Model name: model_name=MEAM_LAMMPS_EtesamiAsadi_2018_Fe__MO_549900287421_002
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.851000025868416
cohesive_energy=4.290337375544713
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.6341560796146398e-19, 2.31524136672804e-19, 3.32184088057122e-19, 3.83942404218492e-19, 4.2713227974122996e-19, 4.64185818755748e-19, 4.96335095093592e-19, 5.244340689006839e-19, 5.4909797600448e-19, 5.70796254158742e-19, 5.89894199636022e-19, 6.066834085837079e-19, 6.21405809673534e-19, 6.34255266278214e-19, 6.454000069443179e-19, 6.5498422756890595e-19, 6.63126489222894e-19, 6.69937342094028e-19, 6.755065080738119e-19, 6.79917300347214e-19, 6.83243419039398e-19, 6.85550553392358e-19, 6.86896381764918e-19, 6.87333775986e-19, 6.86864338232238e-19, 6.85348679136474e-19, 6.82605752739066e-19, 6.78416060841156e-19, 6.72528061711206e-19, 6.6463093308222e-19, 6.543593786816461e-19, 6.41267993405232e-19, 6.24818445903954e-19, 6.04358650287774e-19, 5.79077905179888e-19, 5.47982861067216e-19, 5.098334332350419e-19, 4.6306910164185e-19, 4.0571278032128394e-19, 3.35229825838356e-19, 2.48334173916732e-19, 1.40717571587586e-19, 6.634196875469159e-21, -1.6170768766962e-19, -3.7536595269668996e-19, -6.50991603396978e-19, -1.0148875735708619e-18, -1.5109342768703339e-18, -2.21712406966188e-18, -3.2837250984483598e-18, -5.0314594796472595e-18, -8.22419696705076e-18, -1.491016016956446e-17, -3.1288426832395797e-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: 0.01629205228083462
Energy: 0.016772239873625475
Energy: 1.2475729616364981
Energy: 0.017073998418466692
Energy: 0.016927452991274617
Energy: 1.4266558292521103
Energy: 0.016673442057501077
Energy: 0.017245222338229626
Energy: 0.24470647583959715
Energy: 0.18916760339313515
Energy: 0.18917030874747082
Energy: 0.2445224146157183
Energy: 0.2446765370601694
Energy: 0.1891575836614476
Energy: 0.1896160539195324
Energy: 0.24452675118085127
Energy: 0.2444121134241699
Energy: 0.18971159282705297
Energy: 0.1897601440281343
Energy: 0.2446348916343991
Energy: 0.18915106920262037
Energy: 0.18936720672184207
Energy: 0.24429185498733058
Energy: 0.244549409209867
Energy: 0.18908602053977408
Energy: 0.18971376201655918
Energy: 0.2451052732125353
Energy: 0.18914381872433578
Energy: 0.18962274452008335
Energy: 0.24530478322749377
Energy: 0.24441888507220869
Energy: 0.18970925520460505
Energy: 0.1890847710576158
Energy: 0.2443944994639523
Energy: 0.18920114338896304
Energy: 0.016687055884691493
Energy: 0.2443592410690242
Energy: 0.1892987827320709
Energy: 0.016904057850420994
Energy: 0.017087533079198948
Energy: 0.244849916109471
Energy: 0.18947837025235093

minimum gb energy = 0.01629205228083462 eV
minimum distance =  2.43830219739478 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 2.396924490853376
Energy: 1.572906736686521
Energy: 1.365498045252845
Energy: 1.3168242595068242
Energy: 1.2979654378136785
Energy: 1.4842278943470235
Energy: 1.2627022056439667
Energy: 1.2828304721902626
Energy: 1.2737196470242391
Energy: 1.3250935893901918
Energy: 1.2754853026042534
Energy: 1.2742751839284885
Energy: 1.2970339882441968
Energy: 1.2646274710885352
Energy: 1.2201404353512495
Energy: 1.2550270228144162
Energy: 1.2317251556803854
Energy: 1.2178919425400416
Energy: 1.2084861664238393
Energy: 1.2535861257650338
Energy: 1.213939994121583
Energy: 1.2024289673955288
Energy: 1.2646111970943572
Energy: 1.2217229876025446
Energy: 1.205261832161729
Energy: 1.2536776613915954
Energy: 1.2233746050392873
Energy: 1.213195064106798
Energy: 1.2716779705424945
Energy: 1.2412624069636342
Energy: 1.2287920176539484
Energy: 1.2199692584781383
Energy: 1.2568937819337258
Energy: 1.226532287514077
Energy: 1.2134106258812951
Energy: 1.2448987433937388
Energy: 1.219313109090681
Energy: 1.2150341397871016
Energy: 1.222692881338717
Energy: 1.2536470942932718
Energy: 1.207490625035748
Energy: 1.2461774420380693
Energy: 1.2537650365066901
Energy: 1.2118908917572793
Energy: 1.2123798376453832
Energy: 1.2342103011074612
Energy: 1.2511865115428233
Energy: 1.204300408031463
Energy: 1.2309986744733936
Energy: 1.2621115906005504
Energy: 1.2097545186093936
Energy: 1.2076791421333302
Energy: 1.2307791408105682
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Energy: 1.2397085346419563
Energy: 1.225495647987246
Energy: 1.270585391424781
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Energy: 1.3189529030764569
Energy: 1.2479184735338336
Energy: 1.28637300500165
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Energy: 1.288413625062633
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Energy: 1.288551669804855
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Energy: 1.3016427241938189
Energy: 1.3135902235237242
Energy: 1.2431235068324649
Energy: 1.2938622040174845
Energy: 1.2168459055139358
Energy: 1.3100068598547174
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Energy: 1.2091528953693684
Energy: 1.241228874968784
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Energy: 1.2016893048401562
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Energy: 1.203906403933684
Energy: 1.179425985663522
Energy: 1.1356411884371203
Energy: 1.179709195668249
Energy: 1.2119588300061275
Energy: 1.1606196024061357
Energy: 1.2541291323787613
Energy: 1.29632108121868
Energy: 1.2829208317447207
Energy: 1.2113075834445899
Energy: 1.2462464305209677
Energy: 1.2365721075532397
Energy: 1.2988667393827098
Energy: 1.247849761240028
Energy: 1.3057783177841487
Energy: 1.316921042497876
Energy: 1.2497321215157342
Energy: 1.26100174972764
Energy: 1.2161045116138636
Energy: 1.3075873194759147
Energy: 1.2851728473843484
Energy: 1.247977960243348
Energy: 1.2950526449026687
Energy: 1.2107811630389087
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Energy: 1.1931220350871288
Energy: 1.2973131988757214
Energy: 1.2884403950133076
Energy: 1.2914172397385273
Energy: 1.2511569343379458
Energy: 1.223281760945595
Energy: 1.234314845657002
Energy: 1.2824430108295595
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Energy: 1.3215877716301025
Energy: 1.2767006247210626
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Energy: 1.292252487920588
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Energy: 1.2163515651136814
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Energy: 1.2708050130398285
Energy: 1.2784956948084043
Energy: 1.314073109790279
Energy: 1.3047220748088095
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Energy: 1.3267410914133628
Energy: 1.3017719689069007
Energy: 1.2197371727237667
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Energy: 1.1830528750258176
Energy: 1.2862277859410747
Energy: 1.2734655894312223
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Energy: 1.3044657884041335
Energy: 1.296176651933344
Energy: 1.2021517692419261
Energy: 1.1901737906872798
Energy: 1.1791427066328584
Energy: 1.2354892303721372
Energy: 1.1882693837195883
Energy: 1.187813141845386
Energy: 1.2334573384027796
Energy: 1.1816521569188077
Energy: 1.182586189564984
Energy: 1.1873842687222447
Energy: 1.1828557475265724
Energy: 1.1759498626656282
Energy: 1.200458066485407
Energy: 1.1893456408991907
Energy: 1.175045053137226
Energy: 1.189604103786835
Energy: 1.1831305913912922
Energy: 1.158833451494267
Energy: 1.190366351445871
Energy: 1.2073998432658295
Energy: 1.1860819465945338
Energy: 1.2123120018704339
Energy: 1.2247307353172816
Energy: 1.257691771895108
Energy: 1.2899829966129024
Energy: 1.2226059018443671
Energy: 1.2732322576236939
Energy: 1.2092316646632402
Energy: 1.2024525218878441
Energy: 1.2025224004673352
Energy: 1.2122040428149212
Energy: 1.203175419054833
Energy: 1.2033755921636704
Energy: 1.2492162719940134
Energy: 1.2122256911177351
Energy: 1.2094611588551105
Energy: 1.2515707409544217
Energy: 1.2277483370515674
Energy: 1.2152608286561049
Energy: 1.2151771992158358
Energy: 1.3076637754614318
Energy: 1.2152542398159456
Energy: 1.308934553386169
Energy: 1.2329921159098503
Energy: 1.241952099005394
Energy: 1.2893664667909093
Energy: 1.2739930353220046
Energy: 1.3079586589867154
Energy: 1.2612287392745807
Energy: 1.2068762183952118
Energy: 1.324575663840798
Energy: 1.2849799985140196
Energy: 1.30072034465483
Energy: 1.2881591277621107
Energy: 1.2809443752579952
Energy: 1.2900342035162429

minimum gb energy = 1.1348710159121542 eV
minimum distance =  2.28074876971332 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 2.1022709334207845
Energy: 1.1853055021585286
Energy: 1.3388667449944258
Energy: 1.3679144898033773
Energy: 1.2210169564498414
Energy: 1.3867942519709962
Energy: 1.2463510752306985
Energy: 1.2019897019970631
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Energy: 1.2496371711637795
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Energy: 1.2522523855368595
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Energy: 1.3164823589812515
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Energy: 1.1931617069571874
Energy: 1.2542497388374192
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Energy: 1.2024101956644226
Energy: 1.1857893286938428
Energy: 1.254864649616487
Energy: 1.2218235011927736
Energy: 1.1591838632661315
Energy: 1.1832867437880725
Energy: 1.246483219242513
Energy: 1.200912378285013
Energy: 1.1651947661253077
Energy: 1.2500233025231213
Energy: 1.1969171007371249
Energy: 1.1500458351356535
Energy: 1.2019388158042295
Energy: 1.1969224994598642
Energy: 1.183443427659878
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Energy: 1.2754062922664304
Energy: 1.1657010296729227
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Energy: 1.2882338283631631
Energy: 1.1728540074351106
Energy: 1.1827556157381174
Energy: 1.2765689913505052
Energy: 1.2083673262464851
Energy: 1.26343499306545
Energy: 1.278286083490692
Energy: 1.3034409719768159
Energy: 1.2596833801727891
Energy: 1.2572529870527813
Energy: 1.310634760650037
Energy: 1.232308164894941
Energy: 1.372985616538645
Energy: 1.2583604614244992
Energy: 1.2759818018672358
Energy: 1.3434647333743666
Energy: 1.3462125411072083
Energy: 1.249862440190288
Energy: 1.2844529025359213
Energy: 1.2805161002153498
Energy: 1.2618905690934679
Energy: 1.2710288573538584
Energy: 1.3278769698041606
Energy: 1.2897769535220631
Energy: 1.2746537644578373
Energy: 1.260270475242772
Energy: 1.2002415578634373
Energy: 1.2465608847921694
Energy: 1.310874063814434
Energy: 1.277105448002162
Energy: 1.2317732914734532
Energy: 1.286017485976625
Energy: 1.2682026942763045
Energy: 1.4438321243938803
Energy: 1.245914413974217
Energy: 1.1849332304743183
Energy: 1.3058032932733152
Energy: 1.2297948831917969
Energy: 1.1825916582849247
Energy: 1.237688001998619
Energy: 1.2114319979917128
Energy: 1.3010513810679911
Energy: 1.269746254761015
Energy: 1.28109086783093
Energy: 1.2422200801010521
Energy: 1.2482862884865074
Energy: 1.2805453079305429
Energy: 1.4119026721937677
Energy: 1.3027733349042572
Energy: 1.2707851360933273
Energy: 1.2514434875308087
Energy: 1.3140466386968472
Energy: 1.3049859461335271
Energy: 1.259524793187005
Energy: 1.4656511485024424
Energy: 1.2863053948438086
Energy: 1.2584582865824319
Energy: 1.2473908777974432
Energy: 1.3863270883896073
Energy: 1.2642432856697003
Energy: 1.2487862830052472
Energy: 1.3348081895132478
Energy: 1.2965377125314128
Energy: 1.2801994879431915
Energy: 1.2779002545870415
Energy: 1.3992814802892808
Energy: 1.2829201908643522
Energy: 1.2610051235753708
Energy: 1.219079529466744
Energy: 1.2346618422529896
Energy: 1.2541776244898428
Energy: 1.2144221812111529
Energy: 1.2398046572413968
Energy: 1.2477957688106642
Energy: 1.218095230340561
Energy: 1.2366451021382776
Energy: 1.2370242678831402
Energy: 1.240655469506835
Energy: 1.227062090920813
Energy: 1.2435630018755401
Energy: 1.2591169063015735
Energy: 1.262671547441952
Energy: 1.2087942811793855
Energy: 1.2478690408164632
Energy: 1.2299453093089179
Energy: 1.2158456328763974
Energy: 1.2254617688379024
Energy: 1.2173039215460522
Energy: 1.1979189755250659
Energy: 1.2256184281339864
Energy: 1.2571408944241653
Energy: 1.3156233252451703
Energy: 1.2619964798813
Energy: 1.2588715687690417
Energy: 1.3491743213385055
Energy: 1.2548985534372392
Energy: 1.2224947684454524
Energy: 1.2133992310670083
Energy: 1.260299037519174
Energy: 1.2500485060978
Energy: 1.241634204002794
Energy: 1.339322176900834
Energy: 1.301219090566496
Energy: 1.232280136699188
Energy: 1.2862883639438116
Energy: 1.2708653327079569
Energy: 1.2336501969112859
Energy: 1.299054814940257
Energy: 1.303020259348952
Energy: 1.2306337334608837
Energy: 1.2035818148867887
Energy: 1.2957666881247172
Energy: 1.28236423897628
Energy: 1.2126935525548619
Energy: 1.1527096907471064
Energy: 1.3030326967800128
Energy: 1.250861706723933

minimum gb energy = 1.1465414670447123 eV
minimum distance =  2.23582623028149 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.3494986905361002
Energy: 1.3387569671298936
Energy: 1.3928094600191818
Energy: 1.4281413638631615
Energy: 1.3793486455522497
Energy: 1.4888810160384
Energy: 1.4749933644960835
Energy: 1.1954571595746213
Energy: 1.136490165387983
Energy: 1.1193568991843554
Energy: 1.1475322035628595
Energy: 1.1145640578135567
Energy: 1.1573340779176058
Energy: 1.2835479448182634
Energy: 1.169299774138131
Energy: 1.1450002438411075
Energy: 1.1732540132883074
Energy: 1.1809900379241973
Energy: 1.1245249254008511
Energy: 1.1270366208868148
Energy: 1.229543226989486
Energy: 1.2120145115809666
Energy: 1.1678600158868755
Energy: 1.1726246636716886
Energy: 1.1920719183022679
Energy: 1.223552847523093
Energy: 1.2780041347650075
Energy: 1.288200957325924
Energy: 1.1692666595946952
Energy: 1.168654223601326
Energy: 1.1822217145845426
Energy: 1.160324131357884
Energy: 1.2025786340848208
Energy: 1.1967964745334618
Energy: 1.2139565421329725
Energy: 1.2955340775071127
Energy: 1.260043257295919
Energy: 1.2836387966582363
Energy: 1.269554808509094
Energy: 1.2734074002568663
Energy: 1.296828585625616
Energy: 1.3405098524972716
Energy: 1.2946671606030506
Energy: 1.262777203189926
Energy: 1.190886609481515
Energy: 1.3245070593353825
Energy: 1.297561192887038
Energy: 1.3125518400899576
Energy: 1.305285806506583
Energy: 1.3056137923687765
Energy: 1.2570043433864848
Energy: 1.2548913599309797
Energy: 1.2702557379141635
Energy: 1.3150463556684475
Energy: 1.3165232030618277
Energy: 1.2943211886449473
Energy: 1.3841037019374463
Energy: 1.2490384159150432
Energy: 1.1856205572493532
Energy: 1.295037169457647
Energy: 1.2347600921778525
Energy: 1.214996667442438
Energy: 1.3066609651859091
Energy: 1.3327769327051795
Energy: 1.2736597232119518
Energy: 1.264814820058807
Energy: 1.3028292930375736
Energy: 1.3193328527897241
Energy: 1.3244129678918857
Energy: 1.405369052192026
Energy: 1.3069935380384292
Energy: 1.2795606870878782
Energy: 1.143507323064714
Energy: 1.1861362821723764
Energy: 1.161292564874224
Energy: 1.1503040975364598
Energy: 1.2882591993435304
Energy: 1.2773011514661428
Energy: 1.2856975182495445
Energy: 1.304191259622437
Energy: 1.2638836501627302
Energy: 1.2756262011178254
Energy: 1.2832293387298361
Energy: 1.309413673961002
Energy: 1.2666037237627774
Energy: 1.280736694452069
Energy: 1.3475042533537709
Energy: 1.322931046285291
Energy: 1.2929085073411992
Energy: 1.3223191511980046
Energy: 1.3192034741345229
Energy: 1.1745992976543917
Energy: 1.12168899548991
Energy: 1.1783795303757925
Energy: 1.1734898849538293
Energy: 1.1839291979147386
Energy: 1.1303703607901308
Energy: 1.1745129561062972
Energy: 1.2315126116619586
Energy: 1.1512599078013364
Energy: 1.204855324392463
Energy: 1.184746830259062
Energy: 1.235925555849525
Energy: 1.1748287340304946
Energy: 1.1737634825302614
Energy: 1.264211589847337
Energy: 1.2804657506045043
Energy: 1.2455983348558988
Energy: 1.28116007676632
Energy: 1.2605874056792128
Energy: 1.2447861533014695
Energy: 1.2547581722541217
Energy: 1.2081767676827082
Energy: 1.1970513145268136
Energy: 1.1986959374317614
Energy: 1.1866912646889114
Energy: 1.1900020438460035
Energy: 1.2085728257836037
Energy: 1.2089621762791207
Energy: 1.2890206015014365
Energy: 1.2854185567613416
Energy: 1.3105888771775027
Energy: 1.3097752721370701
Energy: 1.3012493581701727
Energy: 1.2927201380536142
Energy: 1.3148824095244394
Energy: 1.2775193148606991
Energy: 1.2897336319773929
Energy: 1.299576135608151
Energy: 1.306816533502292
Energy: 1.2994921085331697
Energy: 1.333626196608642
Energy: 1.3181597808563605
Energy: 1.3038412962600276
Energy: 1.1832079055775493
Energy: 1.1925189290553935
Energy: 1.1742926823469164
Energy: 1.192873802370818
Energy: 1.1734686810688986
Energy: 1.3288373319337072
Energy: 1.364563330206601
Energy: 1.2789030211500785
Energy: 1.2803463946786378
Energy: 1.3095204099519941
Energy: 1.2438185333274347
Energy: 1.403675116680318
Energy: 1.379843510903061
Energy: 1.3702244270965402
Energy: 1.1458392577426504
Energy: 1.2879940177351354
Energy: 1.1876630088623499
Energy: 1.1844037147419701
Energy: 1.1410189876671937
Energy: 1.2023792029660794
Energy: 1.2224249240233334
Energy: 1.2382986437674055
Energy: 1.2939992471726818
Energy: 1.2727238301633792
Energy: 1.286109715075353
Energy: 1.2536500470016496
Energy: 1.3274217124367285
Energy: 1.2544529460705756
Energy: 1.27958038258667
Energy: 1.326521914038621
Energy: 1.308649733203703
Energy: 1.2993495714258854
Energy: 1.3214354469289171
Energy: 1.3545227392780121
Energy: 1.2828640809872116
Energy: 1.2800126806325614
Energy: 1.3071512953342228
Energy: 1.3135656524792718
Energy: 1.2932167569557798
Energy: 1.3177688511928463
Energy: 1.3226225268354779
Energy: 1.1813820047454733
Energy: 1.1693694717051597
Energy: 1.1573899906577032
Energy: 1.1444744096147177
Energy: 1.1778405654064676
Energy: 1.1545475916246093
Energy: 1.1834975430599188
Energy: 1.2134410860436042
Energy: 1.2514587869112572
Energy: 1.2183087546206472
Energy: 1.1999228535941626
Energy: 1.2730666923451521
Energy: 1.1738930014708449
Energy: 1.362034474638427
Energy: 1.257507475648783
Energy: 1.2055139190185669
Energy: 1.2050739685261522
Energy: 1.2653373277502553
Energy: 1.234397267362374
Energy: 1.193373328902196
Energy: 1.2326655600072247
Energy: 1.1851745927918302
Energy: 1.155709469360711
Energy: 1.1807382715324182
Energy: 1.194494502384437
Energy: 1.1935436500216823
Energy: 1.1825683434512175
Energy: 1.1588073694778318
Energy: 1.3028619861474136
Energy: 1.3134977151163478
Energy: 1.3459042802717294
Energy: 1.3447643208233009
Energy: 1.3148115942049947
Energy: 1.356925549701725
Energy: 1.2902948212801273
Energy: 1.3141015904581448
Energy: 1.2941749253467416
Energy: 1.2786070050554648
Energy: 1.2957090901810644
Energy: 1.2962597322995135
Energy: 1.305743991861936
Energy: 1.3393745375823283
Energy: 1.3108166551482772
Energy: 1.1784237481992703
Energy: 1.1525847725226748
Energy: 1.1783599087177068
Energy: 1.162590385412585
Energy: 1.1833636627310669
Energy: 1.1636367628053794
Energy: 1.3370808292670742
Energy: 1.3334262269542043
Energy: 1.1896304731646679
Energy: 1.229135337376532
Energy: 1.3724914516168814
Energy: 1.4206664373558435
Energy: 1.391715403772664
Energy: 1.328503639866236
Energy: 1.1599535397701315
Energy: 1.1729937605678902
Energy: 1.1653202912863985
Energy: 1.1620341854924556
Energy: 1.2909818651189322
Energy: 1.4060653226483024
Energy: 1.2333443228443624
Energy: 1.2602192099011895
Energy: 1.2728738675744824
Energy: 1.2574953533473758
Energy: 1.2577617179731198
Energy: 1.269101197260908
Energy: 1.3662254163245329
Energy: 1.2946717964058299
Energy: 1.2668910837846485
Energy: 1.2884071975851017
Energy: 1.3003361411194678
Energy: 1.3250390674153247
Energy: 1.3554261027333117
Energy: 1.3503387754867653

minimum gb energy = 1.1145640578135567 eV
minimum distance =  2.25262237674962 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 1.6336293179313948
Energy: 1.3141372452299516
Energy: 1.527612736311029
Energy: 1.3166963728200713
Energy: 1.3150447480790461
Energy: 1.526961460341047
Energy: 1.3149510399583482
Energy: 1.2434578449563278
Energy: 1.1668274769497375
Energy: 1.188627257793714
Energy: 1.178190582780542
Energy: 1.144990721017325
Energy: 1.1667571917086974
Energy: 1.187555263678214
Energy: 1.2191339194391946
Energy: 1.1869399900390978
Energy: 1.1749512565475255
Energy: 1.2147140291479428
Energy: 1.2168197667834562
Energy: 1.2168170694915972
Energy: 1.2369791654974103
Energy: 1.279903045538822
Energy: 1.123175126874238
Energy: 1.2791783903199203
Energy: 1.2579943943766303
Energy: 1.1868925907619896
Energy: 1.1269663168331836
Energy: 1.2984100914992813
Energy: 1.2671942604520896
Energy: 1.2115539262850388
Energy: 1.2262855551877427
Energy: 1.261807758485058
Energy: 1.200967075500901
Energy: 1.2184347414220762
Energy: 1.2723309315591431
Energy: 1.2390138651198654
Energy: 1.236618591591676
Energy: 1.209127593597847
Energy: 1.2767676566192214
Energy: 1.1830290522631008
Energy: 1.2126631484592265
Energy: 1.2225372775397498
Energy: 1.2332530124135859
Energy: 1.1851169408637148
Energy: 1.2198937571481303
Energy: 1.2253548193540034
Energy: 1.2083799264991137
Energy: 1.236016251051774
Energy: 1.264635428060021
Energy: 1.2737918278933527
Energy: 1.2030069640577834
Energy: 1.2364372850694076
Energy: 1.2967362910955968
Energy: 1.2634090499115442
Energy: 1.2308060874664357
Energy: 1.191760015810462
Energy: 1.3528623867153853
Energy: 1.3352622740628965
Energy: 1.2250745599097506
Energy: 1.2611433544408621
Energy: 1.3341015339519116
Energy: 1.2278635076998508
Energy: 1.3345244265410474
Energy: 1.3254175845893081
Energy: 1.325305323263845
Energy: 1.2848849671965132
Energy: 1.2883709561375256
Energy: 1.3203970688841986
Energy: 1.1279830088034575
Energy: 1.3573457305802326
Energy: 1.3040112720310142
Energy: 1.2201365183081256
Energy: 1.2203967794942334
Energy: 1.2671506843399731
Energy: 1.212593547833284
Energy: 1.1669662262963019
Energy: 1.2595613739185183
Energy: 1.3041227988678563
Energy: 1.1236937444040969
Energy: 1.1602838968109368
Energy: 1.199392890125445
Energy: 1.2474384110924404
Energy: 1.1271234070966571
Energy: 1.3048584639735303
Energy: 1.372273305077717
Energy: 1.2930962300500453
Energy: 1.4324369927851577
Energy: 1.3021910644279073
Energy: 1.3408958778623457
Energy: 1.29341824046664
Energy: 1.4309644293821449
Energy: 1.3736114718339583
Energy: 1.1425077716676628
Energy: 1.183332635815519
Energy: 1.2731028199210705
Energy: 1.253572903751979
Energy: 1.1831827703529323
Energy: 1.2668734889992648
Energy: 1.3047188615487364
Energy: 1.2852523438736916
Energy: 1.2366326888740076
Energy: 1.2924952221761716
Energy: 1.2997715826054932
Energy: 1.1754220157552833
Energy: 1.2368597181204994
Energy: 1.3644979193715032
Energy: 1.302874644784572
Energy: 1.2901847316497597
Energy: 1.3145021260277294
Energy: 1.371128464651112
Energy: 1.2811217068180254
Energy: 1.3618158372913345
Energy: 1.333648599927356
Energy: 1.1431173887035204
Energy: 1.1840398241450139
Energy: 1.227125322799247
Energy: 1.1562370081035287
Energy: 1.174886076967578
Energy: 1.237154456118163
Energy: 1.3735795509902806
Energy: 1.1424188269484168
Energy: 1.1967122164793027
Energy: 1.2735617155178363
Energy: 1.2537567696836593
Energy: 1.2003774523365283
Energy: 1.2173725257041412
Energy: 1.3217297922568514
Energy: 1.1233110370042356
Energy: 1.325806094633048
Energy: 1.222141858041408
Energy: 1.1872533749082046
Energy: 1.1270021170178413
Energy: 1.3195718528160558
Energy: 1.2929875219202287
Energy: 1.1817561056866992
Energy: 1.168921344734588
Energy: 1.164699989763172
Energy: 1.1590087446289385
Energy: 1.188621338019738
Energy: 1.2749048110199843
Energy: 1.277157969209443
Energy: 1.247116808512424
Energy: 1.2340317115902961
Energy: 1.2544887812994745
Energy: 1.1265197588452616
Energy: 1.1852309862104915
Energy: 1.212714572248501
Energy: 1.2536086063658722
Energy: 1.202843137006166
Energy: 1.200214827635517
Energy: 1.1700016060326535
Energy: 1.2201931169746474
Energy: 1.1997339560465003
Energy: 1.25958740713796
Energy: 1.3069509872884262
Energy: 1.212257462861434
Energy: 1.2212748984396975
Energy: 1.2151665156621712
Energy: 1.3031286612996085
Energy: 1.2307867647999644
Energy: 1.2737069798667133
Energy: 1.3162591509406263
Energy: 1.333154466451982
Energy: 1.424295236094831
Energy: 1.382259292226213
Energy: 1.29893994645362
Energy: 1.4213161263153482
Energy: 1.3689526520644175
Energy: 1.3136380218227295
Energy: 1.3098156274344246
Energy: 1.2456787757119585
Energy: 1.2969370835301366
Energy: 1.3094234050814717
Energy: 1.4038632748192816
Energy: 1.3672167373795945
Energy: 1.2662542678851036
Energy: 1.2141171914892346
Energy: 1.189708399624098
Energy: 1.2858159865146612
Energy: 1.2759122106677434
Energy: 1.1893206601590438
Energy: 1.2673535392418793
Energy: 1.2627666206741543
Energy: 1.123857330261553
Energy: 1.2268142758670681
Energy: 1.2819412706315336
Energy: 1.2860332731844268
Energy: 1.1890851900251103
Energy: 1.3786921005059456
Energy: 1.2367816648606929
Energy: 1.2933089328013567
Energy: 1.3718474842602193
Energy: 1.3121359407124145
Energy: 1.3602474651024437
Energy: 1.293600619176409
Energy: 1.3917005164613983
Energy: 1.2208969127677773
Energy: 1.1878404728237317
Energy: 1.192863127934021
Energy: 1.216743170410865
Energy: 1.217611993968318
Energy: 1.1966657197669137
Energy: 1.2064179352125775
Energy: 1.2429141187342647
Energy: 1.3023961723482111
Energy: 1.2358951994650402
Energy: 1.2686908000583963
Energy: 1.26622168155295
Energy: 1.1949428998918674
Energy: 1.1999867555234247

minimum gb energy = 1.123175126874238 eV
minimum distance =  2.28450366010694 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.881184833327105
Energy: 1.2657335601195334
Energy: 1.214305975904273
Energy: 1.2079345233748762
Energy: 1.1908802843667887
Energy: 1.1089323027460023
Energy: 1.186248012675367
Energy: 1.2631659060077227
Energy: 1.1627523233466248
Energy: 1.23261819712011
Energy: 1.2661335130787341
Energy: 1.2553393056226976
Energy: 1.150225930367452
Energy: 1.2670648706917744
Energy: 1.2683948333517594
Energy: 1.0970406427608643
Energy: 1.1774481252474052
Energy: 1.2526218186709377
Energy: 1.1884612884667312
Energy: 1.1004490552592014
Energy: 1.1775357864808846
Energy: 1.2740484898296736
Energy: 1.0686430900935244
Energy: 1.1879747222422572
Energy: 1.3253264252021648
Energy: 1.0217511744633214
Energy: 1.1885581149708255
Energy: 1.1369019673120146
Energy: 1.1224836785556105
Energy: 1.0605052613478232
Energy: 1.1865343988306654
Energy: 1.1491780771273121
Energy: 1.1010556883738307
Energy: 1.0878942587107503
Energy: 1.154371373263505
Energy: 1.1333121498978134
Energy: 1.103844007556823
Energy: 1.2064056928962121
Energy: 1.1582817231442055
Energy: 1.1282861888714586
Energy: 1.103238867064184
Energy: 1.1871544849423865
Energy: 1.0310242742469997
Energy: 1.1327047439284053
Energy: 1.0348733174974432
Energy: 1.038673959636416
Energy: 1.067228336874414
Energy: 1.1377144042492235
Energy: 1.0567036020737812
Energy: 1.0304462341211436
Energy: 0.9967630277192381
Energy: 1.0756051324964446
Energy: 1.0752250021749208
Energy: 1.034307488733854
Energy: 1.1754791921787069
Energy: 1.0377064013369839
Energy: 1.0695395041651319
Energy: 1.0337699932645505
Energy: 1.177930643965006
Energy: 1.0631641228337463
Energy: 1.0755552016805772
Energy: 1.150336314036989
Energy: 1.0398888774577921
Energy: 0.9973872767963302
Energy: 0.9972432826317773
Energy: 1.031228129866606
Energy: 1.0028353870369873
Energy: 1.004498134524874
Energy: 1.0739414506119291
Energy: 1.0596759077766817
Energy: 1.0445288889870652
Energy: 1.0395289790419862
Energy: 1.1233428028322556
Energy: 1.1157612807078934
Energy: 1.0049518437717424
Energy: 1.1220021879852162
Energy: 1.1244913405697576
Energy: 1.0879092684600333
Energy: 1.0551111848222905
Energy: 1.0430206094094276
Energy: 1.1054222479233813
Energy: 1.0960901442457824
Energy: 1.0472016712134995
Energy: 1.0776008400615424
Energy: 1.0950111422328952
Energy: 1.0234427995222635
Energy: 0.9967808737447917
Energy: 1.09022204617673
Energy: 1.094171930154929
Energy: 0.9972574155693025
Energy: 1.0016735841378266
Energy: 1.0720117860560587
Energy: 1.0650233600997552
Energy: 0.9967837013644909
Energy: 1.100757776526952
Energy: 1.087967693231088
Energy: 1.0408520392359109
Energy: 0.9972152541868343
Energy: 1.1066708656473734
Energy: 1.108869422383514
Energy: 1.0302593312652657
Energy: 1.038037058315875
Energy: 1.138197003311731
Energy: 1.0670343863739291
Energy: 1.0697962560280572
Energy: 1.1660548293546211
Energy: 1.115584368443706
Energy: 1.0673537558632082
Energy: 1.1868135650200655
Energy: 1.0597721305212175
Energy: 1.1756078578921667
Energy: 1.0847598306241668
Energy: 1.1654169669543268
Energy: 1.1273931584692154
Energy: 1.0309527916597168
Energy: 1.188270726304555
Energy: 1.0681612103495643
Energy: 1.1440357349169474
Energy: 1.1094130453733615
Energy: 1.1574112158235847
Energy: 1.1522066627983885
Energy: 1.163354424499717
Energy: 1.1449218380197992
Energy: 1.1844965187305092
Energy: 1.216539834877333
Energy: 1.1518195129656226
Energy: 1.2383274739396737
Energy: 1.185745211688431
Energy: 1.186489988517496
Energy: 1.1228789972505406
Energy: 1.1883505048625937
Energy: 1.1310867659450827
Energy: 1.1104955258282092
Energy: 1.1476306309003386
Energy: 1.0972484788752992
Energy: 1.2199872055811392
Energy: 1.1476999325437396
Energy: 1.1882753904090326
Energy: 1.125995226625082
Energy: 1.273691015476764
Energy: 1.2612311689352107
Energy: 1.0955659860658606
Energy: 1.2551299742324646
Energy: 1.2790962769988756
Energy: 1.12958954657981
Energy: 1.1618969742907437
Energy: 1.2670903929169417
Energy: 1.2199174974945164
Energy: 1.0574415443285499
Energy: 1.2682025294099453
Energy: 1.271391166157369
Energy: 1.034757725072692
Energy: 1.1707358968712638
Energy: 1.3329769977824306
Energy: 1.2412670465270876
Energy: 1.0654342963050685
Energy: 1.2723706091005735
Energy: 1.3241810119795656
Energy: 1.0215845992779105
Energy: 1.1841889116779682
Energy: 1.331528557389863
Energy: 1.2751345054406795
Energy: 1.1463696373848447
Energy: 1.236384438346994
Energy: 1.2794226732390783
Energy: 1.2355492576434688
Energy: 1.1453127218804093
Energy: 1.2740164712262754
Energy: 1.2641053400338054
Energy: 1.1249113474411
Energy: 1.1496917747697515
Energy: 1.2666654837910785
Energy: 1.3203675298678055
Energy: 1.1489497332451057
Energy: 1.266013629822243

minimum gb energy = 0.9967630277192381 eV
minimum distance =  2.30128541461638 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.9004024889942526
Energy: 1.052395041228734
Energy: 1.0147971908168218
Energy: 1.1366533302922783
Energy: 1.1374816955496032
Energy: 1.0272878603646192
Energy: 1.09911130217444
Energy: 1.0081786333696598
Energy: 1.0679040479775088
Energy: 1.056815464571796
Energy: 1.1052527758820436
Energy: 1.0821743052282427
Energy: 1.1224912526721293
Energy: 1.0705592292634194
Energy: 1.0694682287099033
Energy: 1.0881539119828392
Energy: 1.0843113189452576
Energy: 1.0937062381176696
Energy: 1.127130621369857
Energy: 1.0658211332270482
Energy: 1.0798782047914692
Energy: 1.1151828531155568
Energy: 1.1445833132550693
Energy: 1.1211496364351097
Energy: 1.0951660462312527
Energy: 1.0359166194567762
Energy: 1.100463380441133
Energy: 1.1013733583067389
Energy: 1.0232887326902205
Energy: 1.0888999315432963
Energy: 1.0568048440435849
Energy: 1.0929757918603764
Energy: 1.0739920859324448
Energy: 1.1012296241007378
Energy: 1.0934308809889186
Energy: 1.0293217202069345
Energy: 1.034452673222862
Energy: 1.0751767165994834
Energy: 1.0784254616096944
Energy: 1.0275509582222413
Energy: 1.0581043135411072
Energy: 1.0477299778709825
Energy: 1.0165819437846373
Energy: 1.1324162625074852
Energy: 1.0396302966856577
Energy: 1.0732044609771576
Energy: 1.0321977264755546
Energy: 1.1049918193369166
Energy: 1.0360612825541053
Energy: 1.0262778015478229
Energy: 1.1155651323656708
Energy: 1.0391865996381275
Energy: 1.0359377751544279
Energy: 1.0552089104623714
Energy: 1.0607304866139011
Energy: 1.0318724015479184
Energy: 1.0517784938315509
Energy: 1.0063890515736638
Energy: 1.0692537536960178
Energy: 1.0642172331167357
Energy: 1.065079358520338
Energy: 1.0616628436626594
Energy: 1.0286714080788124
Energy: 0.9948375192555791
Energy: 1.0005258289533545
Energy: 1.0461183298773138
Energy: 1.0464750297179375
Energy: 1.0302738588430713
Energy: 1.0006568714516095
Energy: 1.049035651523476
Energy: 1.0140055015425964
Energy: 1.0050757608841159
Energy: 1.0101909321843272
Energy: 1.0545587203768285
Energy: 1.0046689958572952
Energy: 1.0093462829058715
Energy: 1.0559496013629832
Energy: 1.0413090948702688
Energy: 0.9977010495386015
Energy: 1.0187536223425964
Energy: 1.0635778672798113
Energy: 1.0097559908239873
Energy: 0.9987643273423382
Energy: 1.018166101827452
Energy: 0.9910708452524467
Energy: 0.9927806271116179
Energy: 0.9798485263725708
Energy: 0.958780419380896
Energy: 1.0188402413735447
Energy: 0.9840346902694417
Energy: 0.9786706286849894
Energy: 1.0226082256879927
Energy: 0.9715450033812892
Energy: 0.9816079654783638
Energy: 1.0134290632454694
Energy: 1.0568384435630287
Energy: 0.967488885616505
Energy: 0.9818068017946094
Energy: 0.9705617243198489
Energy: 1.034468393199134
Energy: 0.9954528543373445
Energy: 0.9570509872354601
Energy: 1.0044955068981396
Energy: 1.0139446568281716
Energy: 0.984525794208625
Energy: 0.9613588744203968
Energy: 0.9881768582998703
Energy: 0.9553225269415332
Energy: 0.9577053076494699
Energy: 0.9541526653138908
Energy: 1.004213598441645
Energy: 0.934256691708382
Energy: 0.9528097791339151
Energy: 0.9801130663320587
Energy: 0.9767409428221113
Energy: 0.9655265025018138
Energy: 0.9541953503956048
Energy: 0.979361215708417
Energy: 0.9578910917640472
Energy: 0.996666590017544
Energy: 0.974585240713776
Energy: 0.9717776009138629
Energy: 0.9775660714122738
Energy: 0.9776298846190556
Energy: 0.9719911382244517
Energy: 0.9672880618190366
Energy: 0.9787249866476543
Energy: 0.9656986660244387
Energy: 0.9632055586191443
Energy: 0.9821777761750411
Energy: 0.9843653331224892
Energy: 0.9821831547106216
Energy: 0.9781780909422487
Energy: 0.9657171677369881
Energy: 0.9195798818286857
Energy: 0.9782893052806428
Energy: 0.9675413517790242
Energy: 0.9311181343509046
Energy: 0.9819883568369853
Energy: 0.9605118279294462
Energy: 0.9767084153599425
Energy: 0.9349903875985058
Energy: 0.960508967983379
Energy: 0.9885366519271438
Energy: 0.9370613972033198
Energy: 0.9543264687843307
Energy: 0.9767953567636172
Energy: 0.9707196583048836
Energy: 0.9357452664030567
Energy: 0.9599556036183166
Energy: 1.0082789287815486
Energy: 0.9356652060022328
Energy: 0.9689399452149307
Energy: 0.9985650514240026
Energy: 0.9329777084959834
Energy: 0.9576766702361363
Energy: 0.9331689614257038
Energy: 0.9656715221351218
Energy: 0.9788274337210521
Energy: 0.9304703763545074
Energy: 0.9781376122116504
Energy: 0.9557421533431278
Energy: 0.9547504950013433
Energy: 0.9690530735174182
Energy: 0.9299860384210284
Energy: 0.9826209101817467
Energy: 0.9499873535223798
Energy: 0.9546998943150444
Energy: 0.9628665317611376
Energy: 0.9995700833484704
Energy: 0.9728754675706636
Energy: 0.9464724501196519
Energy: 0.9880016659740217
Energy: 0.9700161528619604
Energy: 0.9626600367757798
Energy: 0.9658545828939039
Energy: 0.9877997825229324
Energy: 0.9849126557564515
Energy: 0.9530404587701748
Energy: 0.9691156986224047
Energy: 0.9864922921968103
Energy: 0.9221274526612081
Energy: 0.9532493625659806
Energy: 0.9735480381530037
Energy: 0.9790238853231962
Energy: 0.963185617578953
Energy: 0.9689927316256293
Energy: 0.9705353495336664
Energy: 0.9404940599760461
Energy: 0.9934912393022156
Energy: 0.9952522848618803
Energy: 0.9571365627951216
Energy: 0.9610852667732923
Energy: 0.9809979799180851
Energy: 0.9829600718336905
Energy: 0.9880351719451818
Energy: 0.9887419461685648
Energy: 0.980366572879775
Energy: 0.9779461341656988
Energy: 0.9651649902923918
Energy: 0.973007063805292
Energy: 0.9702467003944512
Energy: 0.9996427326112638
Energy: 0.9922128688136663
Energy: 0.9643167975063285
Energy: 0.9954245415155076
Energy: 0.972615106667502
Energy: 0.9747849325448756
Energy: 0.9800425495926095
Energy: 0.9962636761131303
Energy: 0.9945215782896776
Energy: 0.982061296951583
Energy: 1.017047463764855
Energy: 1.0368405859857164
Energy: 0.9841733396091371
Energy: 1.0142849199888664
Energy: 1.001725008442283
Energy: 1.0093952085837554
Energy: 0.9629883845212782
Energy: 1.0295036675680496
Energy: 1.0314018872688755
Energy: 0.9855058848290494
Energy: 0.9630178677747282
Energy: 1.0257209606980398
Energy: 1.0139752277592178
Energy: 0.9637596977774294
Energy: 1.0195414175459943
Energy: 1.0267239146711666
Energy: 0.964865829026992
Energy: 1.0163909377848153
Energy: 1.025262721704067
Energy: 1.0727679830538115
Energy: 1.0252186039125082
Energy: 1.0269852606119534
Energy: 1.0110393658816137
Energy: 0.9997463752043324
Energy: 1.0221657720998152
Energy: 1.0199454065023086
Energy: 0.9879104752978013
Energy: 1.0788003528975845
Energy: 1.0324091556522645
Energy: 0.997303325612012
Energy: 1.0121089069325626
Energy: 1.028076598635111
Energy: 1.0495078446235828
Energy: 0.9873285468829472
Energy: 1.052226456138018
Energy: 1.0434678297780038
Energy: 0.9571065634332618
Energy: 1.016136866582342
Energy: 1.0465862758384175
Energy: 1.0423852444798343
Energy: 0.9953984375927994
Energy: 1.0640478001343079
Energy: 1.0063979111778771
Energy: 1.0372588932492206
Energy: 1.0053286527472378
Energy: 1.0712042060397298
Energy: 1.0294206423448937
Energy: 1.0124643486921114
Energy: 1.034499554181622
Energy: 1.0256541108526431
Energy: 1.0406273032063749
Energy: 1.0439824317768303
Energy: 1.0358930496634535
Energy: 1.0301579234831968
Energy: 1.0461471415730266
Energy: 1.0713845001097655
Energy: 1.012486354370647
Energy: 1.0110576015988175
Energy: 1.1094890947851777
Energy: 0.9971162219472166
Energy: 0.9912911361669596
Energy: 1.0599348665780104
Energy: 1.0796860016059893
Energy: 1.0084045747912302
Energy: 1.0224540772031312
Energy: 1.139093511595946
Energy: 1.0758323593322663
Energy: 1.0053711432738393
Energy: 1.0982095276950226
Energy: 1.0241078785126752
Energy: 1.0467814509246007
Energy: 1.0438715630384148
Energy: 1.0916977233820944
Energy: 1.0883909889639511
Energy: 0.9983611829444027
Energy: 1.0583765722921739
Energy: 1.045263714093469
Energy: 1.107022641821549
Energy: 1.0511916278233242
Energy: 1.0258003087213288
Energy: 1.0623625513370218
Energy: 1.1236566751948072
Energy: 1.1294315883382566
Energy: 1.062890912333243
Energy: 1.0443750181608231
Energy: 1.1031825741362908
Energy: 1.1089930967029895
Energy: 1.0698405718259885
Energy: 1.0160340136361918
Energy: 1.0540624201807787
Energy: 1.0928859702501765
Energy: 1.087423445844277
Energy: 1.109062474010872
Energy: 1.1676741464895604
Energy: 1.081052732737023
Energy: 1.131001630202472
Energy: 1.0821067889938054
Energy: 1.1606435949658438
Energy: 1.0173424820644255
Energy: 1.1043834458507384
Energy: 1.0549740656918836
Energy: 1.020631787058566
Energy: 1.0974084312136774

minimum gb energy = 0.9195798818286857 eV
minimum distance =  2.29799488847144 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 2.1315418050996544
Energy: 1.0009666284449443
Energy: 1.0018841850681142
Energy: 1.0027732339090978
Energy: 1.0025912863534576
Energy: 1.0020560931462617
Energy: 1.001232759145996
Energy: 1.0236114130900473
Energy: 0.38356997534028586
Energy: 0.39285290649140864
Energy: 0.39325002913335
Energy: 0.4037044954732024
Energy: 0.39371674923849087
Energy: 0.3925830752626159
Energy: 0.37670008795395943
Energy: 0.3921259828656137
Energy: 0.39402555434962205
Energy: 0.39847154428995724
Energy: 0.4025299945402723
Energy: 0.3932840957644865
Energy: 0.3928229438769998
Energy: 1.0236765698386798
Energy: 1.0236459350353235
Energy: 1.00190287400741
Energy: 1.002626590423985
Energy: 1.0291335963109236
Energy: 1.0026219359485589
Energy: 1.0020005975640907
Energy: 1.0236696142187183
Energy: 1.0237966910022127
Energy: 1.0236032561534754
Energy: 1.0455458589208269
Energy: 1.0291402655969852
Energy: 1.045935710498122
Energy: 1.0238613740884153
Energy: 0.37683066234468465
Energy: 0.3933171363975416
Energy: 0.39470921396168235
Energy: 0.39980831206717216
Energy: 0.4026768944389686
Energy: 0.39330053497087925
Energy: 0.3837545027223825
Energy: 1.0236640122547187
Energy: 1.0239574066419628
Energy: 1.002166685488605
Energy: 1.027467491166361
Energy: 1.028964557783536
Energy: 1.0032942765194657
Energy: 1.0238927825078703
Energy: 1.0234805585620506
Energy: 1.023949778683232
Energy: 1.0022646968322384
Energy: 1.0276352909964446
Energy: 1.0289345130554564
Energy: 1.0026072521332574
Energy: 1.0239204022054345
Energy: 0.37700670407185344
Energy: 0.3925540052301623
Energy: 0.39469920865446073
Energy: 0.4000325995511821
Energy: 0.4024230800496481
Energy: 0.39628665340304725
Energy: 0.393537932753188
Energy: 1.0239492223879725
Energy: 1.0237964232465513
Energy: 1.0445890615889026
Energy: 1.0469186056522142
Energy: 1.0520916862426146
Energy: 1.0456471776812644
Energy: 1.023783203855179
Energy: 1.0235313438260387
Energy: 1.0221593843096282
Energy: 1.0021564220592611
Energy: 1.0026336522112134
Energy: 1.0291502324421484
Energy: 1.002123826179911
Energy: 1.0016347969477926
Energy: 0.37694747319346794
Energy: 0.39237171070662086
Energy: 0.39372393727073135
Energy: 0.3933201268771529
Energy: 0.40265226589699415
Energy: 0.39500178015492987
Energy: 0.3928185396034224
Energy: 0.3767997503275395
Energy: 0.38315623867633974
Energy: 0.39298005474339104
Energy: 0.39904420543987484
Energy: 0.4023483909430608
Energy: 0.39403918478905114
Energy: 0.3930236873127641
Energy: 1.0223825404866267
Energy: 1.0223441271773912
Energy: 1.001886861014804
Energy: 1.0024668296750319
Energy: 1.0030403220934652
Energy: 1.0019630423192274
Energy: 1.0013696788027366
Energy: 1.0235684125564548
Energy: 1.0238191931955094
Energy: 1.0452344256914183
Energy: 0.3934229631468825
Energy: 0.4034460348446924
Energy: 0.39371588254762785
Energy: 1.044634662594687
Energy: 0.3768843871017397
Energy: 0.39227326447506744
Energy: 0.3949306720027543
Energy: 0.39887847278103256
Energy: 0.40273866447375595
Energy: 0.39473896326126234
Energy: 0.39294132040496293
Energy: 1.022042377020364
Energy: 1.0238503104573098
Energy: 1.002108797586165
Energy: 1.0028163152787206
Energy: 1.0289345264963792
Energy: 1.0027808994633904
Energy: 1.0016143103502866
Energy: 1.0242010087882454
Energy: 1.0239441284622461
Energy: 1.0236905927293085
Energy: 1.027560446924341
Energy: 1.0290822226070426
Energy: 1.0456391723325085
Energy: 1.0239635739121826
Energy: 0.376914667160933
Energy: 0.3843640780727722
Energy: 0.3844477380629593
Energy: 0.40052542268898755
Energy: 0.40285180375457347
Energy: 0.38427758385315586
Energy: 0.3844358462041851
Energy: 1.0235875642585948
Energy: 1.0237173586286974
Energy: 1.0240562296537186
Energy: 1.027259516243046
Energy: 1.0288680039099363
Energy: 1.027096429238863
Energy: 1.0238539675227682

minimum gb energy = 0.37670008795395943 eV
minimum distance =  2.36391306362142 Angstroms
sigma value = 23