163993236 Angstroms
sigma value = 67


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

Energy: 1.2510317207936237
Energy: 0.9528782826657219
Energy: 0.8717316618309383
Energy: 1.2539972696298596
Energy: 1.3619462184853355
Energy: 1.2766687840662216
Energy: 1.2939919136920128
Energy: 1.030863949565765
Energy: 0.952797886008389
Energy: 1.0909021665400387
Energy: 1.0308574124182641
Energy: 0.8050438890180072
Energy: 1.0618704717429635
Energy: 1.001669102586338
Energy: 1.1045520045014414
Energy: 1.0632208716477753
Energy: 1.002858656607725
Energy: 1.1113803880327502
Energy: 1.0645619722120656
Energy: 1.0163344604990978
Energy: 1.1432635037865728
Energy: 1.0599745520649952
Energy: 1.3554995246349537
Energy: 1.006745069784344
Energy: 1.3167711027082818
Energy: 1.1425227703704415
Energy: 1.1224714192287628
Energy: 1.3212995653227133
Energy: 1.286978635950044
Energy: 1.0173390339169117
Energy: 1.3216960013465886
Energy: 1.065455148153901
Energy: 1.5518446997942568
Energy: 1.3212310042185496
Energy: 1.2458306062684301
Energy: 1.4626972769101378
Energy: 1.4307857857328161
Energy: 1.0720639885604255
Energy: 1.1588465253963407
Energy: 1.3607822162441483
Energy: 1.3504111322172876
Energy: 0.9685724719642238

minimum gb energy = 0.8050438890180072 eV
minimum distance =  2.52686282272626 Angstroms
sigma value = 3


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

Energy: 1.7026835634732456
Energy: 1.678865704047399
Energy: 1.393362933850484
Energy: 1.7035785466567004
Energy: 1.7919014714200017
Energy: 1.5479063556733967
Energy: 1.518395202563523
Energy: 1.412027303239642
Energy: 1.5424090442625769
Energy: 1.455831059995363
Energy: 1.488164825097984
Energy: 1.436012948236427
Energy: 1.346788132600747
Energy: 1.391132767219188
Energy: 1.328174037904776
Energy: 1.3487155699646909
Energy: 1.4837555619238731
Energy: 1.3647722724507854
Energy: 0.9859956906891305
Energy: 1.2288159934844525
Energy: 1.0202299077004044
Energy: 0.9874823426073603
Energy: 1.4778342486545186
Energy: 0.9223528234467268
Energy: 1.1482380410880644
Energy: 1.2459835451415333
Energy: 1.18048967591377
Energy: 1.130129519854905
Energy: 1.3758741100552627
Energy: 1.0766586644401057
Energy: 1.3112416672223282
Energy: 1.3223964297712765
Energy: 1.2712747492786745
Energy: 1.3100740325797369
Energy: 1.3712783437418126
Energy: 1.3023982429263652
Energy: 1.56479195164313
Energy: 1.218404201991865
Energy: 1.2497483644479355
Energy: 1.4620789339394171
Energy: 1.2631625746840165
Energy: 1.2722170624291043
Energy: 1.5864398182216632
Energy: 1.5395682629171499
Energy: 1.382335693267347
Energy: 1.587724756204316
Energy: 1.492764034868585
Energy: 1.462034339495798
Energy: 1.553281177125175
Energy: 1.545169707860506
Energy: 1.4549026701308037
Energy: 1.4898422331701269
Energy: 1.5369226366117832
Energy: 1.48327007053087
Energy: 1.5639085962879613
Energy: 1.625166691250719
Energy: 1.329831388269994
Energy: 1.5569900253116986
Energy: 1.6734840156921085
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Energy: 1.177111974206112
Energy: 1.3520247222043527
Energy: 1.205700944161491
Energy: 1.177026167398293
Energy: 1.5522977452739066
Energy: 1.190926554418084
Energy: 1.4312066562884256
Energy: 1.2840823990681893
Energy: 1.3096474065421775
Energy: 1.381599269813014
Energy: 1.3379477842109353
Energy: 1.2548388688596224
Energy: 1.4208289005065042
Energy: 1.1228062068697693
Energy: 1.1213051831846288
Energy: 1.4098725794116311
Energy: 1.1163481674771316
Energy: 1.18415153828871
Energy: 1.6188560936855574
Energy: 0.9543892608162763
Energy: 0.949179538413707
Energy: 1.5288620687573313
Energy: 0.9494614325567573
Energy: 0.9490816782509234
Energy: 1.4361797155151488
Energy: 1.066442632928939
Energy: 1.276264168040414
Energy: 1.4379440029111772
Energy: 1.066326500292531
Energy: 1.336329554146296
Energy: 1.4787103358813631
Energy: 1.4730156245123054
Energy: 1.3858523864303254
Energy: 1.4805709965671727
Energy: 1.438071976558299
Energy: 1.4942790049469277
Energy: 1.572080460310708
Energy: 1.772188256005784
Energy: 1.3934223254900655
Energy: 1.5637374302234484
Energy: 1.8253212766771192
Energy: 1.5812406200368472
Energy: 1.513991444542619
Energy: 1.4006512105308877
Energy: 1.4942820320608898
Energy: 1.494958751392127
Energy: 1.379487192662612
Energy: 1.560563011307804
Energy: 1.7447805551605045
Energy: 1.3936336952791835
Energy: 1.4239746085723313
Energy: 1.6997576426099525
Energy: 1.3717655255469903
Energy: 1.401904373670701
Energy: 1.5514217755728095
Energy: 1.0739154219181817
Energy: 1.1253873409379735
Energy: 1.7372890272234789
Energy: 1.079990196232699
Energy: 1.2759133030987084
Energy: 1.494287849089693
Energy: 1.1592006716650278
Energy: 1.2125112053201685
Energy: 1.4226542199682064
Energy: 1.1436614445395952
Energy: 1.1400305039689014
Energy: 1.198840645493601
Energy: 1.3203591880437389
Energy: 1.3217835668927744
Energy: 1.2290708677187248
Energy: 1.312405366539973
Energy: 1.3038267297267645
Energy: 1.0672553297664147
Energy: 1.3440489413374637
Energy: 1.0528617087291054
Energy: 1.0691767400792027
Energy: 1.5515831281836276
Energy: 1.0210351841373873
Energy: 1.2671645822578474
Energy: 1.535956553097592
Energy: 1.2871996304932363
Energy: 1.2688775396068435
Energy: 1.5278581202026251
Energy: 1.2876347199782867
Energy: 1.5087810972663118
Energy: 1.426163002616805
Energy: 1.4568356691869584
Energy: 1.4362641689322662
Energy: 1.594800209465655
Energy: 1.4299282291535038
Energy: 1.713132737727
Energy: 1.455675949805201
Energy: 1.437477610632174
Energy: 1.7159054662720432
Energy: 1.4148146425292456
Energy: 1.4541448236064114
Energy: 1.7120943994132949
Energy: 1.358805212806845
Energy: 1.3478013650490583
Energy: 1.8293624729832694
Energy: 1.3749202189838416
Energy: 1.3447208941004742
Energy: 1.4941004266796178
Energy: 1.4402096045201827
Energy: 1.3823183784293813
Energy: 1.4542248065252277
Energy: 1.3849134064499626
Energy: 1.3436205984985046
Energy: 1.1453162759233873
Energy: 1.453654115701401
Energy: 1.2947112958069655
Energy: 1.1467292136532534
Energy: 1.4389308176829307
Energy: 1.2296638392509502
Energy: 0.9625650817941087
Energy: 1.303847272211402
Energy: 0.9656990178247065
Energy: 0.9646359474341694
Energy: 1.5819837626424675
Energy: 0.9481339235849902
Energy: 1.1394184158687521
Energy: 1.3248275756262287
Energy: 1.291667244647715
Energy: 1.1381371443949626
Energy: 1.320553961656058
Energy: 1.2970130407079197
Energy: 1.479419676528265
Energy: 1.256007919196709
Energy: 1.230080940735656
Energy: 1.357913172241102
Energy: 1.3337352086426442
Energy: 1.2919812952593828
Energy: 1.7050382226511915
Energy: 1.2932208782025312
Energy: 1.2717478786495229
Energy: 1.693792765015082
Energy: 1.340657452898425
Energy: 1.3653499599123433
Energy: 1.7510816220728058
Energy: 1.4647489338876825
Energy: 1.4713358447075742
Energy: 1.7247163667592174
Energy: 1.5090936141576672
Energy: 1.587839478305723
Energy: 1.4597984863503954
Energy: 1.3799859462015307
Energy: 1.461191716784114
Energy: 1.4668568001384432
Energy: 1.3596138876262036
Energy: 1.5069020727518194
Energy: 1.3863631791376738
Energy: 1.5117575612220882
Energy: 1.3261588798426522
Energy: 1.3617801780466057
Energy: 1.6769308084762884
Energy: 1.4104621238909818
Energy: 1.3257530860068576
Energy: 1.3679264579686057
Energy: 1.2158456109559161
Energy: 1.2596561692057147
Energy: 1.5312384518245532
Energy: 1.254772209730572
Energy: 1.3274347726040525
Energy: 1.1128564328805042
Energy: 1.2311275643787218
Energy: 1.3066374596868136
Energy: 1.1104432278375893
Energy: 1.3168395451479165
Energy: 1.536803504247083
Energy: 0.931855847705037
Energy: 0.9219077046703656
Energy: 1.5047809583935257
Energy: 1.0002503232575104
Energy: 1.0061160019560615
Energy: 1.5027804475280668
Energy: 1.1309961908044108
Energy: 1.123353789762273
Energy: 1.4659652085923456
Energy: 1.1274041107532822
Energy: 1.1819720120503339
Energy: 1.5974145139131617
Energy: 1.3751645151663754
Energy: 1.3827059169615334
Energy: 1.566207631048759
Energy: 1.384807553668509
Energy: 1.3204973016547306
Energy: 1.4290885882114088
Energy: 1.4504294487375298
Energy: 1.4693473108427002
Energy: 1.399527497531087
Energy: 1.8575986018905666
Energy: 1.377651679891723
Energy: 1.5922646869711332
Energy: 1.6346232388044284
Energy: 1.3932134575131407
Energy: 1.593021665244729
Energy: 1.899090302931434
Energy: 1.6034335268892448
Energy: 1.6469711428744356
Energy: 1.4854161043443148
Energy: 1.4356994814833104
Energy: 1.5663768532878686
Energy: 1.4574705454044063
Energy: 1.4577866321235073
Energy: 1.4834305529551648
Energy: 1.1835940338027862
Energy: 1.255518564353927
Energy: 1.4851741117047155
Energy: 1.1942005917574496
Energy: 1.3789354640321958
Energy: 1.575949959390889
Energy: 1.0248915931564675
Energy: 1.0028964103757592
Energy: 1.481292918938287
Energy: 1.0099340098001524
Energy: 1.0030723099304553
Energy: 1.3405025931132635
Energy: 1.1811590631041544
Energy: 1.207705073343086
Energy: 1.2636490061569534
Energy: 1.2164704716236485
Energy: 1.286306505135141
Energy: 1.2110633151689774
Energy: 1.2864963932311562
Energy: 1.2523025871642486
Energy: 1.207642119242879
Energy: 1.2940587455651873
Energy: 1.1179158161438287
Energy: 1.0212401754947822
Energy: 1.5190803566906994
Energy: 1.2873389489522173
Energy: 1.0865533226176909
Energy: 1.606774159906058
Energy: 1.0979162294731433
Energy: 1.5494548169826177
Energy: 1.558990523995823
Energy: 1.351336726423095
Energy: 1.4505218179009918
Energy: 1.6460722331965907
Energy: 1.4548244946022049
Energy: 1.5614367138838157
Energy: 1.4596731110653987
Energy: 1.5992923043547707
Energy: 1.4619040771063507
Energy: 1.5407184742092594
Energy: 1.4788928579921343

minimum gb energy = 0.9219077046703656 eV
minimum distance =  2.51469486609843 Angstroms
sigma value = 81


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

Energy: 1.7331479503954266
Energy: 1.176599239458266
Energy: 1.174103801535297
Energy: 1.7264143782628492
Energy: 1.7091176109517026
Energy: 1.4547234902724586
Energy: 1.588079126899476
Energy: 1.131702968036945
Energy: 1.1366015826544842
Energy: 1.5080289847684467
Energy: 1.1347390651243208
Energy: 1.0800307464950176
Energy: 1.282989138262423
Energy: 1.1771896097912795
Energy: 1.2719742275983048
Energy: 1.2479289741002653
Energy: 1.2504328656268089
Energy: 1.3383702800802375
Energy: 1.100941049396292
Energy: 1.3526841822925242
Energy: 1.1479737330932895
Energy: 1.1024981116406514
Energy: 1.4254371949932765
Energy: 0.963147897836257
Energy: 1.059115003832992
Energy: 1.4031135114113278
Energy: 1.0366404850707822
Energy: 1.0592168528081165
Energy: 1.4435824814971552
Energy: 1.022271056661349
Energy: 1.4567563887872153
Energy: 1.2682227088292017
Energy: 1.2689803715508865
Energy: 1.4603804677727978
Energy: 1.3803555035491748
Energy: 1.2702004134948022
Energy: 1.3619254540042425
Energy: 1.0911539587121657
Energy: 1.0897238618401963
Energy: 1.3362720671235915
Energy: 1.0905275389795135
Energy: 1.2575906186255024
Energy: 1.4418802695197717
Energy: 1.52991433791456
Energy: 1.652045540760911
Energy: 1.4424560009049423
Energy: 1.5313636866503781
Energy: 1.165476837202661
Energy: 1.4483213057630124
Energy: 1.1561414856654555
Energy: 1.4196131331780095
Energy: 1.3184869675866335
Energy: 1.460577258181304
Energy: 1.3427814188036569
Energy: 1.4419666334146444
Energy: 1.4570114829681202
Energy: 1.3606296767478854
Energy: 1.2578143939774888
Energy: 1.668982331252771
Energy: 1.2553481269183813
Energy: 1.077083674788268
Energy: 1.53419502150236
Energy: 1.1005684820455617
Energy: 1.078418462936437
Energy: 1.539626319764099
Energy: 1.040380471503775
Energy: 1.3310372101055006
Energy: 1.3530113185844914
Energy: 1.314238391793646
Energy: 1.2713516704316044
Energy: 1.19736806574532
Energy: 1.2935374546328993
Energy: 1.233760099261973
Energy: 1.2180643326940357
Energy: 1.203970943428241
Energy: 1.2049310564715403
Energy: 1.2188459853725733
Energy: 1.2983517121642756
Energy: 1.4161757509490152
Energy: 1.0163476224660764
Energy: 1.03312881608361
Energy: 1.4178853104906601
Energy: 1.0584305494413493
Energy: 1.0441222498905163
Energy: 1.4433342729390601
Energy: 1.372223311207077
Energy: 1.3564716920968363
Energy: 1.4581314245330759
Energy: 1.3274794708480897
Energy: 1.3250936045500774
Energy: 1.2984197917582763
Energy: 1.2594040082492175
Energy: 1.23978185476928
Energy: 1.2998939319370606
Energy: 1.3380603215806761
Energy: 1.3486656526613285
Energy: 1.5285639680174867
Energy: 1.443874598341258
Energy: 1.1649399394433915
Energy: 1.5299335253729824
Energy: 1.4466117236683629
Energy: 1.1651597706397578
Energy: 1.366800469844813
Energy: 1.174412015760282
Energy: 1.3264925818422864
Energy: 1.2778609145846502
Energy: 1.3193961815075406
Energy: 1.439037991263824
Energy: 1.6953598287925045
Energy: 1.234710568605814
Energy: 1.1556270054038857
Energy: 1.5833870982819738
Energy: 1.2350309470673722
Energy: 1.2011666471195432
Energy: 1.6944455923790793
Energy: 1.0486658003738807
Energy: 1.1031016735222212
Energy: 1.630263437968914
Energy: 1.048472975786454
Energy: 1.1019958915865824
Energy: 1.4884441153345354
Energy: 1.0836919555315734
Energy: 1.1692067683527143
Energy: 1.4590503111933084
Energy: 1.1080081466063407
Energy: 1.1798020719363296
Energy: 1.2006618082779996
Energy: 1.1858568554970843
Energy: 1.2829145779335305
Energy: 1.2020675027068835
Energy: 1.188418680368859
Energy: 1.2435791465509347
Energy: 0.9926148248687288
Energy: 1.265018282181275
Energy: 1.0292260339252237
Energy: 0.9936444491846567
Energy: 1.415058684851554
Energy: 1.0646360851856043
Energy: 1.202048480290858
Energy: 1.4609246895602068
Energy: 1.3786263285452234
Energy: 1.1590838542600117
Energy: 1.4878033823614891
Energy: 1.1161288989561238
Energy: 1.278842308572307
Energy: 1.3786692800750155
Energy: 1.3394906718916764
Energy: 1.2753202737889158
Energy: 1.3648004054789036
Energy: 1.2988693792853863
Energy: 1.614011214593794
Energy: 1.479257562179541
Energy: 1.4550035274177961
Energy: 1.5956636885436888
Energy: 1.4780029960119183
Energy: 1.6561136813684711
Energy: 1.5385818121249224
Energy: 1.3259429945078804
Energy: 1.3771051613133558
Energy: 1.5400663839656301
Energy: 1.3272786873633886
Energy: 1.382115855504833
Energy: 1.3911840972273068
Energy: 1.321025539831126
Energy: 1.3313397212181364
Energy: 1.4015740398574985
Energy: 1.5118362809886174
Energy: 1.275790549498797
Energy: 1.1562482854332983
Energy: 1.3930798846879433
Energy: 1.470761117927515
Energy: 1.133994083484786
Energy: 1.6667053058450672
Energy: 1.202087018307261
Energy: 1.1111954654199583
Energy: 1.2517894485194374
Energy: 1.0461259602869046
Energy: 1.109687439149702
Energy: 1.5237183109947743
Energy: 1.1474784297071035
Energy: 1.1776409103668508
Energy: 1.2415459284351054
Energy: 1.3775446511855578
Energy: 1.1798333322288113
Energy: 1.2456825717045783
Energy: 1.2445999886052015
Energy: 1.5263154860692003
Energy: 0.9718527229190618
Energy: 0.9811842190307531
Energy: 1.3900774745503535
Energy: 0.9862581241599448
Energy: 0.9719036026279901
Energy: 1.5311766779823424
Energy: 1.1203027882299839
Energy: 1.1217397909754165
Energy: 1.4980675756606068
Energy: 1.130606608416737
Energy: 1.1308808229091782
Energy: 1.3899440120002262
Energy: 1.301762936259935
Energy: 1.2081500615591292
Energy: 1.3973567609169038
Energy: 1.4485327614662526
Energy: 1.2606428597801547
Energy: 1.0792499962877282
Energy: 1.2181025576151447
Energy: 1.2705862593477448
Energy: 0.9652633063639537
Energy: 1.7376249442640057
Energy: 1.2020966338602745
Energy: 1.5894101739029678
Energy: 1.4579689969895036
Energy: 1.1653798340911172
Energy: 1.589574752016127
Energy: 1.4439579091506678
Energy: 1.6559436010199247
Energy: 1.6246733523909134
Energy: 1.301149289825297
Energy: 1.370985408957379
Energy: 1.5046402944340502
Energy: 1.301451189636287
Energy: 1.3710695004989744
Energy: 1.7203146102188263
Energy: 1.208373632528745
Energy: 1.1746474317476847
Energy: 1.7275693651250885
Energy: 1.2226918738421408
Energy: 1.328147480355881

minimum gb energy = 0.963147897836257 eV
minimum distance =  2.52358038017904 Angstroms
sigma value = 43


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

Energy: 1.6973440334308996
Energy: 1.5658200259412156
Energy: 1.3438340530171162
Energy: 1.6972353375376994
Energy: 1.759787971056245
Energy: 1.2252425532962328
Energy: 1.637330744380708
Energy: 1.3126894552701593
Energy: 1.1790415689013574
Energy: 1.481019040950802
Energy: 1.3128236422917732
Energy: 1.2856826697221524
Energy: 1.3842728119237593
Energy: 1.4313055644276644
Energy: 1.3417335204534024
Energy: 1.3223817559025248
Energy: 1.4765383918862796
Energy: 1.3743718898714623
Energy: 1.0080766733632909
Energy: 1.2319142566468544
Energy: 1.0187934457230088
Energy: 0.9509507820599087
Energy: 1.4363488013967847
Energy: 0.9360438431480368
Energy: 1.18386888391195
Energy: 1.2429795704472868
Energy: 1.2112527799512218
Energy: 1.1335998138436205
Energy: 1.2815295048443582
Energy: 1.1439036727256273
Energy: 1.3614736504429312
Energy: 1.189721621818635
Energy: 1.1464818520851114
Energy: 1.3399220273842873
Energy: 1.1876026802523194
Energy: 1.1682980255358288
Energy: 1.435513155278448
Energy: 0.9509761960536008
Energy: 0.9503982109114963
Energy: 1.4214064711628203
Energy: 0.9519200177587852
Energy: 0.9506243781614053
Energy: 1.4984909753996456
Energy: 1.0959100532101276
Energy: 1.155017880318833
Energy: 1.463463476600226
Energy: 1.2047636254366136
Energy: 1.3843629661342924
Energy: 1.4449345593345693
Energy: 1.2435503665688912
Energy: 1.3830830620394345
Energy: 1.372478797324123
Energy: 1.3539372595846084
Energy: 1.3795252855955153
Energy: 1.5296945879730748
Energy: 1.5685313597263502
Energy: 1.3769433784807694
Energy: 1.5352243494586781
Energy: 1.7166449023690642
Energy: 1.3215661023388343
Energy: 1.4101532165736201
Energy: 1.4094040133000063
Energy: 1.3899587194968972
Energy: 1.3644978701099997
Energy: 1.6119181097566564
Energy: 1.3865554376713949
Energy: 1.4916176714811191
Energy: 1.294640420640515
Energy: 1.3347778241968897
Energy: 1.5407612639288408
Energy: 1.294992141959915
Energy: 1.3926381486909505
Energy: 1.6202262970915127
Energy: 1.138242838289616
Energy: 1.1560977511996045
Energy: 1.6224287673051565
Energy: 1.138290471464203
Energy: 1.2729470446332656
Energy: 1.4339567522818517
Energy: 1.0872705186219647
Energy: 1.1705253519295158
Energy: 1.4555951940439518
Energy: 1.089301789847406
Energy: 1.1824626335018504
Energy: 1.1488306143079219
Energy: 1.3267337754264765
Energy: 1.3263491017699933
Energy: 1.144983960842506
Energy: 1.2274295938097783
Energy: 1.2568509192578652
Energy: 0.9570743664731043
Energy: 1.260703398444094
Energy: 0.9171799471843691
Energy: 0.95643090213179
Energy: 1.3331432032204993
Energy: 0.9194735702962553
Energy: 1.1102857890379312
Energy: 1.4733059015748493
Energy: 1.2837312190017451
Energy: 1.1077589760929516
Energy: 1.4092432491355005
Energy: 1.1365010777204354
Energy: 1.3637787643719828
Energy: 1.245591808536428
Energy: 1.3133984219950139
Energy: 1.3234325780618297
Energy: 1.2254385750117407
Energy: 1.2908312405600744
Energy: 1.665350494668784
Energy: 1.2226515490839445
Energy: 1.2224203531702682
Energy: 1.657086564674055
Energy: 1.1929631062496935
Energy: 1.236993290412913
Energy: 1.6584080186796362
Energy: 1.3658806112191617
Energy: 1.3870539182674075
Energy: 1.597823345241373
Energy: 1.3669272533896224
Energy: 1.418023198202124
Energy: 1.3546575493881805
Energy: 1.2257825712472545
Energy: 1.415151142936201
Energy: 1.3764285266652847
Energy: 1.3886076887118137
Energy: 1.3645484427196233
Energy: 1.4495133672658012
Energy: 1.5353129174468894
Energy: 1.2976019452966123
Energy: 1.4524244450862038
Energy: 1.5741508177664865
Energy: 1.206859692037119
Energy: 1.2298099801440676
Energy: 1.2091157513161588
Energy: 1.162332113770282
Energy: 1.192303654739636
Energy: 1.3888471548796721
Energy: 1.1416114927402632
Energy: 1.4248182462295207
Energy: 1.203097436917055
Energy: 1.2983268422040317
Energy: 1.4085332137971045
Energy: 1.203924469711576
Energy: 1.371028513150988
Energy: 1.4314711948910472
Energy: 0.9108342618039388
Energy: 0.9107721312196545
Energy: 1.438391178391005
Energy: 0.9511941911010813
Energy: 0.911355130700846
Energy: 1.422293415814636
Energy: 1.1179951105413408
Energy: 1.1182403598753496
Energy: 1.3562644779620334
Energy: 1.0827783732709608
Energy: 1.1448420828256807
Energy: 1.3082343104714051
Energy: 1.3248418777885358
Energy: 1.247796063609792
Energy: 1.2934252731825615
Energy: 1.281022992366702
Energy: 1.2000536253960674
Energy: 1.0747339675621115
Energy: 1.3190100759277474
Energy: 1.0404357853472217
Energy: 1.059604188769574
Energy: 1.3942574496605187
Energy: 1.007548707764481
Energy: 1.4198459360347213
Energy: 1.493268120422708
Energy: 1.3513451001611338
Energy: 1.3550635767237815
Energy: 1.5201223701963245
Energy: 1.3340612334841044
Energy: 1.4346131414874643
Energy: 1.307947576286281
Energy: 1.4411253819214278
Energy: 1.3407551911367601
Energy: 1.420984954764418
Energy: 1.2307656644409728
Energy: 1.7631614111120915
Energy: 1.6395776100780182
Energy: 1.43953249383457
Energy: 1.7550635604783593
Energy: 1.6090588071723109
Energy: 1.4392071515201015

minimum gb energy = 0.9107721312196545 eV
minimum distance =  2.5204635257794 Angstroms
sigma value = 57


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

Energy: 1.5978427131590178
Energy: 1.1963676597977355
Energy: 1.183312833112188
Energy: 1.4544298987656423
Energy: 1.4683413418820475
Energy: 1.5421191938808998
Energy: 1.5170722533311713
Energy: 1.0877404193651663
Energy: 1.0875029733168347
Energy: 1.4056242503889307
Energy: 1.0819530899997647
Energy: 1.3515799722410393
Energy: 1.4558350963220072
Energy: 1.3290264026363345
Energy: 1.2357526617025505
Energy: 1.2686436250783495
Energy: 1.4501058546203272
Energy: 1.3018930383527445
Energy: 1.0784877671325397
Energy: 1.3623411187433911
Energy: 1.3883621729321738
Energy: 1.0906177872096454
Energy: 1.4810765876477254
Energy: 1.0831881624501865
Energy: 1.2087794468311963
Energy: 1.2437902879708729
Energy: 1.2483219905596656
Energy: 1.161926346003833
Energy: 1.4367413084922651
Energy: 1.1301539797572433
Energy: 1.3277539644877216
Energy: 1.228789251686184
Energy: 1.24195807043147
Energy: 1.4025903410798872
Energy: 1.2274113058686469
Energy: 1.306513726807165
Energy: 1.415337464478399
Energy: 1.0898145258771919
Energy: 1.09068668723472
Energy: 1.4141572010766965
Energy: 1.084036192191379
Energy: 1.1117666260293153
Energy: 1.4039750336255643
Energy: 1.373874415158581
Energy: 1.405045761163842
Energy: 1.4055443670692582
Energy: 1.3014749261124219
Energy: 1.4121334501381804
Energy: 1.3485739978347713
Energy: 1.3139909133409813
Energy: 1.1399325279277452
Energy: 1.3575609679893104
Energy: 1.3147011717070558
Energy: 1.4093366681973627
Energy: 1.5006289135827087
Energy: 1.5433411938119979
Energy: 1.4788171404131474
Energy: 1.4557252534743192
Energy: 1.6131017726965227
Energy: 1.2937186620217385
Energy: 1.3327770492764008
Energy: 1.217873952355823
Energy: 1.346543577994234
Energy: 1.3370502793243075
Energy: 1.396384288214064
Energy: 1.2963794338747023
Energy: 1.421263422523586
Energy: 1.3746487441355395
Energy: 1.278610346811064
Energy: 1.4233549464234787
Energy: 1.4935843191612745
Energy: 1.2734679033626213
Energy: 1.7679669063319607
Energy: 1.2778442448711933
Energy: 1.1337593501418923
Energy: 1.421949669401609
Energy: 1.2945475401929305
Energy: 1.2774535795393522
Energy: 1.615312055991129
Energy: 1.2096836854405193
Energy: 1.2662256021718767
Energy: 1.4839447985216294
Energy: 1.3181394128946777
Energy: 1.4036079464918556
Energy: 1.3052446051042097
Energy: 1.3839192578802184
Energy: 1.3832077600604973
Energy: 1.3073939408661268
Energy: 1.3890834493309008
Energy: 1.3019507519796554
Energy: 1.0567325528019087
Energy: 1.2998579115189228
Energy: 1.1778433353583475
Energy: 1.0573129852286587
Energy: 1.4729444154259217
Energy: 1.0929081724308864
Energy: 1.3169250834400645
Energy: 1.344027630097887
Energy: 1.353857540973912
Energy: 1.257250172362531
Energy: 1.3668582919595342
Energy: 1.232990077998379
Energy: 1.5696679259375457
Energy: 1.067082953415738
Energy: 1.0687720709526038
Energy: 1.4532136819211328
Energy: 1.134720351587418
Energy: 1.2330999776656537
Energy: 1.4506477746032085
Energy: 1.1088785275187552
Energy: 1.119337534716898
Energy: 1.46589705147107
Energy: 1.0853227990026773
Energy: 1.171375540470441
Energy: 1.472636626224695
Energy: 1.3183696133990168
Energy: 1.3002658973533057
Energy: 1.4174958908497843
Energy: 1.3117171348605416
Energy: 1.3782448636646207
Energy: 1.3356450218762304
Energy: 1.1714411936182358
Energy: 1.1956697267679441
Energy: 1.3639264141033391
Energy: 1.3464844506127511
Energy: 1.2430159916948582
Energy: 1.6536894688453396
Energy: 1.5066723077813764
Energy: 1.2329583342408947
Energy: 1.589683865384685
Energy: 1.6014736032468266
Energy: 1.2329333479986448
Energy: 1.4789910894849918
Energy: 1.1935338869368946
Energy: 1.1844210461852993
Energy: 1.4484121698744439
Energy: 1.2491868989727142
Energy: 1.2043386165892962
Energy: 1.844928088240835
Energy: 1.197247736437109
Energy: 1.2579442497432893
Energy: 1.5996800602124641
Energy: 1.199197609397027
Energy: 1.3727916360521986

minimum gb energy = 1.0567325528019087 eV
minimum distance =  2.48872778564163 Angstroms
sigma value = 17


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

Energy: 1.4278395603703284
Energy: 1.0895412439259324
Energy: 1.089397805866253
Energy: 1.4292489860850968
Energy: 1.477857891997115
Energy: 1.310685252820539
Energy: 1.3207978715636173
Energy: 1.1531633523222466
Energy: 1.1019747933878186
Energy: 1.2513891782661677
Energy: 1.1555834694373084
Energy: 1.2434442997448267
Energy: 1.2931026771405105
Energy: 1.2237644815314308
Energy: 1.1538219007149535
Energy: 1.1892533923071107
Energy: 1.4075865854287508
Energy: 1.1691106941658003
Energy: 0.9681318322515964
Energy: 1.1740278780813118
Energy: 1.17401139085539
Energy: 0.9691622817672607
Energy: 1.2569493952379018
Energy: 0.9658847898305742
Energy: 1.0785618812381146
Energy: 1.2371444655380808
Energy: 1.0925170402460616
Energy: 1.0784455542820286
Energy: 1.2584331413711
Energy: 1.1395105297813326
Energy: 1.341308808852744
Energy: 0.8909923617064079
Energy: 1.0741919345777378
Energy: 1.3160494530476674
Energy: 0.9592492953080913
Energy: 1.1878016811466319
Energy: 1.2378657689641155
Energy: 0.8242992890020406
Energy: 0.8539592287701173
Energy: 1.2172632887575976
Energy: 0.8278306817751172
Energy: 0.9776828004081494
Energy: 1.2892769188985957
Energy: 1.1804413027509384
Energy: 1.2069353311381552
Energy: 1.2909725299451194
Energy: 1.177448503989901
Energy: 1.2081851354910715
Energy: 0.8961912928235003
Energy: 1.18501229896468
Energy: 1.047878386816103
Energy: 0.8977285998341014
Energy: 1.1967163297622347
Energy: 0.8247648229548153
Energy: 1.029362979900521
Energy: 1.2517102131547955
Energy: 1.0994663947400214
Energy: 0.9539210955383115
Energy: 1.3337430721596149
Energy: 1.1011512051639416
Energy: 1.3844478594575114
Energy: 1.1954990232273248
Energy: 1.1336861389543524
Energy: 1.2649478392935218
Energy: 1.1866465507126465
Energy: 1.1085462067223935
Energy: 1.4673438066115636
Energy: 0.9655437507520174
Energy: 0.9663920194480429
Energy: 1.3500004229688707
Energy: 0.9690240517986155
Energy: 0.9659408043298673
Energy: 1.4400442152107193
Energy: 1.1889643045505554
Energy: 1.2047298588152786
Energy: 1.4415877514272948
Energy: 1.1916595375001464
Energy: 1.2701179585534699
Energy: 1.172225524887677
Energy: 1.3465738507530083
Energy: 1.1634390178292908
Energy: 1.1736794080251574
Energy: 1.348381231509044
Energy: 1.2361787689747086
Energy: 1.2920654545609576
Energy: 1.4807744270564405
Energy: 1.1440781680127472
Energy: 1.2926763576419973
Energy: 1.4815954079111688
Energy: 1.145369853710469
Energy: 1.2853622314858477
Energy: 1.1615455276932383
Energy: 1.2195645670489923
Energy: 1.2870676118721502
Energy: 1.3454138109820026
Energy: 1.178313693462394
Energy: 1.531407053208443
Energy: 1.188290946802388
Energy: 1.1194162903395921
Energy: 1.5005108730913286
Energy: 1.2459535464096094
Energy: 1.186021297829607

minimum gb energy = 0.8242992890020406 eV
minimum distance =  2.52914580577072 Angstroms
sigma value = 17


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

Energy: 1.4889153346456692
Energy: 1.0278450727090642
Energy: 1.335196195595187
Energy: 1.5261603499860172
Energy: 1.3603172591765547
Energy: 1.2023001994288627
Energy: 1.3154389839299236
Energy: 1.0412790514157682
Energy: 0.9955209198816779
Energy: 1.187416052791512
Energy: 1.0830096600162775
Energy: 1.2191811057699817
Energy: 1.178794455519325
Energy: 1.2515567083110275
Energy: 1.1109423882416822
Energy: 1.1799737444765408
Energy: 1.3478075693882134
Energy: 1.0870730289844204
Energy: 0.9183758682118254
Energy: 1.042803381602616
Energy: 0.9396112962703824
Energy: 0.919651558477386
Energy: 1.2911829162930675
Energy: 0.9331593435301255
Energy: 1.1260089191621785
Energy: 1.1531618744156404
Energy: 1.1530073776963823
Energy: 1.1261136426299783
Energy: 1.2008367760176735
Energy: 1.0966113720042245
Energy: 1.353307271757642
Energy: 0.8333793134792542
Energy: 1.1416640063566035
Energy: 1.3341460490821457
Energy: 0.833122858718266
Energy: 1.1723805409614854
Energy: 1.2502731741658337
Energy: 0.7970852162048855
Energy: 0.7902030912863041
Energy: 1.1412576307032145
Energy: 0.7929378214280162
Energy: 1.0419696477805833
Energy: 1.1302519768769252
Energy: 1.1129463102183612
Energy: 1.1783298241858502
Energy: 1.1317795335166492
Energy: 1.2591063084718352
Energy: 1.124763487227852
Energy: 0.7529464998106676
Energy: 1.0214868495223177
Energy: 0.7857774196754601
Energy: 0.7542621396571991
Energy: 1.064911059419986
Energy: 0.7896157322287926
Energy: 1.0687745652981524
Energy: 1.101027442517323
Energy: 1.03625366013406
Energy: 0.8544696059766508
Energy: 1.2198853232919054
Energy: 0.9377725467760414
Energy: 1.2200440657272402
Energy: 0.9616998802588285
Energy: 0.9121940830275274
Energy: 1.221469608762346
Energy: 0.8014909563149637
Energy: 1.0237334805210359
Energy: 1.2065944160637962
Energy: 0.7929749947340486
Energy: 0.7894360808465484
Energy: 1.1603902265917094
Energy: 0.7720697323911212
Energy: 0.7893318868984742
Energy: 1.3346880764692213
Energy: 1.1931446041317502
Energy: 1.0807444379637818
Energy: 1.1979011545099105
Energy: 1.181722864613554
Energy: 1.0675435314915191
Energy: 0.8398740510659296
Energy: 1.0330147113905872
Energy: 1.0562591307251552
Energy: 0.7909137001376497
Energy: 1.1408965736766588
Energy: 0.8056837432417743
Energy: 0.9942564185514792
Energy: 1.2781260512171366
Energy: 1.2147487352712012
Energy: 0.9410563671156433
Energy: 1.3028812322160739
Energy: 1.0193867842946938
Energy: 1.24915425093888
Energy: 1.046730481047353
Energy: 1.0454604543415773
Energy: 1.2533490743288263
Energy: 1.0737181566826595
Energy: 1.0006412526980646
Energy: 1.3694736237880458
Energy: 0.9171435924247654
Energy: 0.9174232772500718
Energy: 1.3736106844995706
Energy: 0.922434240380518
Energy: 1.0411606441787973
Energy: 1.3748166132602002
Energy: 1.1347056514026366
Energy: 1.1160926306056418
Energy: 1.3243682381475481
Energy: 1.0997653854134875
Energy: 1.097400988681912
Energy: 1.1032995349246135
Energy: 1.0362243848514177
Energy: 1.1953155984596942
Energy: 1.100138434851751
Energy: 1.2755820130424986
Energy: 1.1645126188240447
Energy: 1.280218273393751
Energy: 1.4232713288270435
Energy: 1.3073418532952503
Energy: 1.2803906022802656
Energy: 1.4546522991681603
Energy: 1.116375327728568
Energy: 1.2698048633010384
Energy: 1.255994131595008
Energy: 1.0134098102210665
Energy: 1.184928275828416
Energy: 1.2608473493707988
Energy: 1.0583173949329479
Energy: 1.5682879863996189
Energy: 1.1393800904514382
Energy: 1.049989457515055
Energy: 1.4508914329000682
Energy: 1.14320825926442
Energy: 1.0830473083857026
Energy: 1.4507271603183949
Energy: 1.0807166710041223
Energy: 1.0975761138600557
Energy: 1.344773942156936
Energy: 1.0959376077777894
Energy: 1.1270387105693989
Energy: 1.1908996842174513
Energy: 1.1329363494577116
Energy: 1.0710150002537548
Energy: 1.1924331890940747
Energy: 1.2723861885266756
Energy: 1.0559574943711216
Energy: 0.9827600851295181
Energy: 1.3407651796445168
Energy: 1.1785506081944295
Energy: 0.9224850489132956
Energy: 1.3894281402417692
Energy: 1.249314195705808
Energy: 0.9801821042008191
Energy: 1.0643630053171094
Energy: 1.023660932400976
Energy: 0.9813950795843613
Energy: 1.2160393494431543
Energy: 1.1680822406764033
Energy: 1.3875423669247846
Energy: 1.1324760109222949
Energy: 1.120347773441803
Energy: 1.3889189763039043
Energy: 1.0821029231910129
Energy: 1.1691611340505257
Energy: 1.2323903437153134
Energy: 0.8268838710108812
Energy: 0.8218422329792197
Energy: 1.1154988768335172
Energy: 0.7922925932318873
Energy: 0.821592327863431
Energy: 1.2475887049186556
Energy: 1.1169156416241819
Energy: 1.0759863784642894
Energy: 1.1726302707976415
Energy: 1.1698885301146897
Energy: 1.1048488144400779
Energy: 0.7982447375697991
Energy: 1.1617856956969055
Energy: 1.0251414959316665
Energy: 0.8476234126744303
Energy: 1.2451152497389502
Energy: 0.785282190913959
Energy: 0.8809101315106271
Energy: 1.0045640887190093
Energy: 0.9899992271840485
Energy: 0.7744493778573359
Energy: 1.0807720947816204
Energy: 0.9007798391975972
Energy: 1.1635748297833517
Energy: 1.0437275994220439
Energy: 1.0938392752292152
Energy: 1.1626660032110505
Energy: 1.076420796670916
Energy: 1.0007276044914966
Energy: 1.1166331561544338
Energy: 0.7581383950425169
Energy: 0.7522920759053908
Energy: 1.1175480271017924
Energy: 0.7532286732705114
Energy: 0.7683199204133975
Energy: 1.2479520652117604
Energy: 0.8736842086705406
Energy: 1.0967439453575087
Energy: 1.250297677535145
Energy: 0.9704245294233392
Energy: 1.0521913418519384
Energy: 0.8491598712623954
Energy: 1.1126078587606236
Energy: 1.010006728836113
Energy: 0.8980793380465931
Energy: 1.1139131273008485
Energy: 1.066347116197608
Energy: 0.827016311821645
Energy: 1.183275036003805
Energy: 1.0237793794557337
Energy: 0.8284761249008444
Energy: 1.2663599453665177
Energy: 0.8212955616423354
Energy: 1.2497038484582463
Energy: 1.1016342934125167
Energy: 1.1553093972878519
Energy: 1.1758494396193049
Energy: 1.2003804275577694
Energy: 1.1176461905058825
Energy: 1.254149548957936
Energy: 0.9071783266620422
Energy: 0.9170501984161681
Energy: 1.2040008999184524
Energy: 0.9033993949895727
Energy: 0.9166826004486657
Energy: 1.4400745608463148
Energy: 1.1166114073745739
Energy: 1.076742492860546
Energy: 1.420474827305955
Energy: 1.1048546597795077
Energy: 1.245851417754492
Energy: 1.183377677130503
Energy: 1.1291345163125923
Energy: 0.9752545171046325
Energy: 1.1681897756080362
Energy: 1.2889431603311536
Energy: 1.126957018551174
Energy: 1.1936449014423427
Energy: 1.3637969841967619
Energy: 1.157153154457916
Energy: 1.1085969104292703
Energy: 1.4811452933848284
Energy: 0.9861318179958619
Energy: 1.174757041163199
Energy: 1.2361483871358339
Energy: 1.0546509166917262
Energy: 1.1760391868604847
Energy: 1.2659824034663216
Energy: 1.2038728004133352
Energy: 1.440145547281012
Energy: 1.1474168612054427
Energy: 1.1663236707273894
Energy: 1.3164751616528068
Energy: 1.1619636849564445
Energy: 1.0916429968976151

minimum gb energy = 0.7522920759053908 eV
minimum distance =  2.51844188090864 Angstroms
sigma value = 57


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

Energy: 1.401381208959219
Energy: 0.9682469150369419
Energy: 1.110291161081833
Energy: 1.4027139198574718
Energy: 1.2706167289178727
Energy: 1.1886076127630976
Energy: 1.1961107190527662
Energy: 0.981694760061425
Energy: 0.9503143087145498
Energy: 1.196621747069317
Energy: 0.9969601711217674
Energy: 1.012385981662872
Energy: 1.0889806499014631
Energy: 1.129910595439937
Energy: 1.1395182949267446
Energy: 1.0900793475446413
Energy: 1.3028642573972118
Energy: 1.030798680513691
Energy: 0.8731871815096774
Energy: 1.1684304861698696
Energy: 1.0021476178078819
Energy: 0.8743537877411466
Energy: 1.1709935521976997
Energy: 0.8867387706690917
Energy: 1.1028301186320073
Energy: 1.089623260342581
Energy: 1.0827063585579677
Energy: 1.0256698671621451
Energy: 1.0990519472421083
Energy: 1.012522744743528
Energy: 1.2831910372867081
Energy: 0.7902270826047937
Energy: 1.0800401506319688
Energy: 1.2850999818803075
Energy: 0.8036753249264091
Energy: 1.083701153656415
Energy: 1.15247365601138
Energy: 0.7652699489621085
Energy: 0.7679452249746259
Energy: 1.087695589937516
Energy: 0.7620879203649829
Energy: 1.045963725436292
Energy: 1.0441879163920365
Energy: 1.0557182406080932
Energy: 1.0649960066360167
Energy: 1.0304596481083557
Energy: 1.2029893554245235
Energy: 1.1368853369059786
Energy: 0.7358466689512733
Energy: 0.9420962267953227
Energy: 0.7341658132037984
Energy: 0.7373691074091631
Energy: 1.127072069359653
Energy: 0.7346845236514236
Energy: 1.17563568063045
Energy: 1.0668894627634886
Energy: 0.9672339955361643
Energy: 1.0708835717952738
Energy: 1.1699625326287257
Energy: 0.9811754149185227
Energy: 1.185273151181027
Energy: 0.8660353054376922
Energy: 0.8690368645079016
Energy: 1.1875597389138253
Energy: 0.7355311854740719
Energy: 0.9373381100225965
Energy: 1.1099018596740076
Energy: 0.7109753125335508
Energy: 0.7230628000421409
Energy: 1.0708446394998257
Energy: 0.7090397724189587
Energy: 0.9078185427070099
Energy: 1.1404404217612172
Energy: 1.081542051046648
Energy: 0.9889557598557293
Energy: 1.1355326424692518
Energy: 1.1195395569328253
Energy: 0.9687147009258098
Energy: 0.6922980206990351
Energy: 0.9448752434935738
Energy: 0.7234027996271075
Energy: 0.6936868063758583
Energy: 1.0027001604311465
Energy: 0.6915377345354857
Energy: 0.9609949987997951
Energy: 1.0456147726707854
Energy: 0.9760265547590379
Energy: 0.9212435254290502
Energy: 1.1755095644295133
Energy: 0.9477219166022415
Energy: 1.1128448121167485
Energy: 0.7910468204722347
Energy: 0.9854526067403122
Energy: 1.1145729566075064
Energy: 0.8284149442955606
Energy: 0.8808173331024416
Energy: 1.2230083969532668
Energy: 0.7431996546897216
Energy: 0.7351951235144414
Energy: 1.17223130645085
Energy: 0.739252486707298
Energy: 0.7339879530541299
Energy: 1.22961882427155
Energy: 1.0786073909741303
Energy: 1.0063362352850425
Energy: 1.228481937895201
Energy: 1.12973988766055
Energy: 0.9785689306538018
Energy: 0.7691772308838293
Energy: 0.9543839542615554
Energy: 0.7892337305039052
Energy: 0.7708185153147719
Energy: 1.090691088058721
Energy: 0.7800013533922326
Energy: 1.0171585400586831
Energy: 1.2475972143206013
Energy: 1.1131284012641702
Energy: 1.0068373335399936
Energy: 1.306799856585845
Energy: 1.1242956677673135
Energy: 1.1712318125873464
Energy: 0.9277543072962241
Energy: 0.880653984529863
Energy: 1.140801784046301
Energy: 0.9250454865922436
Energy: 0.9455350589247902
Energy: 1.3556079977343938
Energy: 0.881244157522629
Energy: 0.8505594486770724
Energy: 1.3215036322294147
Energy: 0.8778173277394072
Energy: 1.1882359761150405
Energy: 1.3335178469620614
Energy: 1.0702223349859772
Energy: 1.072424718445787
Energy: 1.2571129016671398
Energy: 1.0514205684051838
Energy: 1.082364339975841
Energy: 1.0322728573948543
Energy: 1.1166256734338378
Energy: 1.0902561567978035
Energy: 1.0336435328174352
Energy: 1.247809596666101
Energy: 1.0849241183925737
Energy: 1.1380582820741416
Energy: 1.3164118187192106
Energy: 1.2358989848991704
Energy: 1.1391699611688015
Energy: 1.432644226901025
Energy: 1.115173986721875
Energy: 1.1489666600980508
Energy: 1.1196605197563139
Energy: 0.9348523303050881
Energy: 1.1498785837385816
Energy: 1.156078752266704
Energy: 1.0013232586864886
Energy: 1.4153796851015847
Energy: 1.0835697869079763
Energy: 1.1689070025649184
Energy: 1.417214190895681
Energy: 1.0791911105009748
Energy: 1.1806353751317293

minimum gb energy = 0.6915377345354857 eV
minimum distance =  2.50913046557339 Angstroms
sigma value = 43


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

Energy: 1.295019553469138
Energy: 0.8431824148854588
Energy: 0.9999787608303758
Energy: 1.280898230511381
Energy: 1.0986437295770402
Energy: 1.0168723155762012
Energy: 1.072234235076504
Energy: 0.8584948991673623
Energy: 0.815895747332085
Energy: 0.9187519635814694
Energy: 0.8753028506977303
Energy: 0.810276518647941
Energy: 0.9245600638015685
Energy: 1.0643426672643268
Energy: 1.0452397954024977
Energy: 0.9259209861132768
Energy: 1.1277005827726887
Energy: 0.9080996417595913
Energy: 0.7622465797590257
Energy: 0.9790585252792912
Energy: 0.8046094244989678
Energy: 0.7630972704812716
Energy: 1.0606990429935725
Energy: 0.7703774408948507
Energy: 1.1345709135516
Energy: 0.9154033931422096
Energy: 0.8471464063696861
Energy: 0.9297016041617527
Energy: 0.9074327572923673
Energy: 0.8505358540976575
Energy: 1.2154738144345463
Energy: 0.6942940904293088
Energy: 0.9382928229317917
Energy: 1.217357549019132
Energy: 0.693990973735565
Energy: 1.004029329241476
Energy: 1.01714038883874
Energy: 0.6873024214185428
Energy: 0.6873032450705793
Energy: 0.9604117707439335
Energy: 0.6935511564349887
Energy: 0.8790368224942982
Energy: 0.8807974865349143
Energy: 1.038263737144833
Energy: 1.0101016084532686
Energy: 0.8822435008811865
Energy: 1.1254027680496086
Energy: 0.9494381819282598
Energy: 0.6470561429322993
Energy: 0.8021414302933699
Energy: 0.6464185043917889
Energy: 0.6487116659534173
Energy: 1.0934952139168088
Energy: 0.6460425875780385
Energy: 1.0371895825289805
Energy: 0.9245238925342979
Energy: 0.8953053063006934
Energy: 0.9780668144078364
Energy: 0.9606160515414657
Energy: 0.8273687398994867
Energy: 1.1405827535423898
Energy: 0.624283620661905
Energy: 0.624810490164694
Energy: 1.1422742772097894
Energy: 0.628616021800007
Energy: 0.9412058378222248
Energy: 1.0728727427321958
Energy: 0.6140098915908441
Energy: 0.6137776926522736
Energy: 0.9790509395889959
Energy: 0.6136981089854344
Energy: 0.8026253602246837
Energy: 0.9405794108283207
Energy: 1.017550875400985
Energy: 0.9376079994827602
Energy: 0.9413442437791845
Energy: 1.1028395673110338
Energy: 0.878395814389432
Energy: 0.5903782154419172
Energy: 0.8705168563138427
Energy: 0.6049049437945088
Energy: 0.591939783669759
Energy: 0.9450459263720472
Energy: 0.604941729754446
Energy: 1.0416984326975083
Energy: 0.9361853163926623
Energy: 0.9227915875242805
Energy: 0.966038030908145
Energy: 0.9513133478987059
Energy: 0.8696938880889634
Energy: 1.0726305269238534
Energy: 0.5981006743616677
Energy: 0.5983222121677924
Energy: 1.0198722523013597
Energy: 0.628513034857086
Energy: 0.8436217421284732
Energy: 1.0217462291135575
Energy: 0.598347008175862
Energy: 0.5987066876266971
Energy: 1.0051455505290228
Energy: 0.5981371383301872
Energy: 0.7318133443320641
Energy: 0.9981732112579654
Energy: 0.9551601852537839
Energy: 0.871050402060317
Energy: 0.8823051374515719
Energy: 1.0193607165630696
Energy: 0.8354784616416077
Energy: 0.583206363397247
Energy: 0.8258191477152097
Energy: 0.5904656683821855
Energy: 0.5841465564893135
Energy: 0.8286527989010567
Energy: 0.5832606966418435
Energy: 0.9608689589077871
Energy: 0.9975738386924663
Energy: 0.8910002609201311
Energy: 0.93248451452152
Energy: 1.0760082060352147
Energy: 0.866088973680546
Energy: 0.9950606571663658
Energy: 0.6064092347860375
Energy: 0.8164262962617099
Energy: 0.987808592660831
Energy: 0.6355856916606704
Energy: 0.7392076850290844
Energy: 1.1076858860783214
Energy: 0.6050611120113905
Energy: 0.6058735220176563
Energy: 1.041422247779023
Energy: 0.6052073388466088
Energy: 0.8797458461241271
Energy: 1.065829530657081
Energy: 0.8959043602441956
Energy: 0.8866935672159044
Energy: 1.0075012454578245
Energy: 0.946690716469709
Energy: 0.8591390042364642
Energy: 0.6126484789742076
Energy: 0.9858438467063387
Energy: 0.6199813206636403
Energy: 0.6142874228332521
Energy: 0.9736544099209891
Energy: 0.6199799834408395
Energy: 0.9154574013339651
Energy: 1.0548347849849098
Energy: 0.9863316721020334
Energy: 0.9106866885905924
Energy: 1.1402082711410648
Energy: 0.927495938758544
Energy: 1.051670029042786
Energy: 0.6388798251209454
Energy: 0.6385555988681297
Energy: 0.9886537488657825
Energy: 0.6388029543216923
Energy: 0.7833273455517037
Energy: 1.1810100134786254
Energy: 0.6465266641144584
Energy: 0.6461796045105919
Energy: 1.1825209864593167
Energy: 0.6541296701763069
Energy: 0.982843083052599
Energy: 1.080291644935635
Energy: 0.922509911080518
Energy: 0.9112964058553316
Energy: 1.0249625607769317
Energy: 0.9604595470454123
Energy: 0.8354180660982162
Energy: 0.6885807202674891
Energy: 0.8166289513323592
Energy: 0.6872018677666442
Energy: 0.6899069353497674
Energy: 1.102923052538571
Energy: 0.6873843687908375
Energy: 0.9125358171230583
Energy: 1.0801458608949177
Energy: 1.0564495046518532
Energy: 0.8667582924630014
Energy: 1.1678082530629743
Energy: 0.9945667236348433
Energy: 1.0025989128948964
Energy: 0.7590309147736696
Energy: 0.7589921330179087
Energy: 1.0025302799362164
Energy: 0.7647458230781018
Energy: 0.8010603069186756
Energy: 1.262211208883746
Energy: 0.7623570434080558
Energy: 0.963232576839915
Energy: 1.2636103380435075
Energy: 0.7617368394565014
Energy: 1.021941105838014
Energy: 1.1884352443117032
Energy: 0.8944168303390406
Energy: 0.8586876793679261
Energy: 0.9798098278276287
Energy: 0.8873467109945147
Energy: 0.813132028147803
Energy: 0.8845409088189434
Energy: 0.8475309757341772
Energy: 0.8176903790624934
Energy: 0.8858010931438423
Energy: 1.0828149836822485
Energy: 0.8120480379599635
Energy: 0.9279657708670362
Energy: 1.1125813916828307
Energy: 0.8922608861443169
Energy: 0.9247140956665288
Energy: 1.078090762015054
Energy: 0.8310785565790432
Energy: 1.0302461939925418
Energy: 0.8996066256908047
Energy: 0.8151131048471871
Energy: 0.9125662667924553
Energy: 0.9274837749427883
Energy: 0.8070285407578435

minimum gb energy = 0.583206363397247 eV
minimum distance =  2.51662388366898 Angstroms
sigma value = 81


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

Energy: 0.06371101811104023
Energy: 0.43276985720950945
Energy: 0.43210845694245203
Energy: 0.06593390172212746
Energy: 0.4343620467998272
Energy: 0.06423550076277186
Energy: 0.54478716490339
Energy: 0.0642807990750046
Energy: 0.06469424465003491
Energy: 0.5450601045620357
Energy: 0.06698504004152717
Energy: 0.06426520595191071
Energy: 0.5549760066228006
Energy: 0.0641005267226336
Energy: 0.25169782347900893
Energy: 0.5569529368763922
Energy: 0.06413305687023362
Energy: 0.7313617890360239
Energy: 0.06559069335757968
Energy: 0.06448055141014415
Energy: 0.2517594888502207
Energy: 0.06464061072106186
Energy: 0.06420615191022665
Energy: 0.7315421842652594
Energy: 0.7316531166053658
Energy: 0.5580941719159657
Energy: 0.5451609902759753
Energy: 0.2514923938850114
Energy: 0.5492447556239933
Energy: 0.2692769445587259
Energy: 0.06479098405146139
Energy: 0.2524897377135503
Energy: 0.4326367919454723
Energy: 0.06614129981482372
Energy: 0.06466343683443766
Energy: 0.0643119512598079
Energy: 0.6080174652039914
Energy: 0.06428003834544287
Energy: 0.06446682828203949
Energy: 0.5497777865085363
Energy: 0.06431525928488097
Energy: 0.064658211618769
Energy: 0.5516824270988246
Energy: 0.06423908199326082
Energy: 0.2541106154311343
Energy: 0.5513206977291978
Energy: 0.06408354169807141
Energy: 0.25170515258867976
Energy: 0.06566992040106202
Energy: 0.43168703986947343
Energy: 0.433193214024546
Energy: 0.06567935789831969
Energy: 0.25162176794678437
Energy: 0.7311939081040496
Energy: 0.251564198897973
Energy: 0.5582262742244245
Energy: 0.5449791034802552
Energy: 0.25162297874783435
Energy: 0.5485772848527166
Energy: 0.26891254440518164

minimum gb energy = 0.06371101811104023 eV
minimum distance =  2.67900410199611 Angstroms
sigma value = 3


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

Energy: 1.337359403673806
Energy: 1.1808887792628133
Energy: 1.0340648644906116
Energy: 1.3773768501187738
Energy: 1.3093042149266751
Energy: 1.178980580898618
Energy: 0.9201861758544018
Energy: 0.8651595478095038
Energy: 0.8678107475076682
Energy: 0.9472809298806741
Energy: 0.8648984495439631
Energy: 0.891086635562472
Energy: 0.9082015784972319
Energy: 1.0933778617900642
Energy: 0.9980107622403829
Energy: 0.909032442813421
Energy: 1.1758983003140007
Energy: 0.9181248533759204
Energy: 0.8261809384411086
Energy: 0.9699499959431567
Energy: 0.9236330654874702
Energy: 0.8273678077468616
Energy: 1.2495640769321803
Energy: 0.9868242457031529
Energy: 1.1402347908573085
Energy: 0.8939380106474178
Energy: 0.8974081599485554
Energy: 0.9104440906112999
Energy: 0.8950899085411093
Energy: 0.9818730011219612
Energy: 1.3235738050199706
Energy: 0.9738136322960852
Energy: 1.0215241414382097
Energy: 1.291441919833633
Energy: 0.8987988804903462
Energy: 1.0648177455286214
Energy: 0.8918571530976581
Energy: 0.8780318054480853
Energy: 0.8635894092675077
Energy: 0.8918619532811405
Energy: 0.89306905784224
Energy: 0.842077769009127
Energy: 0.8427450648798711
Energy: 0.9567333703309866
Energy: 1.0542955984386406
Energy: 0.8426574155836696
Energy: 1.1332182372310735
Energy: 1.0258729878074266
Energy: 0.9219557258173036
Energy: 0.9571956733719558
Energy: 0.8956725321344428
Energy: 0.9232888447864166
Energy: 1.0664184526295692
Energy: 0.9548312887879884
Energy: 1.1029088974187078
Energy: 0.7763224380698289
Energy: 0.7763217480118944
Energy: 1.0412975967336515
Energy: 0.779246042059463
Energy: 0.7576665915337759
Energy: 1.2213889521362538
Energy: 0.7892892014814407
Energy: 0.9446952932002166
Energy: 1.1661077492968424
Energy: 0.791764494108024
Energy: 0.9707169914747152
Energy: 0.7770803049041433
Energy: 0.9177806449998552
Energy: 0.8486603406788245
Energy: 0.7073043204511789
Energy: 0.9281533526552221
Energy: 0.7466926808145165
Energy: 0.6651714102299963
Energy: 1.005837418262862
Energy: 0.9775968217473466
Energy: 0.6652647770456679
Energy: 1.134320871449689
Energy: 0.9556737577581222
Energy: 0.9743652110043676
Energy: 0.7635123066032139
Energy: 0.814463822642482
Energy: 0.9729502482497869
Energy: 0.7647849254393133
Energy: 0.854930481532192
Energy: 1.0751050159387336
Energy: 0.6398492232644948
Energy: 0.6400621000238461
Energy: 0.9888798100214293
Energy: 0.7104994722465598
Energy: 0.7565848003677657
Energy: 1.124595271144203
Energy: 0.840265086910774
Energy: 0.8425199300277268
Energy: 1.1021241427470088
Energy: 0.8699424757470363
Energy: 0.9115729432515509
Energy: 0.6298254745158408
Energy: 0.8747054256027106
Energy: 0.9496587083393536
Energy: 0.6292236089079525
Energy: 0.9200282170171377
Energy: 0.7014209440043728
Energy: 0.6318222894533996
Energy: 0.9839616715094219
Energy: 0.9617753743981565
Energy: 0.6313493911318547
Energy: 1.056222938784027
Energy: 0.7886383993060291
Energy: 1.0911819449038302
Energy: 0.7016130970460073
Energy: 0.844319152922206
Energy: 1.0540529004873984
Energy: 0.6965501163463528
Energy: 0.9190786297345908
Energy: 1.060150618607647
Energy: 0.6291660021623069
Energy: 0.6294935756606328
Energy: 0.8870872031881024
Energy: 0.6324383724414415
Energy: 0.7012887333304266
Energy: 1.0270863257654737
Energy: 0.9712548298827709
Energy: 0.9125664030466326
Energy: 0.9704345637987576
Energy: 1.0090322273741106
Energy: 0.8807196605443252
Energy: 0.6764366060241583
Energy: 0.899131962952396
Energy: 0.7091089616015503
Energy: 0.6772473812065083
Energy: 0.9691746023633786
Energy: 0.6740492045075324
Energy: 0.7500747789624933
Energy: 0.9056793282059009
Energy: 0.8755522671547079
Energy: 0.713694367424783
Energy: 0.9476052685365525
Energy: 0.8493704554711574
Energy: 1.1285548515267187
Energy: 0.665400690711784
Energy: 0.9815755157387958
Energy: 1.1733646434157026
Energy: 0.6654192999012536
Energy: 0.9858565233217613
Energy: 0.9403313101514523
Energy: 0.666121529681436
Energy: 0.6694441432017177
Energy: 0.940409010775245
Energy: 0.7004520344461633
Energy: 0.7465574154709999
Energy: 0.9406318834664005
Energy: 0.9714169597703776
Energy: 0.9539682562804158
Energy: 0.9245846790404247
Energy: 1.088126570867669
Energy: 0.9148962363762606
Energy: 0.776813889246595
Energy: 0.9722764578171287
Energy: 0.9461190201979158
Energy: 0.7782071989419491
Energy: 1.0975025189204208
Energy: 0.7762587869732238
Energy: 0.7962297198861209
Energy: 0.9152850921647949
Energy: 0.8613684338929632
Energy: 0.7549327777885699
Energy: 0.8962140442234862
Energy: 0.8915474822871465
Energy: 1.268231046367604
Energy: 0.8082238840396876
Energy: 0.8008762378583559
Energy: 1.2455826205014415
Energy: 0.7747432588506074
Energy: 1.0205095585893942
Energy: 1.0309620945059947
Energy: 0.8524843044970665
Energy: 0.8633911910094727
Energy: 0.9778990061591069
Energy: 0.8198425584925922
Energy: 0.842976253989722
Energy: 0.9301231419250775
Energy: 1.0855760614801744
Energy: 1.1302567696857524
Energy: 0.9303487594653932
Energy: 1.2083619569721593
Energy: 1.0686246673677047
Energy: 0.8979973719340998
Energy: 0.9404278811668423
Energy: 0.9330494387046978
Energy: 0.8991492646387608
Energy: 1.1337449091233704
Energy: 0.9202144234220172
Energy: 1.032981567506487
Energy: 0.8876664154094935
Energy: 0.8883657246085429
Energy: 0.9972085413334195
Energy: 0.8896621451768248
Energy: 0.9741503884132808

minimum gb energy = 0.6291660021623069 eV
minimum distance =  2.50419133326384 Angstroms
sigma value = 67


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

Energy: 1.308008975733334
Energy: 1.3129715166488392
Energy: 1.3081903179413394
Energy: 1.3099084907884195
Energy: 1.478866423086769
Energy: 1.3594248828300164
Energy: 1.132865302395209
Energy: 1.0065922220807615
Energy: 1.0047340321312388
Energy: 1.1888001314456753
Energy: 1.0047084425954271
Energy: 1.0784196620631588
Energy: 1.0582532949141057
Energy: 1.3148855180463812
Energy: 1.1462074342543664
Energy: 1.0593980972607013
Energy: 1.3708656560062675
Energy: 1.0785056838587717
Energy: 0.9742541015102347
Energy: 1.2971939393485594
Energy: 1.3186298075504215
Energy: 0.9707861832419464
Energy: 1.3848301601818218
Energy: 1.1615034980363967
Energy: 1.2561070566407042
Energy: 1.058425071175174
Energy: 1.1134413307423354
Energy: 1.198305695540553
Energy: 1.0482693607241627
Energy: 1.106713672559377
Energy: 1.2948459329004443
Energy: 1.1404277619726497
Energy: 1.2214110056385206
Energy: 1.4275417989445742
Energy: 1.0551068825520136
Energy: 1.179381648435365
Energy: 1.0315611550810357
Energy: 1.0964910050752739
Energy: 1.06788366954669
Energy: 0.9857265230169701
Energy: 1.0541818879779503
Energy: 0.9628782806709731
Energy: 0.9811329000331882
Energy: 1.1786645183865776
Energy: 1.1315668432952157
Energy: 0.9331775654383416
Energy: 1.244657365317063
Energy: 0.9967099227521311
Energy: 1.0874267500791117
Energy: 1.0659981393473674
Energy: 1.0712192856176808
Energy: 1.0884384783084733
Energy: 0.8744908222862816
Energy: 1.0444295504351337
Energy: 1.1949533250428908
Energy: 0.9050714408021544
Energy: 0.821793962597591
Energy: 1.1219404615762523
Energy: 0.9009210564000905
Energy: 0.9261702187295142
Energy: 1.2537139103691295
Energy: 0.9084391037949193
Energy: 1.0442456242439189
Energy: 1.2556071218820972
Energy: 0.9065142561672833
Energy: 1.1127692441508743
Energy: 0.7754721791985777
Energy: 1.0361336561455063
Energy: 1.14407246922449
Energy: 0.7764823915292767
Energy: 1.134831124690745
Energy: 0.8762094105880864
Energy: 0.7740148072994516
Energy: 1.1310386978584885
Energy: 1.1167572276943578
Energy: 0.7749704117962124
Energy: 1.164627860551356
Energy: 0.9897991565114066
Energy: 1.2287642090739903
Energy: 0.8906719626186003
Energy: 0.9902758474388434
Energy: 1.1814822993006995
Energy: 0.8874631782208381
Energy: 1.0450236996190236
Energy: 1.148021623884595
Energy: 0.8305690576919105
Energy: 0.795883792479284
Energy: 1.095249441222659
Energy: 0.817745471125854
Energy: 0.8989337684750411
Energy: 1.135965406156948
Energy: 0.9801523116108477
Energy: 0.9901053183722491
Energy: 1.1373178394008057
Energy: 0.8870318326391803
Energy: 0.990795769390188
Energy: 0.8536532535444563
Energy: 1.0375625532740698
Energy: 1.080790439800255
Energy: 0.8549664260535722
Energy: 1.1789588572056366
Energy: 0.8028385678874002
Energy: 0.8638219711030445
Energy: 1.0681271858431212
Energy: 1.007180506215914
Energy: 0.862986238422895
Energy: 1.0961437672775163
Energy: 0.9678334899905433
Energy: 1.2235496124280183
Energy: 0.9919879202835258
Energy: 1.1057895194237402
Energy: 1.3347901267666749
Energy: 0.9511062801948663
Energy: 1.1814714284809245
Energy: 1.118057854218506
Energy: 0.94503882519152
Energy: 0.9376560429174136
Energy: 1.073684993740194
Energy: 0.9348652169475268
Energy: 1.0211725962378106
Energy: 1.0352436697593617
Energy: 1.2197585407255198
Energy: 1.2659735428323737
Energy: 1.0133010730011642
Energy: 1.3005271693583258
Energy: 1.172898636344365
Energy: 1.099191909592777
Energy: 1.2556254773121818
Energy: 1.2268853394587846
Energy: 1.1001985282250712
Energy: 1.2864257322871404
Energy: 1.09342291010802
Energy: 1.1335705134421277
Energy: 0.9939741912749607
Energy: 0.988981267956464
Energy: 1.028534022730201
Energy: 0.9799708727218255
Energy: 1.0758800724720847

minimum gb energy = 0.7740148072994516 eV
minimum distance =  2.50556195026912 Angstroms
sigma value = 33


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

Energy: 1.449361106119272
Energy: 1.3774656395659197
Energy: 1.3611613528714916
Energy: 1.4517520726956772
Energy: 1.584072986182645
Energy: 1.369531900600335
Energy: 1.1042039341534307
Energy: 1.0714866635478677
Energy: 1.0749624342656712
Energy: 1.180393126309113
Energy: 1.098248854743009
Energy: 1.1230876069522242
Energy: 1.1422819634259687
Energy: 1.3184355637467864
Energy: 1.2620402525497334
Energy: 1.1434251754968712
Energy: 1.4569162739532693
Energy: 1.178003009817698
Energy: 1.0408816644694547
Energy: 1.223339370064187
Energy: 1.3089969733120417
Energy: 1.0381102836168539
Energy: 1.185875679041319
Energy: 1.2232114135472993
Energy: 1.3347934673032158
Energy: 1.1997448984563293
Energy: 1.2045676037981747
Energy: 1.1369660267207875
Energy: 1.1466717086989808
Energy: 1.2891075762439612
Energy: 1.4288589390592996
Energy: 1.2604198475594244
Energy: 1.290370931946078
Energy: 1.3494228618214843
Energy: 1.121903928178086
Energy: 1.2917431800643449
Energy: 0.9948326112879012
Energy: 1.1816753659242136
Energy: 1.163382142011258
Energy: 0.9949242881873537
Energy: 1.149792860276724
Energy: 1.0299391119659076
Energy: 1.0561658085926924
Energy: 1.1751569728784805
Energy: 1.1722198135373096
Energy: 0.9977832024284524
Energy: 1.2707569850341667
Energy: 1.0136763454437427
Energy: 1.2108341569654473
Energy: 1.0682266888634928
Energy: 1.0910940220775864
Energy: 1.1957541872332516
Energy: 0.9240891049120363
Energy: 1.1311820001382953
Energy: 1.2089633642031639
Energy: 0.8801038570680552
Energy: 0.8846324276533083
Energy: 1.206630268883513
Energy: 0.8758209865533964
Energy: 1.0197730996863237
Energy: 1.3424342361905572
Energy: 1.0271234099340287
Energy: 1.0865147730683118
Energy: 1.3122642036292353
Energy: 0.9717164437308444
Energy: 1.137103851151691
Energy: 0.8627947926736284
Energy: 1.18843843514652
Energy: 1.1824273599712414
Energy: 0.8628001623966618
Energy: 1.259496208136226
Energy: 1.1432100952520619
Energy: 0.8655724058748077
Energy: 1.164572899199623
Energy: 1.1467447244212645
Energy: 0.8652445904772303
Energy: 1.1243276421111879
Energy: 1.06721425701603
Energy: 1.3278424770414978
Energy: 1.0592241609242978
Energy: 1.1704934843336803
Energy: 1.3296632945685043
Energy: 1.0089636577546037
Energy: 1.2024248573958358
Energy: 1.0725224927477757
Energy: 1.0124072267640665
Energy: 1.0058257299728568
Energy: 1.0701513173575703
Energy: 1.0082625860123482
Energy: 1.0919544068690987
Energy: 1.1267896620240339
Energy: 1.1826329192865053
Energy: 1.18431461150621
Energy: 1.1203950643005807
Energy: 0.9959677527133605
Energy: 1.3025986144294868
Energy: 1.1950587061027846
Energy: 1.262331880902373
Energy: 1.2791621138029452
Energy: 1.1958031097455621
Energy: 1.431397727933184
Energy: 1.048193947135932
Energy: 1.1797871175192383
Energy: 1.0575777185343715
Energy: 1.058122290933038
Energy: 1.1746813078031932
Energy: 1.0829471834853077
Energy: 1.1843309228377175
Energy: 1.5277875692369653
Energy: 1.158041755976464
Energy: 1.3156477878208173
Energy: 1.4933487262115162
Energy: 1.0974639999014089
Energy: 1.251831344896761
Energy: 1.3139813907345703
Energy: 1.1437488893825238
Energy: 1.0803544021940092
Energy: 1.1035275353029355
Energy: 1.0879626765077737
Energy: 1.2202612364850502
Energy: 1.140649088163994
Energy: 1.2310225990759887
Energy: 1.2335186641833298
Energy: 1.1416592954495854
Energy: 1.1334788982328867
Energy: 1.178232957096533
Energy: 1.111496988484542
Energy: 1.3392736448005589
Energy: 1.226006077164645
Energy: 1.1126946160942854
Energy: 1.4918111342702696
Energy: 1.2230197305618369
Energy: 1.1352653420015018
Energy: 1.1573717614515646
Energy: 1.150382990993909
Energy: 1.135434248339408
Energy: 1.1527522866675706
Energy: 1.1662584108849952
Energy: 1.3461687616749034
Energy: 1.199454206846778
Energy: 1.287715316382995
Energy: 1.3476125227014386
Energy: 1.1356855100713108
Energy: 1.2870033172882271
Energy: 0.9950611721772498
Energy: 1.1705368694149347
Energy: 1.1698401255173794
Energy: 0.9954193883465794
Energy: 1.150401168732436
Energy: 1.214677018923605
Energy: 1.0569774463713928
Energy: 1.241316325813417
Energy: 1.173879049854419
Energy: 1.0580727702790202
Energy: 1.2223485202888622
Energy: 0.9941127773529689
Energy: 1.1817089393327516
Energy: 1.1235446138996625
Energy: 1.1221210074803922
Energy: 1.164488854490849
Energy: 0.924166549905588
Energy: 1.1317167959800185
Energy: 1.207410165712425
Energy: 0.8801761934905635
Energy: 0.8739156933661191
Energy: 1.2061439679629642
Energy: 0.8763929784487003
Energy: 1.0095480420951268
Energy: 1.3420124638232152
Energy: 0.9617789380841546
Energy: 1.1065015451173574
Energy: 1.2078113406366486
Energy: 0.9165845215054489
Energy: 1.1368245120763796
Energy: 0.8618529137120069
Energy: 1.1742250924469304
Energy: 1.1834793201087341
Energy: 0.8618162662485968
Energy: 1.2237389466240471
Energy: 1.1557317751502094
Energy: 0.8677508409885859
Energy: 1.2011185030440317
Energy: 1.196113378459794
Energy: 0.8682835714479117
Energy: 1.1817868566838245
Energy: 0.977508106981511
Energy: 1.314706334235169
Energy: 1.0072933921152125
Energy: 1.149807818500322
Energy: 1.2773977192200827
Energy: 1.0098251429031802
Energy: 1.117586055233609
Energy: 1.3148611041033602
Energy: 1.0006369503836676
Energy: 1.0057383334497776
Energy: 1.1128376086867204
Energy: 0.9962076985958428
Energy: 1.0728202959289634
Energy: 1.1257611066470126
Energy: 1.1299904624900539
Energy: 1.2754327107604992
Energy: 1.0951956938134164
Energy: 1.095509858742611
Energy: 1.1326422067859758
Energy: 1.1923009313211879
Energy: 1.3793218336916957
Energy: 1.2790707738013536
Energy: 1.1324422483266061
Energy: 1.3495361784106041
Energy: 1.13087983241431
Energy: 1.1782347011043277
Energy: 1.0811146885184382
Energy: 1.0580497677916743
Energy: 1.1729333362502712
Energy: 1.0841947617170764
Energy: 1.1279845594833615
Energy: 1.5533904016130557
Energy: 1.1492506982538362
Energy: 1.3173923265456955
Energy: 1.5294914186840871
Energy: 1.0971775498640917
Energy: 1.4142864195177736

minimum gb energy = 0.8618162662485968 eV
minimum distance =  2.51988997662001 Angstroms
sigma value = 41


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

Energy: 1.4229578149247935
Energy: 1.4200942481065555
Energy: 1.4593029940717923
Energy: 1.3492214105117077
Energy: 1.717770372924845
Energy: 1.681927906427706
Energy: 1.0442402718487895
Energy: 1.1380733064129704
Energy: 1.1408320464632407
Energy: 1.2095133354808687
Energy: 1.208067679131058
Energy: 1.3633729046588057
Energy: 1.349261336586764
Energy: 1.4178911416800155
Energy: 1.289012832218282
Energy: 1.3504224471864115
Energy: 1.4455280895909175
Energy: 1.1920737450559284
Energy: 1.3710590256682986
Energy: 1.3575620864427587
Energy: 1.4024367278401195
Energy: 1.21037951546188
Energy: 1.3074007812578419
Energy: 1.2062133682320206
Energy: 1.2010114857345329
Energy: 1.4748005730821427
Energy: 1.4026677184994927
Energy: 1.2012510719462928
Energy: 1.2714093841438834
Energy: 1.3332950504193226
Energy: 1.3808263617216632
Energy: 1.3075872157528987
Energy: 1.3215322865612376
Energy: 1.2874506542801887
Energy: 1.211926814759107
Energy: 1.4661338786705327
Energy: 1.0027912418026725
Energy: 1.2452547595732884
Energy: 1.2710118100924424
Energy: 1.0017556609172258
Energy: 1.221486639916059
Energy: 1.2397360813269653
Energy: 0.9981911763527503
Energy: 1.2811277034545105
Energy: 1.1987477270051259
Energy: 0.9993626321155762
Energy: 1.3629435886186398
Energy: 1.0553824706327912
Energy: 1.2927412798044673
Energy: 1.1262857267296817
Energy: 1.1961764996443387
Energy: 1.295064872274252
Energy: 1.077071354391906
Energy: 1.2751203301118819
Energy: 1.2904550295354227
Energy: 1.1054996121294112
Energy: 1.0138236316086906
Energy: 1.2859010287746278
Energy: 1.1009269622106794
Energy: 1.1162901724164749
Energy: 1.2655527100203394
Energy: 1.1615289224880534
Energy: 1.3340692163934311
Energy: 1.2668632382414158
Energy: 1.1211269747880899
Energy: 1.273031879891974
Energy: 1.2191686291264547
Energy: 1.361866868834684
Energy: 1.2754798209176454
Energy: 1.220222244452911
Energy: 1.3623845772510752
Energy: 1.1615279921599935
Energy: 1.2054358251858455
Energy: 1.1749115892978124
Energy: 1.3010188586649714
Energy: 1.183005541520447
Energy: 1.1707091036571613
Energy: 1.2148336452751818
Energy: 1.4776032529614909
Energy: 1.248849716553685
Energy: 1.4016340893622254
Energy: 1.477686958444469
Energy: 1.180293328735499
Energy: 1.6172648910501957

minimum gb energy = 0.9981911763527503 eV
minimum distance =  2.45853503997357 Angstroms
sigma value = 11


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

Energy: 1.659349792219658
Energy: 1.7326233232566288
Energy: 1.6559950703348534
Energy: 1.6606597589950922
Energy: 2.0291621380471114
Energy: 1.519930543160257
Energy: 1.3412119546310208
Energy: 1.1655963100980171
Energy: 1.2805381055995988
Energy: 1.4240831753484817
Energy: 1.1675819250559387
Energy: 1.3691558194923137
Energy: 1.5232075400909761
Energy: 1.5688096228516482
Energy: 1.4406168624061744
Energy: 1.5064394351064951
Energy: 1.6373292951266902
Energy: 1.4065441665640912
Energy: 1.416330981162699
Energy: 1.4057844842803287
Energy: 1.4146284858619225
Energy: 1.4205890389002693
Energy: 1.3649036551093672
Energy: 1.4252496395097276
Energy: 1.4002815386580707
Energy: 1.2166794102345948
Energy: 1.2101754594941734
Energy: 1.3814791085151952
Energy: 1.2178061461226481
Energy: 1.3426334420599195
Energy: 1.5788924458083957
Energy: 1.1655460686565216
Energy: 1.2479820307141287
Energy: 1.287047225799828
Energy: 1.1652082956112717
Energy: 1.2956692015865967
Energy: 1.1433647272060257
Energy: 1.4144353336599274
Energy: 1.3271136851605068
Energy: 1.1520444498105984
Energy: 1.2579451154693577
Energy: 1.249747671137503
Energy: 1.1610407759422718
Energy: 1.3318037619865166
Energy: 1.3865438672630144
Energy: 1.1591892135570683
Energy: 1.3198392568099104
Energy: 1.2711705149059316
Energy: 1.5740058303056075
Energy: 1.4062654713736051
Energy: 1.4091327652563121
Energy: 1.5216645857247084
Energy: 1.4012540577802761
Energy: 1.5342966604544077
Energy: 1.598578692234857
Energy: 1.4680197968112891
Energy: 1.468123342867823
Energy: 1.5217745214866474
Energy: 1.4816302139291146
Energy: 1.524809041436096
Energy: 1.2742894140394694
Energy: 1.2835240006342592
Energy: 1.3227177988495242
Energy: 1.2546115400302817
Energy: 1.315464969230913
Energy: 1.3668265979479564
Energy: 1.5798384248333979
Energy: 1.7557322560425206
Energy: 1.5511830277981005
Energy: 1.5810043152610014
Energy: 1.647953888046429
Energy: 1.550132136461848
Energy: 1.2430513482858685
Energy: 1.4934943894375567
Energy: 1.3953153251864843
Energy: 1.157295723302199
Energy: 1.458964532840515
Energy: 1.3277426153038685
Energy: 1.575788968956277
Energy: 1.4152806149626824
Energy: 1.4068558710739814
Energy: 1.5417808181938284
Energy: 1.3930655816678743
Energy: 1.4768150212518114
Energy: 1.1328967287672835
Energy: 1.4428908657076545
Energy: 1.4221312570297673
Energy: 1.1331197123994692
Energy: 1.4262032838112464
Energy: 1.2594753042937532
Energy: 1.1877862454975074
Energy: 1.2951088104378128
Energy: 1.2890184366151076
Energy: 1.189374252953477
Energy: 1.3533668030497703
Energy: 1.106759547387355
Energy: 1.112761999332449
Energy: 1.375974771714837
Energy: 1.2650120320484382
Energy: 1.112665754964842
Energy: 1.4540402227903078
Energy: 1.250120004861337
Energy: 1.384569496092506
Energy: 1.261762356087999
Energy: 1.3040342532829463
Energy: 1.3618973563824843
Energy: 1.2375914798321268
Energy: 1.3269842352922752
Energy: 1.3635040391869775
Energy: 1.2682133111689855
Energy: 1.2555450521275422
Energy: 1.274729883850718
Energy: 1.2693102077141896
Energy: 1.2826349594059785
Energy: 1.331726316884803
Energy: 1.594565567723537
Energy: 1.48684840225924
Energy: 1.3667034992837177
Energy: 1.6481298715069148
Energy: 1.5873909800397277
Energy: 1.3529018576638774
Energy: 1.4672378829841277
Energy: 1.429672520924007
Energy: 1.4248074025585105
Energy: 1.3191174806060217
Energy: 1.3548327018888706
Energy: 1.2823215923096092
Energy: 1.4880884793473534
Energy: 1.3896608003983628
Energy: 1.3513854707278372
Energy: 1.4090875502552742
Energy: 1.483898612642652
Energy: 1.7207050315568808
Energy: 1.4501743946111398
Energy: 1.492178532137217
Energy: 1.6207275436459954
Energy: 1.4080404149662331
Energy: 1.52947912446464
Energy: 1.318456199450129
Energy: 1.2449020717139117
Energy: 1.220853887730736
Energy: 1.3195159859891041
Energy: 1.245666639491448
Energy: 1.241845946959708
Energy: 1.2404364303648425
Energy: 1.43568713919015
Energy: 1.4250355056080206
Energy: 1.263844799510322
Energy: 1.3397190460693111
Energy: 1.3700941630688466
Energy: 1.496546889590322
Energy: 1.1550990893163957
Energy: 1.2347792634537578
Energy: 1.46247192538267
Energy: 1.113020452857253
Energy: 1.2647975450939384
Energy: 1.3953949264601204
Energy: 1.1469915895359164
Energy: 1.147203110046922
Energy: 1.3287256042566529
Energy: 1.1299835021880658
Energy: 1.209755247999846
Energy: 1.4512532750637601
Energy: 1.1822672239005758
Energy: 1.262291687816981
Energy: 1.3943888860849356
Energy: 1.0929607164240784
Energy: 1.432413854820598
Energy: 1.4185375458768177
Energy: 1.4770891198027076
Energy: 1.4550684131414686
Energy: 1.4335625353981658
Energy: 1.4535578945258625
Energy: 1.4153865229146203
Energy: 1.4452385765816087
Energy: 1.1344231976062824
Energy: 1.158842597985605
Energy: 1.4680924396947777
Energy: 1.2233778824467834
Energy: 1.2635431091887317
Energy: 1.7521657832310664
Energy: 1.489071836339851
Energy: 1.5625599193389794
Energy: 1.6634877393889802
Energy: 1.4765789293279947
Energy: 1.5908903294492436

minimum gb energy = 1.0929607164240784 eV
minimum distance =  2.48959985303161 Angstroms
sigma value = 57


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

Energy: 1.4956144156754443
Energy: 1.3750393783303514
Energy: 1.3782475897560962
Energy: 1.4993189816487262
Energy: 1.8287181990721644
Energy: 1.4928892027603784
Energy: 1.1658018697168688
Energy: 1.414090060365005
Energy: 1.385291265213695
Energy: 1.4254087961758153
Energy: 1.4108334930868256
Energy: 1.4164003932637148
Energy: 1.6525564630124747
Energy: 1.3381266108841472
Energy: 1.3041634864917124
Energy: 1.6238815073219923
Energy: 1.1184794177854689
Energy: 1.5954947795444936
Energy: 1.240343012455247
Energy: 1.3184521005634875
Energy: 1.367403043668971
Energy: 1.384650432414534
Energy: 1.476819515961403
Energy: 1.3663741601510992
Energy: 1.3299373340448972
Energy: 1.530729628879641
Energy: 1.3278450310136312
Energy: 1.3187559664219766
Energy: 1.4485526800148123
Energy: 1.351828981644188
Energy: 1.541422722611427
Energy: 1.3777261929770286
Energy: 1.3780560557260173
Energy: 1.4789653573931216
Energy: 1.3732363423716913
Energy: 1.3917436134244652
Energy: 1.1951319718374822
Energy: 1.2621070106636676
Energy: 1.197155809725433
Energy: 1.19631568477849
Energy: 1.1197364471385938
Energy: 1.276527458656439
Energy: 1.3124626646623048
Energy: 1.246977399329453
Energy: 1.3388046661389152
Energy: 1.3024314948649425
Energy: 1.2398518485261851
Energy: 1.293166216359738
Energy: 1.7044017247430452
Energy: 1.3109986146200778
Energy: 1.3639489802546094
Energy: 1.2877702623661076
Energy: 1.3084643537983778
Energy: 1.3998552735655951
Energy: 1.7045271915933133
Energy: 1.3815503129431927
Energy: 1.3642142022179966
Energy: 1.2870620025840247
Energy: 1.377689896501676
Energy: 1.400135587314734
Energy: 1.42745404981109
Energy: 1.3950645208274728
Energy: 1.3690615602902358
Energy: 1.4259560781895046
Energy: 1.4106883579219347
Energy: 1.3683319199000443
Energy: 1.6675580299451396
Energy: 1.4055461030014955
Energy: 1.3045769562073661
Energy: 1.6695586770296975
Energy: 1.3079695629965695
Energy: 1.4059104666715412
Energy: 1.32951600607304
Energy: 1.4579913225596175
Energy: 1.3959846125789452
Energy: 1.3309761711897237
Energy: 1.4483661348708794
Energy: 1.3423243126133917
Energy: 1.4430530697474724
Energy: 1.4136137353499352
Energy: 1.4096733110004553
Energy: 1.4278670148197443
Energy: 1.4132013316798924
Energy: 1.4316993881070241
Energy: 1.3662833140936188
Energy: 1.3028975403062564
Energy: 1.4270043389107345
Energy: 1.367530928302522
Energy: 1.3050138972276413
Energy: 1.2961638805649356
Energy: 1.3338367920620358
Energy: 1.1459578075427421
Energy: 1.1881488303004186
Energy: 1.3344932080607048
Energy: 1.14753331604101
Energy: 1.253306618614909
Energy: 1.1660826064494554
Energy: 1.3884004101121352
Energy: 1.2794253954849681
Energy: 1.1665828799549811
Energy: 1.3893982902128819
Energy: 1.301874180826035

minimum gb energy = 1.1184794177854689 eV
minimum distance =  2.47873786398747 Angstroms
sigma value = 9


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

Energy: 1.7269193605317184
Energy: 1.9320186078496844
Energy: 1.5869041195755746
Energy: 1.72973327838811
Energy: 2.0705636874020423
Energy: 1.592179045595388
Energy: 1.3899543891010964
Energy: 1.442025886522229
Energy: 1.4562130149226389
Energy: 1.6190196001688522
Energy: 1.4813404933541376
Energy: 1.4577808810253519
Energy: 1.5051055241838485
Energy: 1.310760318156258
Energy: 1.4734313040609313
Energy: 1.506292921390271
Energy: 1.3836815426867901
Energy: 1.4632398635273807
Energy: 1.4111167654259038
Energy: 1.3670940277991175
Energy: 1.362608868875731
Energy: 1.3839920417476128
Energy: 1.338832013729598
Energy: 1.3478226902641752
Energy: 1.271152770005887
Energy: 1.2864259307022288
Energy: 1.2975399068415752
Energy: 1.2348608603787343
Energy: 1.2879900410891933
Energy: 1.2616727186502714
Energy: 1.4275165881792375
Energy: 1.239415320462731
Energy: 1.21257550872209
Energy: 1.211452045631861
Energy: 1.2502240596648697
Energy: 1.2216834329663804
Energy: 1.490642308091325
Energy: 1.3542419150287361
Energy: 1.6056024632320045
Energy: 1.4908734682589393
Energy: 1.3595089903565982
Energy: 1.593195142598182
Energy: 1.356617855068207
Energy: 1.3602261220833138
Energy: 1.349908691781972
Energy: 1.3562534356664826
Energy: 1.3763468139478403
Energy: 1.3670753608260569
Energy: 1.5440540115775963
Energy: 1.4532112682101486
Energy: 1.437540898788793
Energy: 1.5264092381261671
Energy: 1.4502262798671506
Energy: 1.482998298787743
Energy: 1.5326791460457676
Energy: 1.3965726795450062
Energy: 1.399134601956028
Energy: 1.5677500217171163
Energy: 1.4107654006452548
Energy: 1.4226407141470152
Energy: 1.2607688088017648
Energy: 1.300082734406299
Energy: 1.2484453496642771
Energy: 1.2603222227587747
Energy: 1.2774497659380224
Energy: 1.2398954938017748
Energy: 1.2043898226435688
Energy: 1.296893982928556
Energy: 1.3130609109973568
Energy: 1.2043109889023536
Energy: 1.2313067376621087
Energy: 1.2490822638564127
Energy: 1.4503785003159764
Energy: 1.4514641706579665
Energy: 1.4381638920802073
Energy: 1.363657957307076
Energy: 1.3921005202315977
Energy: 1.3331787456895028
Energy: 1.4561913704777514
Energy: 1.4264472691456012
Energy: 1.4268425022949784
Energy: 1.3968083176262176
Energy: 1.4358434439331176
Energy: 1.3489817042838392
Energy: 1.426025092002523
Energy: 1.2767669923061902
Energy: 1.279515560505655
Energy: 1.5557656880504054
Energy: 1.3548090455877608
Energy: 1.4823789062368316
Energy: 1.5361033503283594
Energy: 1.489405717808641
Energy: 1.4366661464043848
Energy: 1.5365292611702006
Energy: 1.6386344582407275
Energy: 1.6796877536571642
Energy: 1.3638318227560517
Energy: 1.3902494200854472
Energy: 1.3494067293192566
Energy: 1.378549616134596
Energy: 1.410033999005348
Energy: 1.308919612586044
Energy: 1.3093581605985372
Energy: 1.3437372206890397
Energy: 1.3247258645761364
Energy: 1.3109562429504864
Energy: 1.3185643413937074
Energy: 1.3149603066069153
Energy: 1.2694721289624977
Energy: 1.4075977596224865
Energy: 1.358682410481567
Energy: 1.2704124304512683
Energy: 1.394205677844667
Energy: 1.3325335890063406
Energy: 1.3972582692508158
Energy: 1.2887932418176262
Energy: 1.2959766695872454
Energy: 1.3980212290552747
Energy: 1.2873338067283449
Energy: 1.3476151231092597
Energy: 1.6360025695134237
Energy: 1.49920144253811
Energy: 1.507404778066278
Energy: 1.5286585513045752
Energy: 1.4817984869550997
Energy: 1.4157784601318038

minimum gb energy = 1.2043109889023536 eV
minimum distance =  2.51616800566931 Angstroms
sigma value = 27


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

Energy: 1.5114577454073357
Energy: 1.4745925796464459
Energy: 1.4116548467718346
Energy: 1.4154747201793692
Energy: 1.6706172041967946
Energy: 1.450398291652941
Energy: 1.6977413101376135
Energy: 1.5230697184300201
Energy: 1.4337208524186476
Energy: 1.6845135459137985
Energy: 1.4558156070724353
Energy: 1.4843856645471198
Energy: 1.8853783401137638
Energy: 1.4620227252569273
Energy: 1.476392870883865
Energy: 1.7821971119506066
Energy: 1.1672793965861894
Energy: 1.488814397933849
Energy: 1.5259703220935343
Energy: 1.4689274578708464
Energy: 1.5242590471334572
Energy: 1.4782618482020011
Energy: 1.6620645731342372
Energy: 1.470339707097853
Energy: 1.1837808633103624
Energy: 1.482848462777339
Energy: 1.4385272867827827
Energy: 1.185245999740291
Energy: 1.4879445937017721
Energy: 1.5207965781818278
Energy: 1.6432875008306072
Energy: 1.387390272398336
Energy: 1.404377459484945
Energy: 1.4109204568177596
Energy: 1.4906853601769499
Energy: 1.364811645316054
Energy: 1.4427991735205135
Energy: 1.350191640368121
Energy: 1.3365890595335495
Energy: 1.4104357384799364
Energy: 1.3492681035347174
Energy: 1.3663111113562916
Energy: 1.4812270817533857
Energy: 1.4552744215110707
Energy: 1.4288593913122318
Energy: 1.4729412641591337
Energy: 1.4551933303966216
Energy: 1.4225044804538376
Energy: 1.6485634459139131
Energy: 1.7458796366496618
Energy: 1.430147111105514
Energy: 1.3429249472097564
Energy: 1.7101865962160432
Energy: 1.358185022182756
Energy: 1.589906195303894
Energy: 1.3835457077029265
Energy: 1.3892597190262934
Energy: 1.4066535006861696
Energy: 1.6744997807634177
Energy: 1.3570278918306273
Energy: 1.5812413725765215
Energy: 1.3184492675311172
Energy: 1.4229919601196728
Energy: 1.545440145910191
Energy: 1.166381136057977
Energy: 1.4294668881606138
Energy: 1.4675513553756132
Energy: 1.2368008599654887
Energy: 1.2551593542246366
Energy: 1.3129521809901645
Energy: 1.3324956778469639
Energy: 1.2990361300141093
Energy: 1.2798913489529555
Energy: 1.314398357558059
Energy: 1.313491742363543
Energy: 1.2810555498710259
Energy: 1.3125271727404837
Energy: 1.2872819223397804
Energy: 1.3773800975183939
Energy: 1.3370436393355356
Energy: 1.3054476078142814
Energy: 1.3494695069278433
Energy: 1.3327935912872704
Energy: 1.268400257341246
Energy: 1.6702261711425568
Energy: 1.308845895801056
Energy: 1.295875561954564
Energy: 1.6681106788491222
Energy: 1.3944341162965803
Energy: 1.3554550269921335
Energy: 1.7660145516246353
Energy: 1.4606135289046396
Energy: 1.4657595594878625
Energy: 1.7158920578061945
Energy: 1.4428876692126635
Energy: 1.5412111640815747
Energy: 1.4123465295895103
Energy: 1.4618822629781032
Energy: 1.4203654403931008
Energy: 1.2180577078126718
Energy: 1.4591445096763576
Energy: 1.3325755987184937
Energy: 1.4004616953594402
Energy: 1.4075986163148384
Energy: 1.3656273897444615
Energy: 1.2917249031540257
Energy: 1.45044939092619
Energy: 1.319639241662851
Energy: 1.5420294541737505
Energy: 1.346121659815038
Energy: 1.3374650462761521
Energy: 1.5193930651438294
Energy: 1.3453285347787771
Energy: 1.3343166790544194
Energy: 1.4920122751404972
Energy: 1.3461613251997755
Energy: 1.3174142087276621
Energy: 1.4850574597813673
Energy: 1.389265446860799
Energy: 1.3513288510813881
Energy: 1.6412984362659164
Energy: 1.4307895179481127
Energy: 1.4970800644731448
Energy: 1.6102863359541335
Energy: 1.3983688146991347
Energy: 1.413286999081227
Energy: 1.3627511623324653
Energy: 1.8099675606839107
Energy: 1.8394288514975599
Energy: 1.180623650472273
Energy: 1.8954779385646747
Energy: 1.6088829740256139
Energy: 1.577970491320505
Energy: 1.4055789008463748
Energy: 1.4054689013283173
Energy: 1.6109935019624977
Energy: 1.4448600392306417
Energy: 1.402851674997291
Energy: 1.5437985582304723
Energy: 1.3794123697487972
Energy: 1.4059863885292403
Energy: 1.407368613875168
Energy: 1.357047322924148
Energy: 1.461807919184741
Energy: 1.7176098459399887
Energy: 1.489494483563015
Energy: 1.448892965992455
Energy: 1.5814421867967223
Energy: 1.5016580120364578
Energy: 1.4680707121937828

minimum gb energy = 1.166381136057977 eV
minimum distance =  2.52239349834718 Angstroms
sigma value = 19


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

Energy: 1.6598380699276307
Energy: 1.9840491074719717
Energy: 1.686179445802037
Energy: 1.662324709157899
Energy: 2.166533465855256
Energy: 1.7444961279690858
Energy: 1.4072079352877034
Energy: 1.3352122055193183
Energy: 1.3320080674231332
Energy: 1.4001443636381652
Energy: 1.3621832724983785
Energy: 1.3103897568189051
Energy: 1.2819831908162316
Energy: 1.2745773275770726
Energy: 1.322165505149335
Energy: 1.278323942578708
Energy: 1.2650760522046114
Energy: 1.3075642265795138
Energy: 1.3490843731726794
Energy: 1.3215702588394984
Energy: 1.3393408064260137
Energy: 1.3531402817200429
Energy: 1.3198890351601658
Energy: 1.3394269646547634
Energy: 1.1608100482377728
Energy: 1.3281287574937772
Energy: 1.327407045882186
Energy: 1.163047224572722
Energy: 1.3417321107974651
Energy: 1.3360749689852387
Energy: 1.3288012695105715
Energy: 1.3607013261582923
Energy: 1.2706860419876276
Energy: 1.3289127234447646
Energy: 1.3617673625246265
Energy: 1.2526383615250014
Energy: 1.5908733922835605
Energy: 1.6980406621650126
Energy: 1.653192120803932
Energy: 1.590915536371171
Energy: 1.7718687919873364
Energy: 1.6141592224120496
Energy: 1.4386926379048035
Energy: 1.296625356395266
Energy: 1.3506867958071604
Energy: 1.397548152006957
Energy: 1.3660189052484704
Energy: 1.3578432985764728
Energy: 1.14144245129401
Energy: 1.2170144020469753
Energy: 1.244875836396929
Energy: 1.1419989392757302
Energy: 1.2171330888184502
Energy: 1.1632893299744496
Energy: 1.4689593358617117
Energy: 1.237557708009481
Energy: 1.2222798649832562
Energy: 1.4779974319439306
Energy: 1.2791702296350551
Energy: 1.2489386270152976
Energy: 1.4232742708683541
Energy: 1.4033582114421574
Energy: 1.4761121141108071
Energy: 1.428406257002511
Energy: 1.3753002073887897
Energy: 1.4024531798850188
Energy: 1.3844614964619633
Energy: 1.3219748861957465
Energy: 1.2885700049492348
Energy: 1.3712878364041046
Energy: 1.3854650949664
Energy: 1.2835039602806775
Energy: 1.5839304310640134
Energy: 1.3085403638554105
Energy: 1.5340707285252952
Energy: 1.5391817628933147
Energy: 1.3230100643722975
Energy: 1.5079379578420729
Energy: 1.4743564881587419
Energy: 1.314835172499429
Energy: 1.3275090758781136
Energy: 1.4911777690021595
Energy: 1.313749712578812
Energy: 1.3503797053476991
Energy: 1.160399371832065
Energy: 1.1060995641651978
Energy: 1.1687596857927747
Energy: 1.1876543260175703
Energy: 1.0793864240186686
Energy: 1.2564152572037626
Energy: 1.2117832387652718
Energy: 1.1788794296033145
Energy: 1.2144120517455659
Energy: 1.2357424886448172
Energy: 1.2013685454980745
Energy: 1.2107120454573577
Energy: 1.3890011887328582
Energy: 1.526970992061854
Energy: 1.5521494919745165
Energy: 1.3854010614305077
Energy: 1.5276112213735937
Energy: 1.5760761593267092
Energy: 1.4805347648903628
Energy: 1.3735608573704765
Energy: 1.4133329803757217
Energy: 1.4083651883053057
Energy: 1.3818891502632502
Energy: 1.3169464455164621
Energy: 1.2845464253021988
Energy: 1.344342234370335
Energy: 1.4501581694572612
Energy: 1.3285722557927675
Energy: 1.3571133202263632
Energy: 1.4070512636933634
Energy: 1.3746476890525683
Energy: 1.447322029679031
Energy: 1.4474528038074703
Energy: 1.3816283463097117
Energy: 1.4140100924844934
Energy: 1.4236375999460023
Energy: 1.1009522068172546
Energy: 1.2141843415642863
Energy: 1.2099380707357061
Energy: 1.1014420823660411
Energy: 1.2235690759730196
Energy: 1.2100057546997973
Energy: 1.1152896617316337
Energy: 1.2088735954828789
Energy: 1.2470364583978228
Energy: 1.1756352732932271
Energy: 1.2225964707935133
Energy: 1.216467780764987
Energy: 1.4559372302703637
Energy: 1.5703562053568645
Energy: 1.5765839596346132
Energy: 1.5414240284271288
Energy: 1.6254633647695986
Energy: 1.5666464985883948
Energy: 1.3113643645497128
Energy: 1.4359821987718646
Energy: 1.508554690114841
Energy: 1.3056966189872792
Energy: 1.4754237635541598
Energy: 1.4542865136404306
Energy: 1.467576557006039
Energy: 1.3503838222856395
Energy: 1.3385987687280103
Energy: 1.3435097022767932
Energy: 1.364312745924792
Energy: 1.4033901677985112
Energy: 1.2463713827887961
Energy: 1.3180615960603401
Energy: 1.3556416596017038
Energy: 1.2472666401904504
Energy: 1.3142577739452999
Energy: 1.373583880288975
Energy: 1.2517328702249115
Energy: 1.1810690942547586
Energy: 1.1897769630029287
Energy: 1.2181133824283839
Energy: 1.1254992442415879
Energy: 1.229847411459456
Energy: 1.257682554619022
Energy: 1.1383940895827998
Energy: 1.197140349696005
Energy: 1.2567728953483928
Energy: 1.1789729802102882
Energy: 1.2339899605304738
Energy: 1.7788753707396838
Energy: 1.3644606881607317
Energy: 1.4415937442737525
Energy: 1.5397071922869368
Energy: 1.3968448423602482
Energy: 1.5907613519606396

minimum gb energy = 1.0793864240186686 eV
minimum distance =  2.48815878614105 Angstroms
sigma value = 101


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

Energy: 1.5396829691254517
Energy: 1.7641393497687887
Energy: 1.8763327735797375
Energy: 1.5417402413198873
Energy: 2.071997297684268
Energy: 1.4565817026264212
Energy: 1.3811192605857134
Energy: 1.4316676238527026
Energy: 1.3306684554264225
Energy: 1.4500122935888486
Energy: 1.4264777417941366
Energy: 1.2836146354645361
Energy: 1.3067050666447702
Energy: 1.3666090246102378
Energy: 1.35515619644954
Energy: 1.3179139574201155
Energy: 1.284688262052874
Energy: 1.3498868523931695
Energy: 1.3067161750071485
Energy: 1.2998769842795057
Energy: 1.3577343468225185
Energy: 1.3336554922698136
Energy: 1.359941865643011
Energy: 1.3963846196541527
Energy: 1.0527041027486823
Energy: 1.3888601466080794
Energy: 1.4015976194021327
Energy: 1.055002605902755
Energy: 1.338003490793901
Energy: 1.2253442515174142
Energy: 1.2641652394969498
Energy: 1.3896007447452665
Energy: 1.2914606632704992
Energy: 1.175384347006903
Energy: 1.3654406222537758
Energy: 1.1834094960008552
Energy: 1.7636857447653291
Energy: 1.7351340397960375
Energy: 1.693865370832794
Energy: 1.6924144746434084
Energy: 1.738059512657101
Energy: 1.604250720373453
Energy: 1.21932888160606
Energy: 1.3961819717064812
Energy: 1.3711721483947998
Energy: 1.3169827669833944
Energy: 1.4092468454196458
Energy: 1.3112360585532232
Energy: 1.0406639433194715
Energy: 1.2743650745990547
Energy: 1.2392382760932334
Energy: 1.0417051355331315
Energy: 1.241531652663547
Energy: 1.1336734024272386
Energy: 1.3667439178053733
Energy: 1.2698930086011844
Energy: 1.2242136725076629
Energy: 1.1971850241970754
Energy: 1.3300551166905812
Energy: 1.260428840085986
Energy: 1.6176767586397274
Energy: 1.507367043438245
Energy: 1.472948930070237
Energy: 1.6186681673103482
Energy: 1.6078845737204475
Energy: 1.4442205963962604
Energy: 1.4406698281605559
Energy: 1.2496379306063135
Energy: 1.2502439699931451
Energy: 1.442052986209738
Energy: 1.411403504274607
Energy: 1.3789744739962517
Energy: 1.2968313521188288
Energy: 1.5405506730499674
Energy: 1.4629186045068732
Energy: 1.297709371712674
Energy: 1.5393691056386027
Energy: 1.6853888510783648
Energy: 1.595134049889287
Energy: 1.4325622107186786
Energy: 1.3500182178952456
Energy: 1.5278615699465685
Energy: 1.3583659157044479
Energy: 1.2690436668301404
Energy: 1.170010309451801
Energy: 1.1267801401414264
Energy: 1.1387237685758407
Energy: 1.1714329952364546
Energy: 1.039976745345809
Energy: 1.2134089216541395
Energy: 1.2714478670072151
Energy: 1.1855534723428878
Energy: 1.154305604984282
Energy: 1.2721256118292172
Energy: 1.3399308991588919
Energy: 1.2902262258031578
Energy: 1.545301423817248
Energy: 1.5377210721690993
Energy: 1.7659426391845143
Energy: 1.5465587108401087
Energy: 1.5369440838829218
Energy: 1.4424064717706497
Energy: 1.5483500309192435
Energy: 1.4234559073910427
Energy: 1.359910107526989
Energy: 1.3102128399532678
Energy: 1.4785573642043568
Energy: 1.393156726833881
Energy: 1.3137919761836245
Energy: 1.3694566397698065
Energy: 1.3523350526563924
Energy: 1.3059178468953996
Energy: 1.277185696355869
Energy: 1.3544603700887559
Energy: 1.31754588691624
Energy: 1.3215981182232628
Energy: 1.3297471931494436
Energy: 1.3180482224175212
Energy: 1.2803396094847548
Energy: 1.3191220239535826
Energy: 1.056059363541858
Energy: 1.3861460852247844
Energy: 1.3836478994212187
Energy: 1.0555431975324518
Energy: 1.3427757327934124
Energy: 1.2395246870531722
Energy: 1.1750474880820359
Energy: 1.3331315407102202
Energy: 1.2562657836361872
Energy: 1.1753948901715456
Energy: 1.325282689013088
Energy: 1.1775149872702633
Energy: 1.3352989249301905
Energy: 1.7196673561936089
Energy: 1.657422841604717
Energy: 1.3356834008410539
Energy: 1.7128438030597144
Energy: 1.6600618569806571
Energy: 1.2812149408397002
Energy: 1.7453421952501664
Energy: 1.6552794254577123
Energy: 1.3210373750602098
Energy: 1.5154096558631487
Energy: 1.3256629993692468
Energy: 1.0380135377251363
Energy: 1.2403071732207922
Energy: 1.199425437885314
Energy: 1.0378739266514052
Energy: 1.2409254352725179
Energy: 1.1468452751928795
Energy: 1.0376491125974403
Energy: 1.2717571523122755
Energy: 1.2215931131888926
Energy: 1.0380985783593812
Energy: 1.2686442826671258
Energy: 1.1958526452330005
Energy: 1.3562109923110455
Energy: 1.4528763246676817
Energy: 1.4664571995030993
Energy: 1.3546974444494693
Energy: 1.5528202534177555
Energy: 1.4593053173074324
Energy: 1.3420487994319172
Energy: 1.469392708540782
Energy: 1.471226430312081
Energy: 1.342859755601827
Energy: 1.427135942302959
Energy: 1.4075577266020525
Energy: 1.35322579826328
Energy: 1.3884666810992912
Energy: 1.4138112315804807
Energy: 1.349104169293279
Energy: 1.381915979863275
Energy: 1.4459858007961213
Energy: 1.4396386909291605
Energy: 1.5530582139500713
Energy: 1.57414149933504
Energy: 1.2975550725423368
Energy: 1.419512733137935
Energy: 1.558814559449767
Energy: 1.189477945856333
Energy: 1.0894704638441037
Energy: 1.1541205603822031
Energy: 1.1907559167116488
Energy: 1.037942247181618
Energy: 1.2203633184321578
Energy: 1.2717749365239541
Energy: 1.1148802136067943
Energy: 1.1605393325835593
Energy: 1.2720425500562302
Energy: 1.1209443938280397
Energy: 1.24128739470396
Energy: 1.454667400822541
Energy: 1.3850527413774565
Energy: 1.4644784345060184
Energy: 1.5916170278547275
Energy: 1.3580382233352344
Energy: 1.442922853652286

minimum gb energy = 1.0376491125974403 eV
minimum distance =  2.49660502998 Angstroms
sigma value = 33


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

Energy: 0.014742926120104506
Energy: 0.015628615367620936
Energy: 0.01532818665720497
Energy: 0.01657019325563018
Energy: 0.8458054338284716
Energy: 0.015158905228464511
Energy: 0.015477798181490608
Energy: 0.10769498282090065
Energy: 0.1065105069758412
Energy: 0.10886871280442387
Energy: 0.734363204350371
Energy: 0.10609903916089393
Energy: 1.4529964288074295
Energy: 0.8450907888887867
Energy: 0.8438405392180243
Energy: 0.8449932323025445
Energy: 1.125411129418737
Energy: 0.8433628006636694
Energy: 0.7054879252663165
Energy: 0.10769498282090065
Energy: 0.106510506975458
Energy: 0.10886871280367877
Energy: 0.7343632043507328
Energy: 0.10609903916089393

minimum gb energy = 0.014742926120104506 eV
minimum distance =  2.71787406848849 Angstroms
sigma value = 1