Model name: model_name=MEAM_LAMMPS_WangOhLee_2020_CuCo__MO_694335101831_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315641880036
cohesive_energy=3.5402784385503736
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: 0.013701671373755933
Energy: 0.01447079530846197
Energy: 0.8633282793576845
Energy: 0.014470795307834168
Energy: 0.014470795307834168
Energy: 0.731623805638013
Energy: 0.014470795307834168
Energy: 0.731623805638013
Energy: 0.8633282793583124
Energy: 0.014470795307834168
Energy: 0.013701671373755933
Energy: 0.01447079530846197
Energy: 0.01447079530846197
Energy: 0.731623805638013
Energy: 0.01447079530846197
Energy: 0.731623805638013

minimum gb energy = 0.013701671373755933 eV
minimum distance =  2.47126489396798 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 0.9558556225578375
Energy: 1.0030219260633217
Energy: 0.9131322756453621
Energy: 1.0030219260633217
Energy: 0.8945447485910998
Energy: 1.1435600659391516
Energy: 0.8981558112459864
Energy: 1.1435600659391516
Energy: 1.011128327612759
Energy: 0.9949330338910365
Energy: 0.9444502675629904
Energy: 0.9949330338910365
Energy: 0.8904052791815238
Energy: 1.0754178623419213
Energy: 0.8653349295119278
Energy: 1.0754178623411599
Energy: 0.9350760099678279
Energy: 1.0622505580291595
Energy: 0.9009457848127002
Energy: 1.0622505580291595
Energy: 0.8572571350474285
Energy: 1.180907779214338
Energy: 0.8399407605076431
Energy: 1.180907779214338
Energy: 0.932940465701369
Energy: 1.0836206396056367
Energy: 0.8758384220877732
Energy: 1.0836206396056367
Energy: 0.818822806424833
Energy: 1.0626185877189058
Energy: 0.8285178496594496
Energy: 1.0626185877181444
Energy: 0.878279683727966
Energy: 1.1112691618281823
Energy: 1.0079476522960142
Energy: 1.1112691610770389
Energy: 0.8324915460490144
Energy: 0.995663384363711
Energy: 0.8125938073736612
Energy: 0.9956633843629498
Energy: 1.0185088247167937
Energy: 0.9578038528377002
Energy: 0.8783759104577636
Energy: 0.9578038528392231
Energy: 0.918454591991527
Energy: 1.063623353998389
Energy: 0.8429265739979336
Energy: 1.063623353998389
Energy: 0.8973394785130947
Energy: 1.118217986678005
Energy: 0.9328577948179378
Energy: 1.118217986678005
Energy: 0.946865040277138
Energy: 0.998441492072452
Energy: 0.858201737715305
Energy: 0.998441492072452
Energy: 0.922900652974176
Energy: 1.0621876369369874
Energy: 0.9959533520232136
Energy: 1.0621876369369874
Energy: 0.9224224752470523
Energy: 1.1199687170039307
Energy: 0.893507959332167
Energy: 1.1199687170031694
Energy: 0.9443346999157266
Energy: 0.9966707624063232
Energy: 0.8562681424241765
Energy: 0.9966707624063232
Energy: 0.8982161042284574
Energy: 1.1194986457800014
Energy: 0.9326396169231522
Energy: 1.1194986457800014
Energy: 0.821310970435833
Energy: 1.0056877627182101
Energy: 0.8417102908709742
Energy: 1.0056877627182101
Energy: 1.014833539786
Energy: 0.8849032223352633
Energy: 0.8798288744184265
Energy: 0.884903222336786
Energy: 0.8351968625782883
Energy: 0.9954816072958623
Energy: 0.8176340377197608
Energy: 0.9954816072966237
Energy: 0.8793092051983068
Energy: 1.1793125991817832
Energy: 1.0043147290482974
Energy: 1.1793125991817832
Energy: 1.0253042778945698
Energy: 1.0630890219787525
Energy: 0.8822341611249753
Energy: 1.0630890219787525
Energy: 0.9638701989361946
Energy: 1.0488162346322163
Energy: 0.8760791142924751
Energy: 1.0488162346314551
Energy: 0.8742352467096705
Energy: 1.1747905128079719
Energy: 1.0333151341102884
Energy: 1.1747905128072103
Energy: 0.9341882577563445
Energy: 1.0579401954205803
Energy: 0.8612196005723445
Energy: 1.0579401954198189
Energy: 0.8926075481741448
Energy: 0.9392203817097199
Energy: 0.8789728000984874
Energy: 0.9392203817097199
Energy: 1.0050570109425676
Energy: 0.9938171526228997
Energy: 0.9422650898577918
Energy: 0.9938171526221384
Energy: 0.8938586483993926
Energy: 1.0543543658142231
Energy: 0.8926785051097494
Energy: 1.0543543658142231
Energy: 0.9560336316801739
Energy: 1.0039566000756999
Energy: 0.920160163594855
Energy: 1.0039566000764613
Energy: 0.8924516625171359
Energy: 1.0862109865262712
Energy: 0.8972596917533189
Energy: 1.0862109865255098
Energy: 0.8685433730018086
Energy: 0.9992402316887631
Energy: 0.9475058469977388
Energy: 0.9992402316887631
Energy: 0.9125120865038199
Energy: 0.8862290984426443
Energy: 0.8649590860856994
Energy: 0.8862290984426443

minimum gb energy = 0.8125938073736612 eV
minimum distance =  2.32927048337083 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 1.0164739238737586
Energy: 1.0672409560111982
Energy: 0.9622006558203695
Energy: 1.0672409560120664
Energy: 0.9335805841802092
Energy: 1.1970030587616696
Energy: 0.93669058075967
Energy: 1.1970030587608012
Energy: 1.0711750003548368
Energy: 1.05292588807744
Energy: 1.0107230147215778
Energy: 1.05292588807744
Energy: 0.9039080908264908
Energy: 0.9045685656986475
Energy: 0.8904121451733306
Energy: 0.9045685656986475
Energy: 0.9040225804734549
Energy: 1.1306425675153595
Energy: 1.049464561590978
Energy: 1.1306425675144915
Energy: 0.994358486821077
Energy: 1.1358390321148095
Energy: 1.0117764574133186
Energy: 1.1358390321165455
Energy: 1.028168850514812
Energy: 1.087794657721188
Energy: 0.9226427029289903
Energy: 1.087794657721188
Energy: 0.8473331710712981
Energy: 1.0741692582733189
Energy: 0.8774230288901338
Energy: 1.0741692582733189
Energy: 0.9178847293041416
Energy: 0.9324157140329453
Energy: 1.0868123260947384
Energy: 0.9324157140338135
Energy: 0.8771973470273752
Energy: 1.144997598915319
Energy: 0.9075078430886413
Energy: 1.144997598917923
Energy: 0.9190534182069081
Energy: 1.0897406423868379
Energy: 0.9431714617400812
Energy: 1.089740642385102
Energy: 0.8841443105752482
Energy: 1.0594022748953396
Energy: 0.9819418096995158
Energy: 1.0594022748936034
Energy: 0.9820568468612965
Energy: 1.1287349054737168
Energy: 0.9214110236120263
Energy: 1.1287349054745848
Energy: 0.9820195300923527
Energy: 1.128865229452116
Energy: 0.9110740121831801
Energy: 1.1288652294547203
Energy: 0.8841034320488513
Energy: 1.0592483834219355
Energy: 0.9816761308493921
Energy: 1.059248383423672
Energy: 0.919148133670821
Energy: 1.0895647383068796
Energy: 0.9366398141694586
Energy: 1.0895647383060114
Energy: 0.8771925274105631
Energy: 1.1450149545731598
Energy: 0.8547838115683637
Energy: 1.145014954574028
Energy: 0.9178687859546406
Energy: 0.9323824547259324
Energy: 0.9523838300410127
Energy: 0.9323824547259324
Energy: 0.8473135123006916
Energy: 1.0740096169177507
Energy: 0.8690330114467276
Energy: 1.074009616920355
Energy: 1.028201089918251
Energy: 1.0876986766048065
Energy: 0.9207439150193127
Energy: 1.0876986766039383
Energy: 0.9944892634593689
Energy: 1.1355384467236254
Energy: 0.8631096066396537
Energy: 1.1355384467210208
Energy: 0.9040530284938545
Energy: 1.1307478187053315
Energy: 0.9227219308992217
Energy: 1.1307478187070679
Energy: 0.9039764175784949
Energy: 0.9042698590179598
Energy: 0.8903964952743919
Energy: 0.9042698590179598
Energy: 1.0713399420078562
Energy: 1.052926760221374
Energy: 1.0103862117390556
Energy: 1.052926760220506
Energy: 0.933523001024135
Energy: 1.1970563310196793
Energy: 0.9366192041717138
Energy: 1.1970563310196793
Energy: 1.0164739238746268
Energy: 1.0672409560111982
Energy: 0.974148599353248
Energy: 1.0672409560120664
Energy: 0.9335805841810773
Energy: 1.1970030587608012
Energy: 0.93669058075967
Energy: 1.1970030587599332
Energy: 1.0711750003548368
Energy: 1.052925888076572
Energy: 0.9478000566314474
Energy: 1.05292588807744
Energy: 0.9039080908273588
Energy: 0.9045685656969112
Energy: 0.8980539958137976
Energy: 0.9045685656986475

minimum gb energy = 0.8473135123006916 eV
minimum distance =  2.28501109495552 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 0.9551771267247214
Energy: 1.1182184756063056
Energy: 1.0933605631630061
Energy: 1.1182184756063056
Energy: 0.9923908191124383
Energy: 1.1484838971837006
Energy: 1.015063662505973
Energy: 1.1484838971837006
Energy: 0.9456324741735269
Energy: 1.1773052628706862
Energy: 0.931448592204462
Energy: 1.1773052628706862
Energy: 0.9247114239326498
Energy: 0.9585415877054031
Energy: 0.9347239093969938
Energy: 0.9585415877094396
Energy: 0.9355265453925726
Energy: 1.1634377921505785
Energy: 1.0721939534841123
Energy: 1.1634377921505785
Energy: 1.0419721327164455
Energy: 1.1815585457615971
Energy: 1.0853893183988572
Energy: 1.1815585457615971
Energy: 0.9793005488393712
Energy: 1.1991671565889424
Energy: 0.9795500808776532
Energy: 1.1991671565899515
Energy: 1.1376675819937585
Energy: 1.1234302498970283
Energy: 0.8994631707450659
Energy: 1.1234302498960194
Energy: 0.9796572728263748
Energy: 1.1114541706682637
Energy: 0.9786752980705548
Energy: 1.1114541706682637
Energy: 0.9332413459230204
Energy: 1.1820999945641886
Energy: 0.9151895015385887
Energy: 1.1820999945631796
Energy: 0.969833869574928
Energy: 1.1167883211841116
Energy: 0.9904441199922419
Energy: 1.1167883211841116
Energy: 0.9570537303912582
Energy: 1.153732187321411
Energy: 1.104608168699674
Energy: 1.153732187321411
Energy: 0.9315152275254275
Energy: 1.0515496509059092
Energy: 0.9281681490291233
Energy: 1.0515496509059092
Energy: 0.9806440833185898
Energy: 1.0211334227345943
Energy: 0.9794569655896851
Energy: 1.0211334227335849
Energy: 0.9713516533877463
Energy: 1.1651862576440224
Energy: 0.898399669769425
Energy: 1.1651862576440224
Energy: 1.0351033267887655
Energy: 0.9759239405702078
Energy: 0.9676724287265135
Energy: 0.9759239405712171
Energy: 0.8853963985892366
Energy: 1.1833130418579794
Energy: 0.8831923869889332
Energy: 1.1833130418569704
Energy: 0.9352784146908104
Energy: 1.1733767805701854
Energy: 0.9707181379291834
Energy: 1.1733767805701854
Energy: 0.9240482320049195
Energy: 0.9585113821971689
Energy: 0.9354515508219629
Energy: 0.9585113821951505
Energy: 0.9793131424089131
Energy: 1.178694590903331
Energy: 0.9566766533055754
Energy: 1.1786945909023219
Energy: 0.9601792355517619
Energy: 1.0892711875802037
Energy: 0.9569129608260494
Energy: 1.0892711875812127
Energy: 0.9572413511527333
Energy: 1.1283660245832048
Energy: 1.0417727322553463
Energy: 1.1283660245832048
Energy: 0.9906144271942159
Energy: 1.114579071302579
Energy: 1.0110660328027608
Energy: 1.114579071302579
Energy: 1.154161334605279
Energy: 1.1815012581557196
Energy: 0.9332898261362875
Energy: 1.1815012581557196
Energy: 1.1653510532886766
Energy: 0.9591072478420255
Energy: 0.9625924854299867
Energy: 0.9591072478400073

minimum gb energy = 0.8831923869889332 eV
minimum distance =  2.28572621457954 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 1.0008576517418333
Energy: 1.1890381272843589
Energy: 1.2313807640203311
Energy: 1.1890381272843589
Energy: 1.027006002123765
Energy: 1.1067078509930819
Energy: 1.0733143315002782
Energy: 1.1067078502494252
Energy: 0.9916604978280367
Energy: 1.0507853934418434
Energy: 0.9886682173208496
Energy: 1.0507853934406395
Energy: 1.2173585882924969
Energy: 1.0244720538239755
Energy: 0.9793036604339034
Energy: 1.024472053827587
Energy: 1.132735217391662
Energy: 1.1073995164326589
Energy: 1.1687921192376005
Energy: 1.1073995164326589
Energy: 0.9138856477701778
Energy: 1.0513152089381255
Energy: 1.26817360409537
Energy: 1.0513152089393294
Energy: 1.131148113702599
Energy: 0.9490314046131351
Energy: 1.0148055769282665
Energy: 0.949031404614339
Energy: 1.0685994375141685
Energy: 1.0603682776985903
Energy: 0.9382238208830903
Energy: 1.0603682776985903
Energy: 1.07956283463423
Energy: 1.1067922036628257
Energy: 1.0340713177019552
Energy: 1.1067002142985671
Energy: 1.0013249645131563
Energy: 1.0487766744465943
Energy: 1.0134554204586177
Energy: 1.0487766744465943
Energy: 0.9722411117940776
Energy: 1.1142268608064543
Energy: 0.9967057606851876
Energy: 1.114226860807658
Energy: 1.078988719454785
Energy: 1.226847926376441
Energy: 0.9803293265469024
Energy: 1.226847926376441
Energy: 0.9124786784844067
Energy: 1.2622242215857318
Energy: 0.9978996773508624
Energy: 1.2622242215869357
Energy: 1.04414208435387
Energy: 1.036372394042305
Energy: 1.11569912737528
Energy: 1.0363723940411012
Energy: 0.9124893150625619
Energy: 1.262168314192025
Energy: 1.068796166664062
Energy: 1.262168314190821
Energy: 1.0789678682634876
Energy: 1.22833063384109
Energy: 0.9806869873577502
Energy: 1.2283306338398863
Energy: 0.9723917721761557
Energy: 1.1143926378588989
Energy: 0.9894089491436749
Energy: 1.114392637857695
Energy: 1.0012823381035418
Energy: 1.0487609502572777
Energy: 1.0131115088575455
Energy: 1.0487609502584818
Energy: 1.0794782776026306
Energy: 1.1065063909107171
Energy: 1.0619478334433619
Energy: 1.106506390914329
Energy: 1.0685740903443972
Energy: 1.06040279221115
Energy: 0.9383101405760146
Energy: 1.0604027914638818
Energy: 1.1311545593751657
Energy: 0.9488349666148632
Energy: 1.0148067686264552
Energy: 0.9488349666148632

minimum gb energy = 0.9124786784844067 eV
minimum distance =  2.38014372489738 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 0.9650914360305771
Energy: 1.1597843456677424
Energy: 1.1803080969108173
Energy: 1.1597843456677424
Energy: 0.9466892389967319
Energy: 1.1731599421958259
Energy: 0.9324981969388406
Energy: 1.1731599421943373
Energy: 1.0638794339838131
Energy: 1.295766782409859
Energy: 0.9329575648731996
Energy: 1.295766782409859
Energy: 1.394062973095436
Energy: 1.186130074424369
Energy: 1.1333015415980703
Energy: 1.186130074424369
Energy: 1.1332912634659993
Energy: 1.0624998504383356
Energy: 1.0156634724128148
Energy: 1.0624998504383356
Energy: 0.9323302372814841
Energy: 1.2350786399450953
Energy: 1.3590693500902098
Energy: 1.2350786399465838
Energy: 1.1470248623479165
Energy: 1.1470567877132791
Energy: 1.0634183774015142
Energy: 1.1470567877117903
Energy: 1.2535770933273462
Energy: 1.2073523092541145
Energy: 1.0179245297647104
Energy: 1.2073523092541145
Energy: 0.9329534438608397
Energy: 1.0607592450570953
Energy: 1.0014426250564286
Energy: 1.0607592450570953
Energy: 1.2083716180207482
Energy: 1.2601849036322577
Energy: 1.0627589231552186
Energy: 1.2601849036322577
Energy: 1.0127308793135357
Energy: 1.2635199832073754
Energy: 1.321001312673437
Energy: 1.2635199832073754
Energy: 1.0626249108330161
Energy: 1.02302144782124
Energy: 1.1577275017723632
Energy: 1.02302144782124
Energy: 1.1271292415523084
Energy: 1.2353354993418275
Energy: 0.9317218126106874
Energy: 1.2353354993418275
Energy: 1.063560814852709
Energy: 1.131021769710727
Energy: 1.0939341998869991
Energy: 1.1310217697062608
Energy: 1.017006035963587
Energy: 1.1317136070024858
Energy: 1.2543391702312878
Energy: 1.1317136070024858
Energy: 1.000750583774286
Energy: 1.2816889078735718
Energy: 0.9357018439908731
Energy: 1.2816889078735718
Energy: 1.063363209923193
Energy: 1.0267861934672744
Energy: 1.2068272501162103
Energy: 1.0267861934672744

minimum gb energy = 0.9317218126106874 eV
minimum distance =  2.36426573010748 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 1.0438421314523496
Energy: 1.307714539464976
Energy: 1.3534405809113255
Energy: 1.3077145394658192
Energy: 1.1256285393224688
Energy: 1.0841529083001011
Energy: 0.9542537802541825
Energy: 1.0841529083001011
Energy: 1.2529465987887547
Energy: 1.2503956503326175
Energy: 0.954272150559854
Energy: 1.2503956503326175
Energy: 1.0433758373137103
Energy: 1.2581108449115597
Energy: 1.136654704677027
Energy: 1.2581108449107163
Energy: 1.1835208233369192
Energy: 1.1105302528918959
Energy: 1.1883105105261735
Energy: 1.1105302528927394
Energy: 0.9650051963252282
Energy: 1.0579440063876107
Energy: 1.4057460386246428
Energy: 1.057944006380022
Energy: 1.0610195351378255
Energy: 1.0655175959517256
Energy: 1.0924071578271468
Energy: 1.0655175959517256
Energy: 1.2579470092811047
Energy: 1.0594976633237836
Energy: 0.9646119849453646
Energy: 1.0594976633229405
Energy: 1.0414652293812015
Energy: 1.237552794516001
Energy: 1.2155420500592788
Energy: 1.2375527945151579
Energy: 1.296930305548286
Energy: 1.1740846410804626
Energy: 1.0466399869719312
Energy: 1.1740846410796195
Energy: 0.9542748011380568
Energy: 1.1017176285687893
Energy: 1.4023420088528369
Energy: 1.1017176285687893
Energy: 1.0719460508041598
Energy: 1.0650526091484152
Energy: 1.110642130151885
Energy: 1.0650526091484152
Energy: 1.3727937671385269
Energy: 1.0441257501249184
Energy: 1.0493865528180968
Energy: 1.0441257501687642
Energy: 0.9545544325678719
Energy: 1.162337305664178
Energy: 1.1662660862159742
Energy: 1.1623373056464714
Energy: 1.1126143997890714
Energy: 1.0655678288494213
Energy: 1.0812990060369756
Energy: 1.0655678288485781
Energy: 1.1621316431244273
Energy: 1.2540585840335
Energy: 1.164232027911839
Energy: 1.2540585840335
Energy: 1.059657262196893
Energy: 1.1511701870122972
Energy: 1.25609599245981
Energy: 1.1511701870106108
Energy: 1.370364432238918
Energy: 1.2887202630466352
Energy: 0.9649701385490134
Energy: 1.2887202630466352
Energy: 0.9985709584136072
Energy: 1.180507664138994
Energy: 1.0253172067835445
Energy: 1.180507664153328
Energy: 1.0718287323864732
Energy: 1.0584597648791754
Energy: 1.0698407142448072
Energy: 1.058459764882548
Energy: 1.0585793949193791
Energy: 1.094316573909736
Energy: 1.162016875053994
Energy: 1.094316573908088
Energy: 1.0345248013873598
Energy: 1.1092863371940087
Energy: 1.295553877632623
Energy: 1.1092863371940087
Energy: 1.1724177529947217
Energy: 1.2344116599492239
Energy: 0.9517467541646187
Energy: 1.2344116599492239
Energy: 1.0556504216197091
Energy: 1.1828958445548192
Energy: 1.2163884153904991
Energy: 1.1828958445548192
Energy: 1.043625772539825
Energy: 1.3234915312582536
Energy: 1.2181452913972763
Energy: 1.3234915312574105
Energy: 1.2832240217373332
Energy: 1.1023793248085956
Energy: 0.9531313892481251
Energy: 1.1023793248069094
Energy: 1.0162434069839228
Energy: 1.2566664668610132
Energy: 1.3137523088442289
Energy: 1.2566664668610132
Energy: 1.1629920940264595
Energy: 1.058903108363839
Energy: 1.1631791525989938
Energy: 1.0589031083402298
Energy: 1.2558684516492147
Energy: 1.1957614056241588
Energy: 1.0608380974775309
Energy: 1.195761405625002
Energy: 0.9647062730555938
Energy: 1.1834686295279657
Energy: 1.2223059526954796
Energy: 1.1834686295288088

minimum gb energy = 0.9517467541646187 eV
minimum distance =  2.27249065181482 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 0.8986056643609762
Energy: 0.898463517716473
Energy: 1.418540940113567
Energy: 0.898463517716473
Energy: 1.1825751686523793
Energy: 1.202017122355339
Energy: 1.048426113511378
Energy: 1.202017122355339
Energy: 0.9173094563094177
Energy: 0.9186236355629165
Energy: 1.1652720796937437
Energy: 0.9186236355629165
Energy: 0.9173924200283872
Energy: 0.918461925644727
Energy: 1.0586485738611502
Energy: 0.9184619256427857
Energy: 1.1825404151731442
Energy: 1.201962973318335
Energy: 0.9310206125796736
Energy: 1.201962973316394
Energy: 0.8986056643609762
Energy: 0.898463517716473
Energy: 1.3732559246680789
Energy: 0.898463517716473
Energy: 1.1825751686523793
Energy: 1.202017122355339
Energy: 1.1507252155972987
Energy: 1.202017122355339
Energy: 0.9173094563094177
Energy: 0.9186236355629165
Energy: 1.1652720796937437
Energy: 0.9186236355629165
Energy: 0.9173924200303283
Energy: 0.9184619256486093
Energy: 1.072661666220751
Energy: 0.9184619256486093
Energy: 1.1825404151731442
Energy: 1.201962973318335
Energy: 1.0501171330291792
Energy: 1.201962973316394
Energy: 0.8986056643609762
Energy: 0.898463517716473
Energy: 1.4538261382292614
Energy: 0.898463517716473
Energy: 1.1825751686523793
Energy: 1.202017122355339
Energy: 1.1507252155972987
Energy: 1.202017122355339
Energy: 0.9173094563094177
Energy: 0.9186236355629165
Energy: 1.1652720796937437
Energy: 0.9186236355629165

minimum gb energy = 0.898463517716473 eV
minimum distance =  2.34277481241935 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 0.9906241974317918
Energy: 1.3351551417181466
Energy: 1.3886026834777536
Energy: 1.3351551417181466
Energy: 1.3219060161938097
Energy: 1.103209496144785
Energy: 1.0711805555439469
Energy: 1.103209496144785
Energy: 1.207451532721164
Energy: 1.198030962031471
Energy: 1.0117944510273473
Energy: 1.1980309620307528
Energy: 1.4272962239125058
Energy: 1.2797447122022163
Energy: 1.0955922123821054
Energy: 1.279744712202935
Energy: 1.357536107272527
Energy: 1.037743866281475
Energy: 1.073922139221408
Energy: 1.037743866281475
Energy: 0.9794424103207999
Energy: 0.9793742820917468
Energy: 1.4737849374863585
Energy: 0.9793742820917468
Energy: 1.4849606190608624
Energy: 1.392843830142516
Energy: 1.0568723726431204
Energy: 1.392843830142516
Energy: 1.2084801755884296
Energy: 1.316939415132164
Energy: 1.2563766314696845
Energy: 1.3169394151307274
Energy: 1.2142539224820865
Energy: 1.364805130257424
Energy: 0.9880639160043555
Energy: 1.364805130257424
Energy: 1.0602679507465942
Energy: 1.082060256122916
Energy: 1.0437492145404312
Energy: 1.082060256122916
Energy: 1.1157449797143646
Energy: 1.3543920465951478
Energy: 1.441657038267639
Energy: 1.354392046595866
Energy: 1.317368044265767
Energy: 1.3291820760614301
Energy: 1.0226602141882517
Energy: 1.3291820760614301
Energy: 1.0735071261418
Energy: 1.08541105928035
Energy: 1.3491770546868314
Energy: 1.0854110594462156
Energy: 1.4267617520637206
Energy: 1.3034867781417188
Energy: 0.9940059361235556
Energy: 1.3034867781410004
Energy: 1.0591993475843102
Energy: 1.2291747194544624
Energy: 1.2325834491258518
Energy: 1.229174719453744
Energy: 1.0411775584705065
Energy: 1.2882877234928616
Energy: 1.2486124347304681
Energy: 1.2882877234928616
Energy: 1.1464998379829936
Energy: 1.2305086376758703
Energy: 1.0593398217044414
Energy: 1.2305086376751515
Energy: 1.1038821578788436
Energy: 1.0345589503274253
Energy: 1.27195789605106
Energy: 1.034558950326707
Energy: 1.4697847296782154
Energy: 1.171883754289274
Energy: 0.9823341062263042
Energy: 1.171883754289274
Energy: 1.017920413840873
Energy: 1.1106155034769862
Energy: 1.2246537605842114
Energy: 1.1106155034755494
Energy: 1.2593442135601591
Energy: 1.368965726062547
Energy: 1.2576974753043295
Energy: 1.368965726062547
Energy: 1.1227067665871844
Energy: 1.156967065775118
Energy: 1.0573126643123827
Energy: 1.1569670657743998
Energy: 0.9882853440037702
Energy: 1.171398024643633
Energy: 1.1426818067998994
Energy: 1.171398024642915
Energy: 1.4375206373002827
Energy: 1.223411443900372
Energy: 1.113374237241698
Energy: 1.2234114439025274
Energy: 1.0562189636491637
Energy: 1.2945763412678182
Energy: 1.4031416029749884
Energy: 1.2945763412685365
Energy: 1.1897969687028322
Energy: 0.9795966542727991
Energy: 1.110697570622349
Energy: 0.9795966542720805
Energy: 1.13396250052002
Energy: 1.2322327287389054
Energy: 1.2729667258128476
Energy: 1.232232728738187
Energy: 0.9957674586177705
Energy: 1.263723687093183
Energy: 1.2760923591623843
Energy: 1.2637236870939015
Energy: 1.1292045367514583
Energy: 0.9796077306602643
Energy: 1.1093200087497186
Energy: 0.9796077306602643
Energy: 1.023050300583861
Energy: 1.3980738741875665
Energy: 1.421165259922771
Energy: 1.3980738741882848
Energy: 1.3588451152505894
Energy: 1.3525440997645406
Energy: 1.1125341814074288
Energy: 1.3525440997645406
Energy: 0.9788874818068144
Energy: 1.0363565411882631
Energy: 1.1421615126273608
Energy: 1.0363565411868263
Energy: 0.9803097236249592
Energy: 1.1563307003627403
Energy: 1.2063685649520397
Energy: 1.1563307003634586
Energy: 1.2615763223482084
Energy: 1.2889886010028933
Energy: 1.2556147787010916
Energy: 1.2889886010036116
Energy: 1.050410656750122
Energy: 1.2151762541608813
Energy: 1.4890645810167233
Energy: 1.2151762541601627

minimum gb energy = 0.9788874818068144 eV
minimum distance =  2.29894686849924 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 1.0532099658949419
Energy: 1.052060078021162
Energy: 1.4846996375012131
Energy: 1.0520600780986227
Energy: 1.2549524886502657
Energy: 1.20295151463047
Energy: 1.0530774662571956
Energy: 1.20295151463047
Energy: 1.0997010215439424
Energy: 1.0572389624356406
Energy: 1.0049598754099287
Energy: 1.0572389624356406
Energy: 1.2513352164846798
Energy: 1.1449463966733664
Energy: 1.1667424993625692
Energy: 1.1449463966733664
Energy: 1.1321935116391737
Energy: 1.1245946813923693
Energy: 0.9906134073419516
Energy: 1.1245946813923693
Energy: 1.1557248102431936
Energy: 1.0082554515439093
Energy: 1.4093615443272276
Energy: 1.0082554515439093
Energy: 1.4941397579188445
Energy: 1.2684176362855895
Energy: 1.101388555769688
Energy: 1.2684176362855895
Energy: 1.0849855939666118
Energy: 1.2019665704266258
Energy: 1.3375462832246143
Energy: 1.2019665704266258
Energy: 1.42008901267316
Energy: 0.9802245641118167
Energy: 0.9805448663088429
Energy: 0.9802245641106768
Energy: 1.0584445461694265
Energy: 1.1657023971887244
Energy: 0.9807548398343979
Energy: 1.1657023971887244
Energy: 1.079495445502989
Energy: 1.0568882769062946
Energy: 1.3780842734828764
Energy: 1.0568882769051546
Energy: 1.2789899911964353
Energy: 1.1710964548637035
Energy: 1.069704708138623
Energy: 1.1710964548648435
Energy: 1.1173272281105573
Energy: 1.1885442918752593
Energy: 1.2854975185497102
Energy: 1.1885442918741194
Energy: 1.3794205217793267
Energy: 1.1708756828474045
Energy: 1.140828580419775
Energy: 1.1708756828474045
Energy: 0.9907110849281179
Energy: 1.2619781646917405
Energy: 1.3846721051794753
Energy: 1.2619781646917405
Energy: 1.333576484359629
Energy: 1.1904584872066077
Energy: 1.05252243517314
Energy: 1.1904584872066077
Energy: 1.0526767278179983
Energy: 1.1163176418694047
Energy: 1.0997804671853477
Energy: 1.116317641868265
Energy: 1.0518324075422372
Energy: 1.0521630243071112
Energy: 1.1051115402689264
Energy: 1.0521630242456086
Energy: 1.041083499446371
Energy: 0.9796326582394093
Energy: 1.143364479790701
Energy: 0.9796326582394093
Energy: 1.0604845220199126
Energy: 1.3766969702944885
Energy: 1.4553399648650742
Energy: 1.3766969702944885
Energy: 1.3829725119899157
Energy: 1.1423398017885364
Energy: 1.1548801149513914
Energy: 1.1423398017896762
Energy: 1.1252269115297764
Energy: 1.1131798068442675
Energy: 1.416478284669995
Energy: 1.1131798068442675

minimum gb energy = 0.9796326582394093 eV
minimum distance =  2.30985283083257 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 1.0003676968634323
Energy: 0.9998918159864977
Energy: 1.4929346804871915
Energy: 0.9998918159848856
Energy: 1.4817849078490575
Energy: 1.1204193057960758
Energy: 1.112902396303339
Energy: 1.1204193057944638
Energy: 1.1069775110201183
Energy: 1.164224422918262
Energy: 1.0658813395023756
Energy: 1.1642244229174559
Energy: 1.137456239899768
Energy: 1.0690199208696136
Energy: 1.1191601995792928
Energy: 1.0690199208680013
Energy: 1.062970149549854
Energy: 1.1014305481540754
Energy: 1.0119555646789122
Energy: 1.1014305481540754
Energy: 1.116318411066846
Energy: 1.1049789191473005
Energy: 1.3688246131583037
Energy: 1.1049789191473005
Energy: 1.2418360897781628
Energy: 1.3421523619583748
Energy: 1.1405965729834553
Energy: 1.3421523619527327
Energy: 1.1159666934151582
Energy: 1.0009690277558574
Energy: 1.5124127763314446
Energy: 1.0009690277502152
Energy: 1.2852016511608975
Energy: 1.0612078885035234
Energy: 1.1164357503128686
Energy: 1.0612078885043295
Energy: 1.0669296277871552
Energy: 1.1804455402593381
Energy: 1.2881613550985656
Energy: 1.1804455402609502
Energy: 1.1382148687421703
Energy: 1.164645669205271
Energy: 1.1184655820124658
Energy: 1.1646456692020468
Energy: 1.0021311185639132
Energy: 1.1015269583910041
Energy: 1.1174742758439558
Energy: 1.101526958389392
Energy: 1.0108438463555982
Energy: 1.00028010847986
Energy: 1.2586714567844108
Energy: 1.000280108480666
Energy: 1.1387578572744985
Energy: 0.9962812976024542
Energy: 1.219617971565704
Energy: 0.9962812976008423
Energy: 1.0649733750891748
Energy: 1.3136945691758275
Energy: 1.4089472075043425
Energy: 1.3136945691758275
Energy: 1.4704109276840434
Energy: 0.9956028328177953
Energy: 1.1432302313218201
Energy: 0.9956028328186013
Energy: 1.0733636252159617
Energy: 1.1013770832884968
Energy: 1.263831456468657
Energy: 1.1013770832884968
Energy: 1.025335245729653
Energy: 1.0697568852370047
Energy: 1.1168263873477184
Energy: 1.0697568852386168
Energy: 1.0740385577821605
Energy: 1.1029228344903608
Energy: 1.035905787466311
Energy: 1.1029228344919728
Energy: 1.0749790769993628
Energy: 1.0876572008746745
Energy: 1.1236080332376126
Energy: 1.0876572008738685
Energy: 1.1355104945014123
Energy: 1.2082597693307962
Energy: 1.1165482578071195
Energy: 1.2082597693316022
Energy: 1.106036132685697
Energy: 1.261625616137968
Energy: 1.3307697990520782
Energy: 1.261625616137968
Energy: 1.438830099649745
Energy: 1.1161828469775665
Energy: 1.160641582198353
Energy: 1.1161828469783726
Energy: 1.0049167133728933
Energy: 1.00105146355574
Energy: 1.5308097143493156
Energy: 1.00105146355574
Energy: 1.206450525410975
Energy: 1.1306892668156951
Energy: 1.055877865258623
Energy: 1.1306892668140833
Energy: 1.1715575800549427
Energy: 1.1622490477313472
Energy: 1.138411149267539
Energy: 1.1622490477297351
Energy: 1.0612576811225662
Energy: 1.1270095311751172
Energy: 1.093543225703055
Energy: 1.1270095311751172
Energy: 1.2525442713929436
Energy: 1.1009665482226592
Energy: 1.1190447138785984
Energy: 1.1009665482210471
Energy: 1.0933793947695936
Energy: 1.0009836711204523
Energy: 1.312711769011381
Energy: 1.0009836711204523
Energy: 1.3046942454254316
Energy: 1.2832108319793016
Energy: 1.1524247877158458
Energy: 1.2832108319793016
Energy: 1.0933233113690366
Energy: 1.0007207790843693
Energy: 1.356148858629964
Energy: 1.0007207790835633

minimum gb energy = 0.9956028328177953 eV
minimum distance =  2.29662786914504 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 0.9428604044007064
Energy: 0.9423457441266911
Energy: 1.295781909339156
Energy: 0.9423457441266911
Energy: 1.406121099290072
Energy: 1.1741727274609661
Energy: 0.9407681876854318
Energy: 1.1741727274606855
Energy: 1.0231709411140104
Energy: 1.1268626876088814
Energy: 1.1602111180242283
Energy: 1.1268626876088814
Energy: 0.9410298115953895
Energy: 0.9130178051830713
Energy: 1.1734668102099746
Energy: 0.9130178051844439
Energy: 0.9434775694793864
Energy: 0.9137038627997767
Energy: 1.1615650119432421
Energy: 0.9137038628025219
Energy: 1.1715278224978722
Energy: 0.9923157108187575
Energy: 1.1714980399509087
Energy: 0.9923157108190382
Energy: 0.9126445190327258
Energy: 0.91297651038456
Energy: 0.9434578364355539
Energy: 0.9129765103878356
Energy: 1.1748750443454794
Energy: 0.91331772838888
Energy: 0.9407974523249913
Energy: 0.9133177283885994
Energy: 1.1600505049504581
Energy: 1.1268636901705433
Energy: 1.110662816836583
Energy: 1.1268636901705433

minimum gb energy = 0.9126445190327258 eV
minimum distance =  2.33641862531247 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 0.9386435862310716
Energy: 0.9453839185537934
Energy: 1.3587715490713108
Energy: 0.9453839185560775
Energy: 1.1313184652624124
Energy: 1.230468467922686
Energy: 0.9552236112036095
Energy: 1.2304684679310613
Energy: 0.9239523063393373
Energy: 1.0356547376489191
Energy: 1.1722354239057642
Energy: 1.0356547376565328
Energy: 0.9941573524207892
Energy: 0.992203956675061
Energy: 0.9265703388979866
Energy: 0.992203956675061
Energy: 0.936716094192936
Energy: 0.9974408766162236
Energy: 1.1425346984345193
Energy: 0.9974408766162236
Energy: 1.0931028096833133
Energy: 1.039356111268833
Energy: 0.9243479113035786
Energy: 1.039356111268833
Energy: 0.9209310246301767
Energy: 0.9952976425320245
Energy: 0.917169973024002
Energy: 0.9952976425320245
Energy: 0.9203154927479952
Energy: 0.9467270294895034
Energy: 0.9376202273574693
Energy: 0.9467270294902301
Energy: 0.9236221032468107
Energy: 0.9955927977286634
Energy: 0.9673883617186676
Energy: 0.9955927977294248
Energy: 0.9233248612634511
Energy: 0.9953909665814945
Energy: 0.9241837426807348
Energy: 0.9953909665814945
Energy: 0.9660076349552144
Energy: 1.1725567402641142
Energy: 0.9259764782171522
Energy: 1.1725567402633528
Energy: 0.9573244010401586
Energy: 0.9346316700167978
Energy: 0.944680964056217
Energy: 0.934631670019082
Energy: 1.0691929714057427
Energy: 0.9454900481865793
Energy: 0.9479855320599825
Energy: 0.9454900481873407
Energy: 0.9357451379022631
Energy: 1.2449296094012385
Energy: 1.2502522908351905
Energy: 1.2449296094012385
Energy: 1.491062673115573
Energy: 1.1825181511390865
Energy: 0.9253966603985664
Energy: 1.1825181511390865
Energy: 0.9251123809450735
Energy: 0.9417554808634405
Energy: 1.2138450433524473
Energy: 0.9417554808626791
Energy: 1.1380101851737927
Energy: 0.9348781093908382
Energy: 0.9368434215880745
Energy: 0.9348781093893154
Energy: 0.9276603503842231
Energy: 1.04026984833291
Energy: 1.3153852919421263
Energy: 1.04026984833291
Energy: 0.9223673869236246
Energy: 0.9960194772800692
Energy: 0.9254904460526138
Energy: 0.9960194772793078
Energy: 0.9344787355519495
Energy: 1.1311521952306454
Energy: 0.9325780663249524
Energy: 1.1311521952314065
Energy: 0.9423047629506358
Energy: 0.9912828304609426
Energy: 0.928697267003992
Energy: 0.9912828304609426
Energy: 0.9601175853179301
Energy: 0.9957997894108488
Energy: 0.9234693307688635
Energy: 0.9957997894108488
Energy: 0.9278899786915158
Energy: 1.1711809793843224
Energy: 0.9685353492297923
Energy: 1.1711809793843224
Energy: 0.9456035899501206
Energy: 0.9501398214234469
Energy: 0.9572270037387938
Energy: 0.9501398214226855
Energy: 0.9517380500325188
Energy: 0.9400310136933329
Energy: 0.9565996469813203
Energy: 0.9400310136948556
Energy: 0.9648015868971236
Energy: 0.9460763975713479
Energy: 0.9388167310265748
Energy: 0.9460763975728707
Energy: 0.9281668112935688
Energy: 0.9185193393958087
Energy: 1.0734193038889437
Energy: 0.9185193393950472
Energy: 1.2261673755244418
Energy: 1.145121275025288
Energy: 0.9250279660325315
Energy: 1.1451212750268105
Energy: 0.9313159665846606
Energy: 1.0773950297193642
Energy: 1.2557656719923531
Energy: 1.0773950297954682
Energy: 1.3130884598187602
Energy: 1.0410886315404988
Energy: 0.9276232770476365
Energy: 1.0410886315412604
Energy: 0.9226365465102347
Energy: 0.9318008421976121
Energy: 1.3050431090836934
Energy: 0.9318008421968508
Energy: 1.1347927492852907
Energy: 1.003546087191711
Energy: 0.9316387209923264
Energy: 1.003546087191711
Energy: 0.9266592990211077
Energy: 1.1429270263064535
Energy: 1.0118003073507849
Energy: 1.1429270263072147

minimum gb energy = 0.917169973024002 eV
minimum distance =  2.27608302818568 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 1.0068155965833259
Energy: 1.0803714168285463
Energy: 1.2856005952237626
Energy: 1.0803714168285463
Energy: 1.2676221627602569
Energy: 0.8778088096695175
Energy: 0.8972864975239283
Energy: 0.8778088096695175
Energy: 0.889960111342974
Energy: 0.9073785441607242
Energy: 1.077649110463572
Energy: 0.9073785441607242
Energy: 0.9041185127716865
Energy: 0.9729839972810491
Energy: 0.8976829338293522
Energy: 0.9729839972810491
Energy: 0.8963087496709065
Energy: 0.9036493940242349
Energy: 1.1568721519608696
Energy: 0.9036493940242349
Energy: 0.8953764457512734
Energy: 1.0993317173877941
Energy: 0.8976952881824284
Energy: 1.0993317173867414
Energy: 0.8900173793662387
Energy: 1.0010261844023296
Energy: 0.9029152033286242
Energy: 1.0010261844023296
Energy: 0.890271196939316
Energy: 0.9094175878680024
Energy: 0.9375448590000893
Energy: 0.9094175878680024
Energy: 0.9063904334011553
Energy: 0.9123387376445773
Energy: 0.9530214984881632
Energy: 0.91233873764563
Energy: 0.9064069180116847
Energy: 1.1311903769858709
Energy: 0.9259827056985465
Energy: 1.1311903769858709
Energy: 0.8906355194838139
Energy: 0.9088310878068413
Energy: 0.9155553267025082
Energy: 0.9088310878068413
Energy: 0.8901308700303332
Energy: 1.1028674621293781
Energy: 1.0563739421239573
Energy: 1.1028674621293781
Energy: 0.8955202821195738
Energy: 1.1772200105114192
Energy: 0.8995250013884991
Energy: 1.1772200105135247
Energy: 0.8961669586332554
Energy: 0.9096030005186161
Energy: 1.2132815705586928
Energy: 0.9096030005186161
Energy: 0.9585452238657262
Energy: 0.9706435811396064
Energy: 0.8995405452697635
Energy: 0.9706435811396064
Energy: 0.8896903668408868
Energy: 0.9069281257287743
Energy: 1.181939152497762
Energy: 0.9069281257287743
Energy: 1.0630447258541504
Energy: 1.2958562986684838
Energy: 0.894028639810649
Energy: 1.2958562986695126
Energy: 1.0068155965843786
Energy: 1.0803714168274934
Energy: 1.285541740706787
Energy: 1.0803714168285463
Energy: 1.2676221627592041
Energy: 0.8778088096695175
Energy: 0.8972864975239283
Energy: 0.8778088096705703
Energy: 0.889960111342974
Energy: 0.9073785441607242
Energy: 1.077649110463572
Energy: 0.9073785441596715
Energy: 0.9041185127737921
Energy: 0.9729839972810491
Energy: 0.8976829338293522
Energy: 0.9729839972810491
Energy: 0.8963087496709065
Energy: 0.9036493940242349
Energy: 1.1568721519608696
Energy: 0.9036493940242349
Energy: 0.8953764457523261
Energy: 1.0993317173877941
Energy: 0.8976952881824284
Energy: 1.0993317173877941
Energy: 0.8900173793662387
Energy: 1.0010261844033823
Energy: 0.902915203329677
Energy: 1.0010261844023296

minimum gb energy = 0.8778088096695175 eV
minimum distance =  2.30023714641931 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 0.9013704693129748
Energy: 0.901265583868935
Energy: 1.2288346095485638
Energy: 0.901265583868935
Energy: 1.078525591687877
Energy: 0.8937562733649923
Energy: 0.8840412424346866
Energy: 0.893756273365643
Energy: 0.8815680878585259
Energy: 0.979695908205634
Energy: 1.110655243798038
Energy: 0.9796959082036819
Energy: 1.0103906947605061
Energy: 1.07777792350803
Energy: 0.8799293992269799
Energy: 1.07777792350803
Energy: 0.8825004502498643
Energy: 0.8988285468953184
Energy: 1.1931394087624183
Energy: 0.8988285468972703
Energy: 0.9444799489139575
Energy: 1.2440253893244024
Energy: 0.8883534577544384
Energy: 1.2440253893250532
Energy: 0.899553109448238
Energy: 1.0932277660716048
Energy: 0.8926277827837517
Energy: 1.0932277660716048
Energy: 0.8801171267045451
Energy: 1.1110804524929663
Energy: 0.8808878009178468
Energy: 1.1110804524936169
Energy: 0.9038295179216873
Energy: 1.1104380763657604
Energy: 0.9308374807813332
Energy: 1.110438076364459
Energy: 0.9052600678389103
Energy: 1.1123933590697197
Energy: 0.8903815565512456
Energy: 1.1123933590703705
Energy: 0.8862932968519369
Energy: 1.0972859029553141
Energy: 0.8887257829189829
Energy: 1.0972859029559647
Energy: 0.8872157940491525
Energy: 0.9424683215766263
Energy: 0.875533161620946
Energy: 0.9424683215759756
Energy: 0.8903002913408624
Energy: 1.105837031578866
Energy: 0.8826909425171972
Energy: 1.1058370315795165
Energy: 0.8992717810573674
Energy: 1.105051706917965
Energy: 0.9014044455364452
Energy: 1.1050517069186157
Energy: 0.8963479390781478
Energy: 1.1152931495356224
Energy: 0.9088960404426324
Energy: 1.1152931495349716
Energy: 0.886967233654908
Energy: 0.8953138273715099
Energy: 1.189574931001017
Energy: 0.8953138273708592
Energy: 0.8835517284584202
Energy: 1.081692977736895
Energy: 0.8847551059018154
Energy: 1.081692977736895
Energy: 0.8766534080510543
Energy: 0.9873089500594917
Energy: 1.0822579000317518
Energy: 0.9873089500581904
Energy: 1.4302437881821475
Energy: 1.0084586952934624
Energy: 0.8839283097331102
Energy: 1.0084586952908596
Energy: 0.8853612664272288
Energy: 0.8926266694711644
Energy: 1.0948934538219584
Energy: 0.8926266694705137
Energy: 1.366465304877129
Energy: 0.8881777798839062
Energy: 0.8975320067368392
Energy: 0.8881777798800614
Energy: 0.8971548959287062
Energy: 0.9895920560454426
Energy: 1.2421654037575318
Energy: 0.9895920560454426
Energy: 0.9897651305508299
Energy: 1.0867655620695427
Energy: 0.8864596398864966
Energy: 1.086765562068892
Energy: 0.8840367059791242
Energy: 0.8874404028943812
Energy: 1.1353549929218094
Energy: 0.8874404028943812
Energy: 0.9483267653206506
Energy: 0.9872671737783879
Energy: 0.8783169076134307
Energy: 0.9872671737790386
Energy: 0.8850987762571015
Energy: 0.9600056387580052
Energy: 0.8831003699130411
Energy: 0.9600056387573545
Energy: 1.0745832877819055
Energy: 1.1095599292665932
Energy: 0.8883338207463831
Energy: 1.1095599292659426
Energy: 0.9127766645226375
Energy: 1.1155177064945745
Energy: 0.8964841533578206
Energy: 1.115517706495225
Energy: 0.9011732764023106
Energy: 1.1051140434658258
Energy: 0.9012747030555833
Energy: 1.1051140434658258
Energy: 0.8845405659244484
Energy: 1.1056852742089174
Energy: 0.9059850250412314
Energy: 1.1056852742089174
Energy: 0.8751471252796114
Energy: 0.9568869406878229
Energy: 0.8762968539501046
Energy: 0.9568869406878229
Energy: 0.8859129576123399
Energy: 1.0965812127605266
Energy: 0.8835642696665084
Energy: 1.0965812127598762
Energy: 0.8882258835300468
Energy: 1.113593773718923
Energy: 1.086326153409303
Energy: 1.1135937737163202
Energy: 0.9328918694893826
Energy: 1.1276110858005448
Energy: 0.89103665641342
Energy: 1.1276110857985926
Energy: 0.8796987967096574
Energy: 0.9868426330010694
Energy: 0.9075281572124956
Energy: 0.9868426330004187
Energy: 0.8928106300675563
Energy: 1.0937430498241494
Energy: 0.9000790746510786
Energy: 1.0937430498248
Energy: 0.8866290840008667
Energy: 1.2384616050100405
Energy: 0.9447230050773795
Energy: 1.23846160500939
Energy: 1.1923420323295542
Energy: 0.8989282591782927
Energy: 0.8853876986787715
Energy: 0.8989282591795941

minimum gb energy = 0.8751471252796114 eV
minimum distance =  2.30399009801002 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 0.8002626185980644
Energy: 0.8004619070110521
Energy: 0.8608075322836558
Energy: 0.8004619070110521
Energy: 0.801651753136017
Energy: 0.822506771670839
Energy: 0.811986515827721
Energy: 0.822506771670839
Energy: 0.810246223679908
Energy: 1.2083310855359777
Energy: 1.4725315228136653
Energy: 1.2083310855359777
Energy: 0.8629741531423532
Energy: 0.8222024331878071
Energy: 0.8121256483350306
Energy: 0.8222024331878071
Energy: 0.8097662189122498
Energy: 1.1494508113850856
Energy: 1.1482736387702015
Energy: 1.1494508113850856
Energy: 0.8097613958982715
Energy: 0.8008210262230785
Energy: 0.8029105393493746
Energy: 0.8008210262230785
Energy: 0.8102788358560358
Energy: 0.9428888689174152
Energy: 0.8004885509478713
Energy: 0.9428888689174152
Energy: 0.8305149017314386
Energy: 1.2076312172845232
Energy: 0.8119870995137499
Energy: 1.2076312172845232
Energy: 0.811038721399857
Energy: 0.8861957936079468
Energy: 0.8031838106587486
Energy: 0.8861957936079468
Energy: 0.8216625987160362
Energy: 1.1492627026278344
Energy: 0.810467957237618
Energy: 1.1492627026278344
Energy: 0.7999300709232562
Energy: 0.8228394459973271
Energy: 0.809602075885315
Energy: 0.8228394459956245
Energy: 0.8001308286358868
Energy: 0.9439889128085195
Energy: 0.8120715126914524
Energy: 0.9439889128085195
Energy: 0.8111561379640857
Energy: 1.1509266304390176
Energy: 0.8305909052851159
Energy: 1.1509266304390176
Energy: 0.8111285356838795
Energy: 0.8835737578808173
Energy: 0.8097379811683465
Energy: 0.8835737578808173
Energy: 0.8033780731009871
Energy: 1.1508459926389165
Energy: 0.8110856978661413
Energy: 1.1508459926389165

minimum gb energy = 0.7999300709232562 eV
minimum distance =  2.29304049576402 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 0.7993591618070127
Energy: 1.0126861622795407
Energy: 1.2258139407766848
Energy: 1.0126861622774
Energy: 1.2656572579316154
Energy: 1.0248947047665435
Energy: 0.7741554319224467
Energy: 1.0248947047644028
Energy: 0.7783887051857246
Energy: 1.0348162375234875
Energy: 0.9705127787729184
Energy: 1.0348162375220604
Energy: 0.7743590279391354
Energy: 1.0244657500486578
Energy: 0.7720912100006063
Energy: 1.0244657500415217
Energy: 0.7852088735687697
Energy: 1.1980579239714342
Energy: 0.8200222005537575
Energy: 1.1980579239714342
Energy: 0.7743655180667868
Energy: 0.9095141571836532
Energy: 0.7834101327892139
Energy: 0.9095141571850804
Energy: 0.7829491288602042
Energy: 1.0195391630399346
Energy: 1.1141001576269551
Energy: 1.0195391630420754
Energy: 0.7759003492222697
Energy: 1.0457316036720468
Energy: 0.7836543132186775
Energy: 1.0457316036749011
Energy: 0.7829511293828052
Energy: 0.9564551582106168
Energy: 0.9850037363384088
Energy: 0.9564551582156119
Energy: 0.9509645682227902
Energy: 1.2460690368082867
Energy: 0.7719840800399982
Energy: 1.246069036807573
Energy: 0.784468487389405
Energy: 1.0149213056492943
Energy: 0.7734862481262786
Energy: 1.0149213056471535
Energy: 1.055770986924271
Energy: 1.2295811276681956
Energy: 0.7779047000589698
Energy: 1.2295811276667683
Energy: 0.8076369741021912
Energy: 0.7870292620880274
Energy: 0.7961883169678601
Energy: 0.7870292613654887
Energy: 1.0279240847672704
Energy: 0.9658743443467167
Energy: 0.7779377634722108
Energy: 0.9658743443438624
Energy: 0.7850760978316725
Energy: 0.9172923978053167
Energy: 0.7878840459715375
Energy: 0.9172923977126154
Energy: 0.7728601563128641
Energy: 0.9660476284228394
Energy: 0.7793324113580319
Energy: 0.9660476284192714
Energy: 0.7824103812556895
Energy: 1.1249472285234658
Energy: 0.7792163972621243
Energy: 1.1249472285234658
Energy: 0.8043277162746318
Energy: 0.8369595291597552
Energy: 0.7919652720543876
Energy: 0.8369595291590416
Energy: 0.7833321802648368
Energy: 1.0971583251125883
Energy: 0.7922531885578428
Energy: 1.0971583251147292
Energy: 0.7830455252106443
Energy: 1.096992020294251
Energy: 0.7926980832247521
Energy: 1.0969920202978185
Energy: 0.8044913660007641
Energy: 0.837168681430194
Energy: 0.7922232397770466
Energy: 0.8371686814294803
Energy: 0.7827005751922201
Energy: 1.124820369223455
Energy: 0.779209361268714
Energy: 1.1248203692241685
Energy: 0.7729316180920133
Energy: 0.9660949547366244
Energy: 0.7792455247708623
Energy: 0.9660949547366244
Energy: 0.7845644987461508
Energy: 0.9166821045553462
Energy: 0.7793560966941274
Energy: 0.9166821045639092
Energy: 1.0494118862144461
Energy: 0.9661062417513311
Energy: 0.7778519474626173
Energy: 0.9661062417527583
Energy: 0.8078948907432935
Energy: 0.7869294301981797
Energy: 0.7855136232159947
Energy: 0.7869294301981797
Energy: 1.0553583160768267
Energy: 1.2298054093367798
Energy: 0.7780313287653821
Energy: 1.2298054093389204
Energy: 0.7834629146552547
Energy: 1.0147726875106164
Energy: 0.7699340597824228
Energy: 1.0147726875120435
Energy: 0.9512792524798671
Energy: 1.246100576976781
Energy: 0.771932508234951
Energy: 1.246100576976781
Energy: 0.7860526497065801
Energy: 0.9564712321423454
Energy: 0.9001317899739228
Energy: 0.9564712321594715
Energy: 0.7755898398106968
Energy: 1.046118986337188
Energy: 0.7836199867221257
Energy: 1.046118986337188
Energy: 0.7826135676523013
Energy: 1.0189705957863044
Energy: 1.1360216929079834
Energy: 1.0189705957863044
Energy: 0.7745733550490435
Energy: 0.9091072669132096
Energy: 0.7836833890267902
Energy: 0.9091072669110689
Energy: 0.7847524987245302
Energy: 1.2348323446425797
Energy: 1.0508029751686838
Energy: 1.234832344640439
Energy: 0.7738922242617857
Energy: 1.025910987219992
Energy: 0.7720967572594063
Energy: 1.0259109872214194

minimum gb energy = 0.7699340597824228 eV
minimum distance =  2.28379505070103 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 0.841635346219261
Energy: 0.841686771574239
Energy: 0.7322569532141374
Energy: 0.8416867715754667
Energy: 1.2818661262229325
Energy: 0.925137471211077
Energy: 0.7166698536705696
Energy: 0.925137471211077
Energy: 0.7297904047347676
Energy: 1.1534879478740607
Energy: 1.0096008923871596
Energy: 1.1534879478728328
Energy: 0.8068139312802279
Energy: 0.8313777091860567
Energy: 0.7173283681780522
Energy: 0.8313777091860567
Energy: 0.716448086934355
Energy: 0.9252600028427933
Energy: 0.7880075646373985
Energy: 0.9252600028427933
Energy: 0.7220195832618405
Energy: 1.0255699328272876
Energy: 0.8083817132762415
Energy: 1.0255699328272876
Energy: 0.7238580885345621
Energy: 1.1388537188300225
Energy: 1.0479193613688453
Energy: 1.1388537188300225
Energy: 0.706273725991675
Energy: 0.7332717807058913
Energy: 0.7353529071885813
Energy: 0.7332717807071191
Energy: 0.7173482780538925
Energy: 0.9255664869583797
Energy: 1.0516564842856937
Energy: 0.9255664869596074
Energy: 1.0146575217000153
Energy: 1.1547501263414468
Energy: 0.8083079748681214
Energy: 1.1547501263402191
Energy: 0.7166651187816285
Energy: 1.0691702714276174
Energy: 0.8073446340347467
Energy: 1.0691702714276174
Energy: 0.9646776922989594
Energy: 1.027637015077886
Energy: 0.7172552875595046
Energy: 1.027637015077886
Energy: 0.8113380649880542
Energy: 1.1420515033193843
Energy: 0.7096217127279665
Energy: 1.1420515033193843
Energy: 1.0493331857160237
Energy: 1.1399773895170402
Energy: 0.7054640057971803
Energy: 1.1399773895158123
Energy: 0.8407013563080731
Energy: 0.8600956212706505
Energy: 0.7056139181177452
Energy: 0.860095621269423
Energy: 0.8411881239551455
Energy: 1.0276628050324124
Energy: 0.7159987028890912
Energy: 1.0276628050324124
Energy: 0.8115394213040776
Energy: 0.95373200995952
Energy: 0.7217620870813322
Energy: 0.95373200995952
Energy: 0.8064030439805827
Energy: 1.1826148145071538
Energy: 0.7161941199970896
Energy: 1.1826148145083815
Energy: 0.7167019366415041
Energy: 1.0287191276325653
Energy: 0.7165117449138572
Energy: 1.0287191276325653
Energy: 0.7159712895235203
Energy: 1.1722558839664161
Energy: 0.8059586590994176
Energy: 1.1722558839664161

minimum gb energy = 0.7054640057971803 eV
minimum distance =  2.25879557154168 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 0.7604035695758191
Energy: 1.0484609750209095
Energy: 0.6494546860813541
Energy: 1.0484609750209095
Energy: 1.2288331673377264
Energy: 0.9484631740776266
Energy: 0.648621868885931
Energy: 0.9484631740785854
Energy: 0.7222122341932556
Energy: 0.7225259761109049
Energy: 0.8826950735321819
Energy: 0.7225259761109049
Energy: 0.8647486713042694
Energy: 0.8885785781145549
Energy: 0.6506757547471601
Energy: 0.8885785781145549
Energy: 0.6575054086691767
Energy: 0.9486198602777688
Energy: 0.6878939912922715
Energy: 0.9486198602768101
Energy: 0.7097666122455594
Energy: 0.9491260696275119
Energy: 0.6571127372970819
Energy: 0.9491260696275119
Energy: 0.6476161704481611
Energy: 0.7910978007699146
Energy: 0.9170087462252741
Energy: 0.7910978007718319
Energy: 0.6386707569326207
Energy: 0.8920436837374398
Energy: 0.7235339342949824
Energy: 0.8920436837374398
Energy: 0.646963735929213
Energy: 0.9486481692338025
Energy: 1.0501059972435893
Energy: 0.948648169234761
Energy: 0.6314866804979657
Energy: 0.9399858562321333
Energy: 0.6801580680731811
Energy: 0.9399858562321333
Energy: 0.6477331360647555
Energy: 0.7914138935229588
Energy: 0.9448074741363599
Energy: 0.7914138935239174
Energy: 0.8826157387985613
Energy: 0.9960919703829249
Energy: 0.7233332034886771
Energy: 0.9960919703829249
Energy: 0.6519254250956653
Energy: 0.8881981923049237
Energy: 0.8639199277533424
Energy: 0.8881981923058824
Energy: 0.8601265005930476
Energy: 1.0049915882653622
Energy: 0.6568275318243558
Energy: 1.0049915882653622
Energy: 0.6595669858875655
Energy: 0.8678713146099429
Energy: 0.7068900334153609
Energy: 0.8678713146099429
Energy: 0.9165903574213097
Energy: 1.1171212081916237
Energy: 0.6497153666672526
Energy: 1.1171212081916237
Energy: 0.7272727765347101
Energy: 0.8924452214809213
Energy: 0.712849864979492
Energy: 0.8924452214799626
Energy: 0.8828150130314235
Energy: 0.9505057651974012
Energy: 0.6457308945402076
Energy: 0.9505057651964424
Energy: 0.7643432439507859
Energy: 1.129443580102806
Energy: 0.6313613201055734
Energy: 1.1294435801037646
Energy: 1.0871976647781134
Energy: 1.0877173584718343
Energy: 0.6492858001458546
Energy: 1.087717358472793
Energy: 0.7272127552446568
Energy: 0.9990877777008632
Energy: 0.6380899304270008
Energy: 0.9990877777008632
Energy: 0.7235828753395769
Energy: 0.8882032554716014
Energy: 0.6557041149834477
Energy: 0.8882032554716014
Energy: 0.6596929132499016
Energy: 0.8266003540610058
Energy: 0.8600724481608786
Energy: 0.8266003540629232
Energy: 0.7080782084921342
Energy: 1.129860193663623
Energy: 0.6558012930847211
Energy: 1.129860193663623
Energy: 0.6464516045443887
Energy: 1.1169731199070982
Energy: 0.9174346575969179
Energy: 1.1169731199080568
Energy: 0.6355097754108122
Energy: 0.8929118691407835
Energy: 0.728346171855581
Energy: 0.8929118691407835

minimum gb energy = 0.6313613201055734 eV
minimum distance =  2.2927676598422 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 0.8307224908852013
Energy: 0.8321222568053277
Energy: 0.8884597215328751
Energy: 0.8321222568076856
Energy: 1.1378586561760884
Energy: 0.8258388568502123
Energy: 0.5817150574223547
Energy: 0.8258388568494263
Energy: 0.5984615716201941
Energy: 0.8200925825957707
Energy: 1.1565169991940487
Energy: 0.8200925825989146
Energy: 0.8220479164016592
Energy: 0.8258199844376952
Energy: 0.5816117587303392
Energy: 0.8258199844376952
Energy: 0.5780197507779187
Energy: 0.8430356265200944
Energy: 0.6150562478930272
Energy: 0.8430356265287042
Energy: 0.6988703378920428
Energy: 0.8255192491589008
Energy: 0.5817129888512389
Energy: 0.8255192491581148
Energy: 0.5810858138122148
Energy: 0.825144749650205
Energy: 0.7509471809879567
Energy: 0.825144749650205
Energy: 0.5702475821026841
Energy: 0.7150919530500919
Energy: 0.5787616573986935
Energy: 0.7150919530508779
Energy: 0.5841186237995264
Energy: 0.9709265386394303
Energy: 0.960645342048105
Energy: 0.9709265386386444
Energy: 0.5722109088331926
Energy: 0.8205178768423684
Energy: 0.5993073295790554
Energy: 0.8205178768423684
Energy: 0.5810828091448647
Energy: 0.8273483748387072
Energy: 0.9808138529952709
Energy: 0.8273483748379211
Energy: 0.5732557594456524
Energy: 0.8333259718566969
Energy: 0.8314361434459346
Energy: 0.8333259718559108
Energy: 0.5838305637586193
Energy: 0.9694596382994114
Energy: 0.9812253497168216
Energy: 0.9694596382986255
Energy: 0.785817910818062
Energy: 1.1001208939024891
Energy: 0.599205186053359
Energy: 1.1001208939024891
Energy: 0.5810600032025462
Energy: 0.8264454969583915
Energy: 0.8222430799210145
Energy: 0.8264454969591775
Energy: 0.7656494631331662
Energy: 0.8603341872334421
Energy: 0.5786982560754297
Energy: 0.8603341872334421
Energy: 0.5837589600934592
Energy: 0.9694244802985132
Energy: 0.6987717221229451
Energy: 0.9694244802985132
Energy: 0.7496369391525198
Energy: 1.1349302047436525
Energy: 0.5816770867828168
Energy: 1.1349302047428662
Energy: 0.5810758332802682
Energy: 0.7159625437289313
Energy: 0.5706666384943575
Energy: 0.7159625437297172
Energy: 0.7459981436942468
Energy: 0.9190215617713301
Energy: 0.5861679152947968
Energy: 0.9190215617713301
Energy: 0.6013477266350805
Energy: 1.0442153653011672
Energy: 0.57235849552212
Energy: 1.0442153653019532
Energy: 0.981486426135928
Energy: 1.0977998175288262
Energy: 0.5819499189378994
Energy: 1.0977998175280406
Energy: 0.8338495530021303
Energy: 0.832097948532871
Energy: 0.5731237752201427
Energy: 0.8320979485336569
Energy: 0.8335543548305876
Energy: 0.9681599363816957
Energy: 0.5834803271567957
Energy: 0.9681599363809097
Energy: 0.6014186736030357
Energy: 1.0443645308139058
Energy: 0.5785741751182717
Energy: 1.0443645308131198
Energy: 0.8198210190005686
Energy: 1.0965848192573744
Energy: 0.5819128065890219
Energy: 1.0965848192573744
Energy: 0.5810969456351169
Energy: 0.8685607349124329
Energy: 0.7655349005163243
Energy: 0.868560734911647
Energy: 0.5787614668225346
Energy: 0.9689283560441477
Energy: 0.5836286861981809
Energy: 0.9689283560441477
Energy: 0.5840587648695151
Energy: 1.059597748955515
Energy: 0.7501279378501738
Energy: 1.059597748954729
Energy: 0.5711573462453442
Energy: 0.9957049636316307
Energy: 0.5844799545136153
Energy: 0.9957049636316307
Energy: 0.5859309035687477
Energy: 0.9182718317824893
Energy: 0.7457658923518696
Energy: 0.9182718317824893
Energy: 0.574087424243509
Energy: 1.043500615289439
Energy: 0.604735575977127
Energy: 1.043500615290225

minimum gb energy = 0.5702475821026841 eV
minimum distance =  2.2637193708265 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 0.7541187471225882
Energy: 0.9840904072163134
Energy: 0.8306690705727975
Energy: 0.9840904072169792
Energy: 1.1156947582444536
Energy: 0.867982238435091
Energy: 0.5442896593276636
Energy: 0.867982238441749
Energy: 0.5617081771037772
Energy: 0.7428389794166852
Energy: 0.6758583714182242
Energy: 0.7428389794213459
Energy: 1.0851457923077519
Energy: 0.8713927301683002
Energy: 0.5441408733536098
Energy: 0.8713927301676343
Energy: 0.5418752245998149
Energy: 1.046119975738835
Energy: 0.5619354648261777
Energy: 1.0461199757401667
Energy: 0.7338640949259215
Energy: 0.8675209015572273
Energy: 0.5444249484794499
Energy: 0.8675209015585589
Energy: 0.5437580926951207
Energy: 0.7479794356543795
Energy: 0.6817493573048233
Energy: 0.7479794356530479
Energy: 0.631605662741922
Energy: 0.7472985594485287
Energy: 0.5443136181605819
Energy: 0.7472985594445338
Energy: 0.545678370414987
Energy: 0.9875670681503554
Energy: 0.815589611608143
Energy: 0.9875670681510212
Energy: 0.5259518042844199
Energy: 1.0326076396953667
Energy: 0.5424176746864862
Energy: 1.0326076396960326
Energy: 0.5438601200601674
Energy: 0.8636777123264807
Energy: 0.9267152900245341
Energy: 0.8636777123258149
Energy: 0.5276568310656939
Energy: 0.740243327874956
Energy: 0.5623881531754432
Energy: 0.7402433278796167
Energy: 0.5457015140737624
Energy: 0.9896617024668838
Energy: 0.9941428355992281
Energy: 0.9896617024682155
Energy: 0.5276940862348504
Energy: 0.9836645695200422
Energy: 0.7543025176349042
Energy: 0.9836645695200422
Energy: 0.5438034352540606
Energy: 0.8671831671881958
Energy: 1.0139577635685704
Energy: 0.8671831671861984
Energy: 0.7107580789264434
Energy: 0.741732841640487
Energy: 0.5621039405215511
Energy: 0.7417328416411527
Energy: 0.5454569299199705
Energy: 0.989302576418925
Energy: 0.8717843169067052
Energy: 0.9893025764195909
Energy: 0.6945339253165875
Energy: 1.0447400547495316
Energy: 0.5424171072116042
Energy: 1.044740054747534
Energy: 0.5438134612856075
Energy: 0.8669034977466846
Energy: 0.7336211148251219
Energy: 0.8669034977473504
Energy: 0.6801280690639017
Energy: 0.7651241698262524
Energy: 0.5442409762465039
Energy: 0.7651241698249208
Energy: 0.5454943403538581
Energy: 0.8832850135747957
Energy: 0.6845340021447508
Energy: 0.8832850135754615
Energy: 0.6787980180085049
Energy: 0.9842109500184423
Energy: 0.5477485036216265
Energy: 0.984210950019774
Energy: 0.5438268310976858
Energy: 0.9421573810621985
Energy: 0.5255499579569143
Energy: 0.9421573810628643
Energy: 0.9223623283663007
Energy: 0.8634843100177285
Energy: 0.5443983557877256
Energy: 0.86348431001906
Energy: 0.5636110306930063
Energy: 1.049041820104817
Energy: 0.5284615004967362
Energy: 1.0490418201041514
Energy: 0.8961888598872032
Energy: 0.9862717680809331
Energy: 0.547670427690247
Energy: 0.9862717680809331
Energy: 0.7559125067449559
Energy: 0.9774121828415548
Energy: 0.527872531187329
Energy: 0.9774121828415548
Energy: 1.012934888011891
Energy: 0.8677080231967874
Energy: 0.5441949866646184
Energy: 0.8677080232001165
Energy: 0.563500891123592
Energy: 1.0589384317600141
Energy: 0.5316175659586472
Energy: 1.0589384317606798
Energy: 0.7402542731118392
Energy: 0.9862610465813924
Energy: 0.547987823075215
Energy: 0.9862610465820582
Energy: 0.543922643133497
Energy: 1.0420905209873252
Energy: 0.7082905364045061
Energy: 1.0420905209866593
Energy: 0.7348345268859476
Energy: 0.8672212711794333
Energy: 0.5441759483896702
Energy: 0.867221271180765
Energy: 0.5456724936495531
Energy: 1.0374427066989504
Energy: 0.6797892236292455
Energy: 1.0374427066969532
Energy: 0.5312997279158554
Energy: 0.8832120129969608
Energy: 0.5480675515566289
Energy: 0.8832120129976266
Energy: 0.5402923126429862
Energy: 0.9834106907746895
Energy: 0.6787156999046021
Energy: 0.9834106907753553
Energy: 0.5255882757086351
Energy: 0.9401996155485483
Energy: 0.546049740201408
Energy: 0.9401996155485483
Energy: 0.5455642264934472
Energy: 1.0024054829955626
Energy: 0.9196464452122107
Energy: 1.0024054829955626

minimum gb energy = 0.5255499579569143 eV
minimum distance =  2.31179644949619 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 0.7646627145377884
Energy: 0.9626721705263912
Energy: 0.6753730486328168
Energy: 0.9626721705258137
Energy: 1.1331500851138718
Energy: 0.8279561453498111
Energy: 0.4962955393355899
Energy: 0.8279561453492337
Energy: 0.7355545767187286
Energy: 0.7360726921488581
Energy: 0.6421749789475303
Energy: 0.7360726921488581
Energy: 1.1081711023015923
Energy: 0.8126565439360546
Energy: 0.4964283162848654
Energy: 0.8126565439354771
Energy: 0.5671488592602829
Energy: 0.7413251866933886
Energy: 0.5329439432159377
Energy: 0.7413251866933886
Energy: 0.8332470472899465
Energy: 0.7644110643603809
Energy: 0.4966813731058496
Energy: 0.7644110643615358
Energy: 0.5403725149034868
Energy: 0.6922986206087246
Energy: 0.6516882974667324
Energy: 0.6922986206087246
Energy: 0.7135879487397622
Energy: 0.8894107350067152
Energy: 0.5029921509015663
Energy: 0.8894107350078702
Energy: 0.5023403136838769
Energy: 0.6678569334211759
Energy: 0.7399738929013614
Energy: 0.6678569334217535
Energy: 0.6053757075143469
Energy: 0.6866751459645543
Energy: 0.5407042252733878
Energy: 0.6866751459645543
Energy: 0.4976846061250115
Energy: 0.8005326107942488
Energy: 0.8731789881710527
Energy: 0.8005326107930938
Energy: 0.5180123176108549
Energy: 0.9547186834652547
Energy: 0.5677416355985269
Energy: 0.9547186834658321
Energy: 0.49590180122977984
Energy: 0.6677816497379989
Energy: 0.9567215453548766
Energy: 0.6677816497379989
Energy: 0.4760596410095795
Energy: 0.7363791622680287
Energy: 0.7361544464387214
Energy: 0.7363791622680287
Energy: 0.49774608209075244
Energy: 0.8123644954360019
Energy: 1.0913571577370234
Energy: 0.8123644954279174
Energy: 0.4724821552657011
Energy: 0.9427994989717146
Energy: 0.7074722925792919
Energy: 0.9427994989711371
Energy: 0.49588360162269596
Energy: 0.6684363623799199
Energy: 0.9833793057972591
Energy: 0.6684363623787649
Energy: 0.6207651932367891
Energy: 0.7366561168670644
Energy: 0.736140152827023
Energy: 0.736656116866487
Energy: 0.4971177694688876
Energy: 0.8061180536448155
Energy: 0.9367663734436693
Energy: 0.8061180536442379
Energy: 0.6080654966585888
Energy: 0.9857749979398802
Energy: 0.5677098133485223
Energy: 0.9857749979393028
Energy: 0.49703626832277625
Energy: 0.6349143447428096
Energy: 0.8882679826269037
Energy: 0.634914344743387
Energy: 0.6510366773451978
Energy: 0.6987801790156463
Energy: 0.54069612151403
Energy: 0.6987801790162238
Energy: 0.5036534176567973
Energy: 0.8464472507936384
Energy: 0.7135762215298632
Energy: 0.8464472507930609
Energy: 0.6540586283561285
Energy: 0.960341018029179
Energy: 0.5032474305804469
Energy: 0.960341018030334
Energy: 0.5421496534201906
Energy: 0.6405430713979289
Energy: 0.6063586427419996
Energy: 0.6405430713979289
Energy: 0.8732502359403153
Energy: 0.8001505782762312
Energy: 0.4972026847252987
Energy: 0.8001505782739213
Energy: 0.5691834012110556
Energy: 0.8981945306702858
Energy: 0.5175963872288895
Energy: 0.8981945306697082
Energy: 0.877494958247695
Energy: 0.9494190019311869
Energy: 0.4964100602478882
Energy: 0.9494190019317643
Energy: 0.7376547385004143
Energy: 0.7376964897159287
Energy: 0.5200454446861515
Energy: 0.7376964897159287
Energy: 1.0312187487879605
Energy: 0.8043567083837425
Energy: 0.4982028055846563
Energy: 0.8043567083837425
Energy: 0.7666001397892754
Energy: 0.9401112518082684
Energy: 0.47238283674303194
Energy: 0.9401112518082684
Energy: 0.9533041691980035
Energy: 0.9406418915081087
Energy: 0.49634825317931425
Energy: 0.9406418915057989
Energy: 0.7376822170082895
Energy: 0.7368603997020082
Energy: 0.4765956286340185
Energy: 0.7368603997020082
Energy: 0.9365299758530308
Energy: 0.8042717738590898
Energy: 0.4982378265654155
Energy: 0.8042717738590898
Energy: 0.5692112739242003
Energy: 0.9640194998389247
Energy: 0.6079344711319046
Energy: 0.9640194998383472
Energy: 0.7243086760022553
Energy: 0.9034533558519914
Energy: 0.49840202521771615
Energy: 0.9034533558519914
Energy: 0.5420299512738451
Energy: 0.6996936208167197
Energy: 0.6508546249714545
Energy: 0.6996936208161423
Energy: 0.7134315289298868
Energy: 0.8369543965653573
Energy: 0.5052803827941885
Energy: 0.8369543965659347
Energy: 0.5036323556662722
Energy: 0.9279480420026428
Energy: 0.6537726526886746
Energy: 0.9279480420026428
Energy: 0.5230011619471375
Energy: 0.8399384610305627
Energy: 0.5435064675024511
Energy: 0.8399384610317175
Energy: 0.4961382600439784
Energy: 0.7540885506402867
Energy: 0.8736330384830441
Energy: 0.7540885506414416
Energy: 0.5181023752149672
Energy: 0.8883072067781723
Energy: 0.5711425968513346
Energy: 0.8883072067775949
Energy: 0.49702853276265013
Energy: 0.9061675650724117
Energy: 0.8770495896477867
Energy: 0.9061675650729891

minimum gb energy = 0.47238283674303194 eV
minimum distance =  2.30343431593353 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.01550149381510057
Energy: 0.01616823454717108
Energy: 0.8071348125948099
Energy: 0.016168234547615002
Energy: 0.8064078264279138
Energy: 0.2558872950142168
Energy: 0.2554462601903793
Energy: 0.2558872950146608
Energy: 0.015501493815519829
Energy: 0.01616823454717108
Energy: 0.8071271579902658
Energy: 0.016168234547615002
Energy: 0.8064078264279138
Energy: 0.2558872950142168
Energy: 0.2554462601908232
Energy: 0.2558872950146608
Energy: 0.01550149381510057
Energy: 0.016168234547615002
Energy: 0.8071210108123897
Energy: 0.016168234547615002
Energy: 0.8064078264279138
Energy: 0.2558872950142168
Energy: 0.2554462601908232
Energy: 0.2558872950142168

minimum gb energy = 0.01550149381510057 eV
minimum distance =  2.54253903094854 Angstroms
sigma value = 1