Model name: model_name=EAM_Dynamo_ZhouFosterSills_2018_FeNiCr__MO_036303866285_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.523954182863236
cohesive_energy=4.432448362714347
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: 0.018046137452095948
Energy: 1.067292236999246
Energy: 0.018046137452095948
Energy: 1.0672922369989524
Energy: 0.018046137452095948
Energy: 1.067292236999246
Energy: 1.067292236999246
Energy: 0.9809595404169008
Energy: 1.0672922369989524
Energy: 0.9809595404162407
Energy: 1.067292236999246
Energy: 0.9809595404165707
Energy: 0.018046137452095948
Energy: 1.0672922369989524
Energy: 0.018046137452095948
Energy: 1.0672922369989524
Energy: 0.018046137452095948
Energy: 1.0672922369989524
Energy: 1.0672922369995759
Energy: 0.9809595404165707
Energy: 1.067292236999246
Energy: 0.9809595404169008
Energy: 1.0672922369986224
Energy: 0.9809595404169008
Energy: 0.018046137452095948
Energy: 1.067292236999246
Energy: 0.018046137452095948
Energy: 1.0672922369989524
Energy: 0.018046137452095948
Energy: 1.067292236999246
Energy: 1.067292236999246
Energy: 0.9809595404169008
Energy: 1.0672922369986224
Energy: 0.9809595404169008
Energy: 1.0672922369989524
Energy: 0.9809595404172308

minimum gb energy = 0.018046137452095948 eV
minimum distance =  2.20167824438606 Angstroms
sigma value = 1


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

Energy: 1.223334317497508
Energy: 1.1900749649532996
Energy: 1.2233343174967135
Energy: 1.1900749649532996
Energy: 1.223334317495919
Energy: 1.1900749649532996
Energy: 1.196145435425338
Energy: 1.1204254133692144
Energy: 1.1961454354412264
Energy: 1.1204254133692144
Energy: 1.1961454354324879
Energy: 1.1204254133684202
Energy: 1.155259553560502
Energy: 1.2316538834702766
Energy: 1.1552595535597077
Energy: 1.2316538834710709
Energy: 1.155259553560502
Energy: 1.2316538834710709
Energy: 1.3561545655383962
Energy: 1.1550173181473273
Energy: 1.3561545655376017
Energy: 1.1550173181473273
Energy: 1.3561545655383962
Energy: 1.1550173181473273
Energy: 1.1834584423929895
Energy: 1.2753937056732148
Energy: 1.1834584423921952
Energy: 1.2753937056740092
Energy: 1.1834584423921952
Energy: 1.2753937056740092
Energy: 1.2524843566287442
Energy: 1.1128775983433286
Energy: 1.2524843566271555
Energy: 1.112877598342534
Energy: 1.2524843566279498
Energy: 1.1128775983433286
Energy: 1.1631530962507242
Energy: 1.1954996188240317
Energy: 1.16315309624993
Energy: 1.1954996188232374
Energy: 1.1631530962515186
Energy: 1.1954996188240317
Energy: 1.145746674618924
Energy: 1.2759547847904995
Energy: 1.1457466746197185
Energy: 1.275954784789705
Energy: 1.1457466746197185
Energy: 1.2759547847881165
Energy: 1.2786740984300904
Energy: 1.2054591505873804
Energy: 1.2786740984285014
Energy: 1.2054591505873804
Energy: 1.2786740984285014
Energy: 1.2054591505865857
Energy: 1.1037021473217927
Energy: 1.2570988114132222
Energy: 1.1037021473217927
Energy: 1.257098811408456
Energy: 1.1037021473217927
Energy: 1.2570988114116337
Energy: 1.292781211291817
Energy: 1.1125135851979326
Energy: 1.2927812112894337
Energy: 1.1125135851979326
Energy: 1.292781211291817
Energy: 1.1125135851979326
Energy: 1.0952880850925633
Energy: 1.2120725004310997
Energy: 1.0952880850917688
Energy: 1.2120725004326884
Energy: 1.0952880850925633
Energy: 1.2120725004366604
Energy: 1.3493213691438821
Energy: 1.0817826657594471
Energy: 1.3493213691430879
Energy: 1.0817826657594471
Energy: 1.3493213691430879
Energy: 1.0817826657586527
Energy: 1.1347659379525012
Energy: 1.187430305194231
Energy: 1.1347659379532957
Energy: 1.1874303051950252
Energy: 1.1347659379525012
Energy: 1.187430305194231
Energy: 1.3346917067964224
Energy: 1.10828898758668
Energy: 1.334691706798011
Energy: 1.10828898758668
Energy: 1.334691706798011
Energy: 1.1082889875874742
Energy: 1.3513465718382687
Energy: 1.2267812958888418
Energy: 1.3513465718382687
Energy: 1.2267812958864588
Energy: 1.3513465718382687
Energy: 1.2267812958864588
Energy: 1.1804138434444158
Energy: 1.1990304069163236
Energy: 1.180413843442827
Energy: 1.1990304069163236
Energy: 1.180413843442827
Energy: 1.199030406915529
Energy: 1.1800134528635866
Energy: 1.1649726053696694
Energy: 1.1800134528635866
Energy: 1.1649726053680804
Energy: 1.180013452862792
Energy: 1.1649726053656975
Energy: 1.0976313766468218
Energy: 1.1540243560952652
Energy: 1.0976313766476162
Energy: 1.1540243560968542
Energy: 1.0976313766476162
Energy: 1.1540243560960597
Energy: 1.2461668264496606
Energy: 1.1131444169395999
Energy: 1.2461668264472772
Energy: 1.1131444169403943
Energy: 1.2461668264464827
Energy: 1.1131444169395999
Energy: 1.130570128194623
Energy: 1.32901467555105
Energy: 1.1305701281954172
Energy: 1.3290146755486665
Energy: 1.130570128194623
Energy: 1.3290146755439003
Energy: 1.2462389973088608
Energy: 1.1980563935346344
Energy: 1.2462389973072718
Energy: 1.1980563935346344
Energy: 1.2462389973088608
Energy: 1.1980563935346344
Energy: 1.0965019502253819
Energy: 1.3231138627854382
Energy: 1.0965019502222042
Energy: 1.3231138627878214
Energy: 1.0965019502222042
Energy: 1.323113862787027

minimum gb energy = 1.0817826657586527 eV
minimum distance =  2.17516385468686 Angstroms
sigma value = 33


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

Energy: 1.3256938943960814
Energy: 1.2910642911103374
Energy: 1.2761162954939096
Energy: 1.2910642911098853
Energy: 1.3256938943956296
Energy: 1.2910642911058188
Energy: 1.3423730416382267
Energy: 1.1558358953701602
Energy: 1.3423730416400341
Energy: 1.1558358953710641
Energy: 1.342373041639582
Energy: 1.1558358953728713
Energy: 1.1397276911824434
Energy: 1.1553081643391554
Energy: 1.1397276911792806
Energy: 1.1553081643391554
Energy: 1.1397276911833474
Energy: 1.1553081643314738
Energy: 1.2944657608161012
Energy: 1.2816241446557264
Energy: 1.2944657608151975
Energy: 1.2816241446557264
Energy: 1.2944657608156496
Energy: 1.2816241446566303
Energy: 1.22704678840924
Energy: 1.228595872752955
Energy: 1.2270467884060772
Energy: 1.2285958727547623
Energy: 1.2270467884096918
Energy: 1.2285958727597326
Energy: 1.1608154144195053
Energy: 1.1292058838750842
Energy: 1.1608154144231202
Energy: 1.1292058838737284
Energy: 1.1608154144199572
Energy: 1.1292058838805064
Energy: 1.2826755570260628
Energy: 1.2118257227499531
Energy: 1.2826755570238033
Energy: 1.2118257227495015
Energy: 1.2826755570242554
Energy: 1.2118257227436273
Energy: 1.0940658926668796
Energy: 1.325228678282575
Energy: 1.094065892665524
Energy: 1.3252286782843825
Energy: 1.0940658926668796
Energy: 1.3252286782821232
Energy: 1.1557114684004188
Energy: 1.1438013552164794
Energy: 1.1557114683940928
Energy: 1.1438013552164794
Energy: 1.1557114683981593
Energy: 1.1438013552133162
Energy: 1.118169940850581
Energy: 1.3419530994725417
Energy: 1.1181698917901535
Energy: 1.3419530994743492
Energy: 1.1181699408510328
Energy: 1.3419530994946827
Energy: 1.3883150162702962
Energy: 1.1219688222801005
Energy: 1.3883150162680369
Energy: 1.1219688222796487
Energy: 1.3883150162702962
Energy: 1.1219688222805524
Energy: 1.1399672581824363
Energy: 1.271986238135558
Energy: 1.1399667478302753
Energy: 1.271986238135558
Energy: 1.1399672581819846
Energy: 1.2719862381373654
Energy: 1.3115493589714524
Energy: 1.1397450943617942
Energy: 1.3115544177764364
Energy: 1.1397450943617942
Energy: 1.311549358973712
Energy: 1.1397450943694756
Energy: 1.322528371944898
Energy: 1.2860214846839486
Energy: 1.3225332881731615
Energy: 1.2860214846871114
Energy: 1.322528371944446
Energy: 1.286021484685304
Energy: 1.2379239421923465
Energy: 1.1548285829313214
Energy: 1.23792394218828
Energy: 1.154828582932677
Energy: 1.237923942191443
Energy: 1.1548285829272547
Energy: 1.139243465321362
Energy: 1.155571576550232
Energy: 1.1392434653218138
Energy: 1.1555715765506838
Energy: 1.139243465321362
Energy: 1.1555715765583654
Energy: 1.3040515483981603
Energy: 1.2523427403065703
Energy: 1.304051548402227
Energy: 1.2523427403061187
Energy: 1.3040515483981603
Energy: 1.2523427403061187
Energy: 1.2302399524436678
Energy: 1.1308104696179313
Energy: 1.2302399524477343
Energy: 1.1308104696183832
Energy: 1.230239952443216
Energy: 1.1308104696138648
Energy: 1.1659870008479747
Energy: 1.1649611581974526
Energy: 1.1659870008461675
Energy: 1.1649611581970007
Energy: 1.165987000847071
Energy: 1.164961158196138
Energy: 1.2862629639147058
Energy: 1.2152027202163782
Energy: 1.286262963911091
Energy: 1.2152027202168303
Energy: 1.2862629639106393
Energy: 1.2152027202136675
Energy: 1.0930937108656447
Energy: 1.3253395783120052
Energy: 1.0930937108633856
Energy: 1.325339578312457
Energy: 1.093093710864741
Energy: 1.3253395783106496
Energy: 1.1565723287877416
Energy: 1.143760157673885
Energy: 1.1565723287827714
Energy: 1.1437601576734333
Energy: 1.1565723287845788
Energy: 1.143760157671174
Energy: 1.1189535342283448
Energy: 1.343196685504745
Energy: 1.1189498162738838
Energy: 1.343196685504745
Energy: 1.1189535342287966
Energy: 1.3431966855237227
Energy: 1.3636894597270557
Energy: 1.2277546842212652
Energy: 1.3636894597284113
Energy: 1.2277546842212652
Energy: 1.3636894597275073
Energy: 1.2277546842316578
Energy: 1.1398259893507456
Energy: 1.1612351313455977
Energy: 1.1398301049439552
Energy: 1.1612351313451459
Energy: 1.1398259893507456
Energy: 1.1612351313514717
Energy: 1.3248848010080223
Energy: 1.2675717246930236
Energy: 1.2762843204782888
Energy: 1.2675717246912164
Energy: 1.3248848010048595
Energy: 1.2675717246948313
Energy: 1.3250050421835409
Energy: 1.244734244707376
Energy: 1.2761672384064622
Energy: 1.2447342447069238
Energy: 1.3250050421826371
Energy: 1.244734244707376
Energy: 1.139816172165544
Energy: 1.1565216016604662
Energy: 1.1398161721623807
Energy: 1.1565216016618218
Energy: 1.139816172165544
Energy: 1.15652160166137
Energy: 1.2777797683002323
Energy: 1.1559940308830159
Energy: 1.277779768292099
Energy: 1.1559940308834677
Energy: 1.2777797682957137
Energy: 1.15599403088889
Energy: 1.1186878413500407
Energy: 1.3916133747729906
Energy: 1.1186878413577224
Energy: 1.3916133747729906
Energy: 1.1186878413500407
Energy: 1.3916133747725388
Energy: 1.232298747762925
Energy: 1.1438988204212657
Energy: 1.2322987477656357
Energy: 1.1438988204212657
Energy: 1.2322987477647322
Energy: 1.1438988204248806
Energy: 1.1383594366858933
Energy: 1.2129401869790375
Energy: 1.1383594366863454
Energy: 1.2129401869808039
Energy: 1.1383594366854415
Energy: 1.2129401869808039
Energy: 1.2830271615176876
Energy: 1.2151927469730497
Energy: 1.2830271615113618
Energy: 1.2151927469730497
Energy: 1.283027161517236
Energy: 1.215192746969435
Energy: 1.1565354374990886
Energy: 1.2370228442328286
Energy: 1.1565354374950219
Energy: 1.2370228442328286
Energy: 1.1565354374995405
Energy: 1.2370228442301174
Energy: 1.1552997568112318
Energy: 1.1391731435136758
Energy: 1.1552997568143946
Energy: 1.1391731435136758
Energy: 1.155299756810328
Energy: 1.139173143510061
Energy: 1.2468791831615558
Energy: 1.302935738369802
Energy: 1.246879183161104
Energy: 1.30293573836935
Energy: 1.2468791831624597
Energy: 1.302935738369802
Energy: 1.1392187299000878
Energy: 1.2265045383011963
Energy: 1.1392243826190491
Energy: 1.2265045383011963
Energy: 1.1392187299005396
Energy: 1.2265045382984852
Energy: 1.1855207780051458
Energy: 1.1613106735315661
Energy: 1.1858241360615622
Energy: 1.1613106735302106
Energy: 1.185520778004694
Energy: 1.1613106735274994
Energy: 1.3119919324189349
Energy: 1.3006593608770634
Energy: 1.311995954957934
Energy: 1.3006593608797745
Energy: 1.311991932417579
Energy: 1.300659360877967
Energy: 1.32591194333958
Energy: 1.1216932855131463
Energy: 1.3259119433377726
Energy: 1.1216932855131463
Energy: 1.3259119433391284
Energy: 1.1216932855248944
Energy: 1.139844352638927
Energy: 1.1561300207718137
Energy: 1.1398443526407342
Energy: 1.1561300207722656
Energy: 1.1398443526384754
Energy: 1.156130020774073

minimum gb energy = 1.0930937108633856 eV
minimum distance =  2.34412816473722 Angstroms
sigma value = 51


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

Energy: 1.2221787698774655
Energy: 1.2424394432972976
Energy: 1.2221787698753717
Energy: 1.2424394432972976
Energy: 1.2221787698774655
Energy: 1.2424394432972976
Energy: 1.3246362072909403
Energy: 1.1715888913119672
Energy: 1.3246362072909403
Energy: 1.1715888913119672
Energy: 1.324636207291987
Energy: 1.1715888913119672
Energy: 1.1601443785171974
Energy: 1.2280798851375996
Energy: 1.1601443785161507
Energy: 1.2280798851396935
Energy: 1.1601443785171974
Energy: 1.2280798851386465
Energy: 1.208284637066496
Energy: 1.0968087107390836
Energy: 1.208284637066496
Energy: 1.0968087107390836
Energy: 1.208284637066496
Energy: 1.0968087107390836
Energy: 1.2327822044342798
Energy: 1.1763090257059938
Energy: 1.2327822044332328
Energy: 1.1763090257059938
Energy: 1.2327822044332328
Energy: 1.1763090257059938
Energy: 1.2331876343812624
Energy: 1.1762514513443059
Energy: 1.2331876343833565
Energy: 1.1762514513443059
Energy: 1.2331876343844035
Energy: 1.1762514513443059
Energy: 1.213542537885544
Energy: 1.1760395491742615
Energy: 1.213542537885544
Energy: 1.1760395491742615
Energy: 1.213542537885544
Energy: 1.1760395491742615
Energy: 1.144263958269645
Energy: 1.1768368758710004
Energy: 1.144263958267551
Energy: 1.1768368758699537
Energy: 1.144263958268598
Energy: 1.1768368758710004
Energy: 1.3745834423765957
Energy: 1.0925685927214082
Energy: 1.3745834423776426
Energy: 1.0925685927214082
Energy: 1.3745834423776426
Energy: 1.0925685927214082
Energy: 1.1229965906153823
Energy: 1.3864237508510024
Energy: 1.1229965906153823
Energy: 1.3864237508510024
Energy: 1.1229965906143353
Energy: 1.3864237508520492
Energy: 1.326218775216952
Energy: 1.109505070246373
Energy: 1.3262187752190462
Energy: 1.1095050702474198
Energy: 1.3262187752190462
Energy: 1.1095050702474198
Energy: 1.2261916582652908
Energy: 1.2455364311208112
Energy: 1.2261916582652908
Energy: 1.2455364311208112
Energy: 1.2261916582663377
Energy: 1.2455364311208112
Energy: 1.3974148865565412
Energy: 1.1707198352448533
Energy: 1.3974148865565412
Energy: 1.1707198352448533
Energy: 1.397414886555494
Energy: 1.1707198352448533
Energy: 1.1601934657083852
Energy: 1.1650729106718514
Energy: 1.1601934657073383
Energy: 1.1650729106708047
Energy: 1.1601934657073383
Energy: 1.1650729106718514
Energy: 1.2097031221030032
Energy: 1.2237415869683377
Energy: 1.2097031221040502
Energy: 1.2237415869683377
Energy: 1.2097031221040502
Energy: 1.2237415869683377
Energy: 1.2334617142995075
Energy: 1.1761331260691081
Energy: 1.2334617142995075
Energy: 1.1761331260691081
Energy: 1.2334617143005546
Energy: 1.1761331260701549
Energy: 1.2327497136369305
Energy: 1.2635644267509425
Energy: 1.2327497136379773
Energy: 1.2635644267509425
Energy: 1.2327497136369305
Energy: 1.2635644267519897
Energy: 1.2145686538926344
Energy: 1.181269577509365
Energy: 1.2145686538926344
Energy: 1.1812695775104118
Energy: 1.2145686538926344
Energy: 1.181269577509365

minimum gb energy = 1.0925685927214082 eV
minimum distance =  2.17209364220481 Angstroms
sigma value = 19


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

Energy: 1.1208891824722524
Energy: 1.1085221435953048
Energy: 1.1208891824716314
Energy: 1.1085221435959258
Energy: 1.1208891824722524
Energy: 1.1085221435971677
Energy: 1.2327529306400065
Energy: 1.2205510970043216
Energy: 1.2327529306387646
Energy: 1.2205510970043216
Energy: 1.2327529306375224
Energy: 1.2205510970043216
Energy: 1.0613725657797866
Energy: 1.220011284085571
Energy: 1.0613725657791937
Energy: 1.220011284085571
Energy: 1.0613725657804076
Energy: 1.220011284086192
Energy: 1.1485853286990606
Energy: 1.061452405780338
Energy: 1.1485853286996817
Energy: 1.061452405780338
Energy: 1.1485853286990606
Energy: 1.0614524057809591
Energy: 1.0890079846307723
Energy: 1.047128920975296
Energy: 1.0890079846301512
Energy: 1.047128920975917
Energy: 1.0890079846307723
Energy: 1.047128920975917
Energy: 1.0769509580625283
Energy: 1.0473133789158646
Energy: 1.0769509580619072
Energy: 1.0473133789158646
Energy: 1.0769509580619072
Energy: 1.0473133789158646
Energy: 1.1097248552976064
Energy: 1.061467333909041
Energy: 1.1097248552988486
Energy: 1.061467333909041
Energy: 1.1097248552988486
Energy: 1.061467333909041
Energy: 1.0616700294648755
Energy: 1.2740736281652811
Energy: 1.0616700294642545
Energy: 1.2740736281646599
Energy: 1.0616700294636334
Energy: 1.2740736281671439
Energy: 1.1423417956141344
Energy: 1.1979892450886318
Energy: 1.1423417956141344
Energy: 1.1979892450886318
Energy: 1.1423417956135133
Energy: 1.1979892450886318
Energy: 1.0490456770339072
Energy: 1.116038957894423
Energy: 1.0490456770339072
Energy: 1.116038957894423
Energy: 1.0490456770339072
Energy: 1.116038957894423
Energy: 1.2327529306375224
Energy: 1.2205510970049427
Energy: 1.2327529306375224
Energy: 1.2205510970043216
Energy: 1.2327529306356595
Energy: 1.2205510970043216
Energy: 1.0613725657810287
Energy: 1.220011284086813
Energy: 1.0613725657810287
Energy: 1.220011284086813
Energy: 1.0613725657816497
Energy: 1.220011284087434
Energy: 1.1485853286996817
Energy: 1.0614628664844536
Energy: 1.1485853286990606
Energy: 1.0614628664844536
Energy: 1.1485853286996817
Energy: 1.0614628664844536
Energy: 1.0890079846295304
Energy: 1.047128920975917
Energy: 1.0890079846301512
Energy: 1.047128920975917
Energy: 1.0890079846301512
Energy: 1.047128920975917
Energy: 1.0769509580631493
Energy: 1.047313378914002
Energy: 1.0769509580637704
Energy: 1.047313378914002
Energy: 1.0769509580637704
Energy: 1.047313378914002
Energy: 1.1097248552957435
Energy: 1.06146733390842
Energy: 1.1097248552976064
Energy: 1.06146733390842
Energy: 1.1097248552969854
Energy: 1.06146733390842
Energy: 1.0616282482716601
Energy: 1.274073628166523
Energy: 1.0616282482716601
Energy: 1.274073628167765
Energy: 1.0616282482716601
Energy: 1.274073628168386
Energy: 1.1736853129601574
Energy: 1.1979892450855267
Energy: 1.1736853129601574
Energy: 1.1979892450855267
Energy: 1.1736853129613996
Energy: 1.1979892450855267
Energy: 1.1208891824697682
Energy: 1.1085221435953048
Energy: 1.1208891824691471
Energy: 1.1085221435946835
Energy: 1.1208891824691471
Energy: 1.1085221435946835
Energy: 1.2327529306400065
Energy: 1.2205510970037008
Energy: 1.2327529306375224
Energy: 1.2205510970037008
Energy: 1.2327529306369014
Energy: 1.2205510970037008
Energy: 1.0613725657810287
Energy: 1.220011284088055
Energy: 1.0613725657810287
Energy: 1.220011284087434
Energy: 1.0613725657810287
Energy: 1.220011284088676
Energy: 1.1485853287003027
Energy: 1.0614524057797172
Energy: 1.1485853287003027
Energy: 1.0614524057790962
Energy: 1.1485853287009238
Energy: 1.0614524057790962
Energy: 1.0890079846326355
Energy: 1.047128920976538
Energy: 1.0890079846326355
Energy: 1.047128920977159
Energy: 1.0890079846332565
Energy: 1.047128920976538
Energy: 1.0769509580631493
Energy: 1.0473133789158646
Energy: 1.0769509580631493
Energy: 1.0473133789158646
Energy: 1.0769509580631493
Energy: 1.0473133789158646
Energy: 1.1097248552976064
Energy: 1.06146733390842
Energy: 1.1097248552994696
Energy: 1.06146733390842
Energy: 1.1097248553007117
Energy: 1.061467333907799
Energy: 1.0616700294630124
Energy: 1.2740736281652811
Energy: 1.0616700294636334
Energy: 1.274073628165902
Energy: 1.0616700294636334
Energy: 1.274073628165902
Energy: 1.1423417956135133
Energy: 1.197989245088011
Energy: 1.1423417956135133
Energy: 1.197989245088011
Energy: 1.1423417956135133
Energy: 1.197989245088011
Energy: 1.0490456770332859
Energy: 1.116038957891318
Energy: 1.0490456770339072
Energy: 1.116038957891318
Energy: 1.0490456770339072
Energy: 1.116038957891318
Energy: 1.2327529306406275
Energy: 1.2205510970049427
Energy: 1.2327529306406275
Energy: 1.2205510970049427
Energy: 1.2327529306406275
Energy: 1.2205510970055637
Energy: 1.0613725657797866
Energy: 1.220011284086192
Energy: 1.0613725657804076
Energy: 1.220011284086813
Energy: 1.0613725657804076
Energy: 1.220011284086813

minimum gb energy = 1.047128920975296 eV
minimum distance =  2.20004822682548 Angstroms
sigma value = 27


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

Energy: 1.0387768931809167
Energy: 1.0049185582581739
Energy: 1.0387768931809167
Energy: 1.0049185582581739
Energy: 1.0387768931809167
Energy: 1.0049185582596951
Energy: 1.1694007198576768
Energy: 1.0495254662566154
Energy: 1.1694007198591982
Energy: 1.0495254662566154
Energy: 1.1694007198576768
Energy: 1.049525466258102
Energy: 1.0388573789725941
Energy: 1.176674308320417
Energy: 1.0388573789741151
Energy: 1.1766743083234594
Energy: 1.0388573789725941
Energy: 1.1766743083234594
Energy: 1.1323242199535741
Energy: 0.9703958517011897
Energy: 1.132324219952053
Energy: 0.9703958517027109
Energy: 1.1323242199550607
Energy: 0.9703958517027109
Energy: 1.2088218317552035
Energy: 0.9705716966127044
Energy: 1.2088218317552035
Energy: 0.9705716966127044
Energy: 1.208821831756725
Energy: 0.9705716966127044
Energy: 1.1501954680232644
Energy: 1.208247305680083
Energy: 1.1501954680232644
Energy: 1.2082473056816043
Energy: 1.1501954680232644
Energy: 1.2082473056770409
Energy: 1.0710416910448388
Energy: 1.050954482154654
Energy: 1.0710416910417966
Energy: 1.050954482154654
Energy: 1.0710416910433178
Energy: 1.0509544821531327
Energy: 1.0336667752622757
Energy: 1.004848145240814
Energy: 1.0336667752622757
Energy: 1.0048481452423352
Energy: 1.0336667752622757
Energy: 1.004848145240814
Energy: 1.0915548735007192
Energy: 1.0387705016006339
Energy: 1.091554873499198
Energy: 1.0387704792052954
Energy: 1.0915548735007192
Energy: 1.0387704918208323
Energy: 1.1452009348398156
Energy: 1.1678538645942005
Energy: 1.1452009348398156
Energy: 1.1678538645942005
Energy: 1.1452009348398156
Energy: 1.1678538645942005
Energy: 1.0062302697840444
Energy: 0.9708319412049894
Energy: 1.0062302697840444
Energy: 0.9708319412049894
Energy: 1.006230269782523
Energy: 0.9708319412049894
Energy: 1.205898596214583
Energy: 1.0910508655451783
Energy: 1.205898596214583
Energy: 1.0910508655451783
Energy: 1.205898596214583
Energy: 1.0910508655451783

minimum gb energy = 0.9703958517011897 eV
minimum distance =  2.170176890645 Angstroms
sigma value = 9


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

Energy: 1.0204695575449656
Energy: 0.9766346440573678
Energy: 1.020469557544111
Energy: 0.9766346440577951
Energy: 1.0204695575436833
Energy: 0.9766346440573678
Energy: 0.9943348969452964
Energy: 1.0228799275370295
Energy: 0.9943348969440141
Energy: 1.0228799275378841
Energy: 0.9943348969358934
Energy: 1.0228799275378841
Energy: 0.9228710578315928
Energy: 1.0423347284136266
Energy: 0.9228710578328749
Energy: 1.0423347284136266
Energy: 0.9228710578333023
Energy: 1.0423347284136266
Energy: 0.9501111726550213
Energy: 0.9143892853749697
Energy: 0.9501111726554486
Energy: 0.9143892853732601
Energy: 0.9501111726550213
Energy: 0.9143892853745422
Energy: 1.015026308911354
Energy: 0.9833992134301865
Energy: 1.0150263089117815
Energy: 0.9833992134289042
Energy: 1.0150263089122087
Energy: 0.983399213430614
Energy: 1.0156717941371098
Energy: 1.0064765095033175
Energy: 1.015671794139247
Energy: 1.006476509503745
Energy: 1.015671794137965
Energy: 1.0064765095054546
Energy: 0.9514578297984104
Energy: 1.0637452572064148
Energy: 0.9514578297988378
Energy: 1.0637452572072696
Energy: 0.9514578297996925
Energy: 1.0637452572076966
Energy: 0.8893277410114443
Energy: 1.0632594607785095
Energy: 0.8893277410135814
Energy: 1.063259460778937
Energy: 0.8893277410105895
Energy: 1.0632594607797918
Energy: 1.0515273653260169
Energy: 0.9748393194437073
Energy: 1.0515273653268715
Energy: 0.9748393194437073
Energy: 1.051527365327299
Energy: 0.9748393194432798
Energy: 1.010338459916306
Energy: 1.0195821784944281
Energy: 1.0103384599180156
Energy: 1.0195821785055406
Energy: 1.0103384599154515
Energy: 1.0195821784969925
Energy: 0.9510654952359117
Energy: 0.9215148461825085
Energy: 0.9510654952354841
Energy: 0.9215148461829358
Energy: 0.9510654952350568
Energy: 0.9215148461825085
Energy: 0.9658761468278942
Energy: 0.9899513019608532
Energy: 0.9658761468266122
Energy: 0.9899513019582887
Energy: 0.965876146827467
Energy: 0.9899513019582887
Energy: 0.9878299676444259
Energy: 0.9852050775976416
Energy: 0.9878299676448532
Energy: 0.9852050775963593
Energy: 0.987829967642289
Energy: 0.985205077598069
Energy: 1.0170410239722978
Energy: 0.9646358073657919
Energy: 1.0170410239731524
Energy: 0.9646358073675015
Energy: 1.0170410239705883
Energy: 0.9646358073657919
Energy: 0.9298786104343651
Energy: 1.0025549289621165
Energy: 0.9298786104360749
Energy: 1.002554928962544
Energy: 0.9298786104360749
Energy: 1.002554928962544
Energy: 0.9397852274789411
Energy: 0.9747702867892597
Energy: 0.9397852274776591
Energy: 0.9747702867884049
Energy: 0.9397852274768042
Energy: 0.9747702867892597
Energy: 1.1720319904643426
Energy: 0.9156534507561049
Energy: 1.1720319904609233
Energy: 0.9156534507556775
Energy: 1.1720319904630605
Energy: 0.9156534507556775
Energy: 0.9411467064956041
Energy: 0.9842919955982861
Energy: 0.9411467064964589
Energy: 0.9842919955991409
Energy: 0.9411467064964589
Energy: 0.9842919955982861
Energy: 0.8853915737069632
Energy: 1.0010676858649903
Energy: 0.8853915737078181
Energy: 1.001067685867555
Energy: 0.8853915737073906
Energy: 1.0010676858679821
Energy: 1.078948116431094
Energy: 0.9489624241667914
Energy: 1.0789481164319488
Energy: 0.9489624241663639
Energy: 1.078948116431521
Energy: 0.9489624241663639
Energy: 0.8853612046350752
Energy: 1.001500051778523
Energy: 0.8853612046346476
Energy: 1.001500051779378
Energy: 0.8853612046346476
Energy: 1.0015000517806598
Energy: 0.9409921423656367
Energy: 0.9845487173789514
Energy: 0.9409921423664914
Energy: 0.9845487173793788
Energy: 0.9409921423652093
Energy: 0.9845487173789514
Energy: 1.1719964718278104
Energy: 0.9156676385985977
Energy: 1.1719964718269553
Energy: 0.915667638596888
Energy: 1.171996471828665
Energy: 0.9156676385943234
Energy: 0.9398271775355709
Energy: 0.993989338064245
Energy: 0.9398271775338612
Energy: 0.9939893380625355
Energy: 0.939827177534716
Energy: 0.9939893380625355
Energy: 0.9295918337773934
Energy: 1.002678618992785
Energy: 0.9295918337756838
Energy: 1.0026786189936399
Energy: 0.9295918337773934
Energy: 1.0026786189940673
Energy: 1.017013677580782
Energy: 1.0067921525072283
Energy: 1.0170136775786447
Energy: 1.0067921525072283
Energy: 1.017013677579927
Energy: 1.0067921525072283
Energy: 0.9880517744140604
Energy: 0.9851247675789014
Energy: 0.9880517744114959
Energy: 0.9851247675823208
Energy: 0.9880517744140604
Energy: 0.9851247675763372
Energy: 0.9660645615022124
Energy: 0.9721576425499684
Energy: 0.9660645615013574
Energy: 0.9721576425491135
Energy: 0.9660645615000752
Energy: 0.9721576425482588
Energy: 0.9510770786618336
Energy: 0.9214942464465252
Energy: 0.9510770786614062
Energy: 0.92149424644738
Energy: 0.9510770786618336
Energy: 0.9214942464469527
Energy: 1.0103261146103995
Energy: 0.9458261737712029
Energy: 1.010326114610827
Energy: 0.9458261737703482
Energy: 1.0103261146121092
Energy: 0.9458261737737674
Energy: 1.0518112460922278
Energy: 0.9744275576213258
Energy: 1.05181124609351
Energy: 0.9744275576221807
Energy: 1.0518112460896631
Energy: 0.9744275576208985
Energy: 0.8893426475682706
Energy: 1.0851601901015169
Energy: 0.8893426475674158
Energy: 1.0851601901015169
Energy: 0.8893426475682706
Energy: 1.0851601901015169
Energy: 0.9512811122114864
Energy: 1.0638402362676036
Energy: 0.9512811122114864
Energy: 1.0638402362676036
Energy: 0.95128111221747
Energy: 1.0638402362671762
Energy: 1.0157689611988454
Energy: 0.9859678668084435
Energy: 1.0157689611992728
Energy: 0.9859678668105805
Energy: 1.015768961198418
Energy: 0.9859678668088708
Energy: 1.015021576545868
Energy: 0.983792254116291
Energy: 1.015021576545441
Energy: 0.9837922541175732
Energy: 1.015021576545868
Energy: 0.9837922541175732
Energy: 0.9501241689503491
Energy: 0.9145453327958332
Energy: 0.9501241689546233
Energy: 0.9145453327949784
Energy: 0.9501241689503491
Energy: 0.9145453327932689
Energy: 0.9230724164413829
Energy: 1.0422950670045286
Energy: 0.9230724164409555
Energy: 1.0422950670053837
Energy: 0.9230724164409555
Energy: 1.0422950670053837
Energy: 0.9948443474680568
Energy: 0.9335425284483951
Energy: 0.9948443474710487
Energy: 0.9335425284471129
Energy: 0.9948443474680568
Energy: 0.9335425284475404
Energy: 1.0204695575445382
Energy: 0.9766346440573678
Energy: 1.020469557544111
Energy: 0.9766346440590774
Energy: 1.0204695575445382
Energy: 0.9766346440582225
Energy: 0.9943348969316191
Energy: 0.984815880707053
Energy: 0.9943348969341838
Energy: 0.9848158807074803
Energy: 0.9943348969431594
Energy: 0.9848158807074803
Energy: 0.9228710578341572
Energy: 1.0423347284157636
Energy: 0.9228710578333023
Energy: 1.0423347284157636
Energy: 0.9228710578341572
Energy: 1.0423347284157636
Energy: 0.9501111726558761
Energy: 0.9143892853779615
Energy: 0.950111172656731
Energy: 0.9143892853779615
Energy: 0.9501111726550213
Energy: 0.9143892853788164
Energy: 1.015026308905409
Energy: 0.9833992134293317
Energy: 1.015026308906264
Energy: 0.9833992134327508
Energy: 1.0150263089071188
Energy: 0.9833992134318962

minimum gb energy = 0.8853612046346476 eV
minimum distance =  2.27620088478788 Angstroms
sigma value = 57


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

Energy: 1.0191370469504157
Energy: 0.8984166369894447
Energy: 0.4757927203045466
Energy: 0.8984166369884719
Energy: 1.0191370469494427
Energy: 0.8984166369904177
Energy: 1.0857325028057454
Energy: 0.8866462675483175
Energy: 1.0857325028057454
Energy: 0.8866851965040446
Energy: 1.0857325028067184
Energy: 0.8866462675473447
Energy: 0.9707251347975385
Energy: 1.0404571505605629
Energy: 0.9707251347956368
Energy: 0.8505893813665357
Energy: 0.9707251347975385
Energy: 1.0404571505615359
Energy: 0.8988770817239828
Energy: 0.6592062499562654
Energy: 0.8988770817200912
Energy: 0.6592084309422509
Energy: 0.8988770817171722
Energy: 0.6592062499514006
Energy: 0.6475053647924871
Energy: 1.0920212345275453
Energy: 0.647505364797352
Energy: 1.0920212345275453
Energy: 0.6475053648002707
Energy: 1.0920212345275453
Energy: 0.8442240603782548
Energy: 0.9702785779792308
Energy: 0.47584324143916384
Energy: 0.9702785779772848
Energy: 0.8442240603821465
Energy: 0.9702785779811766
Energy: 0.8441807593140845
Energy: 0.551884803489946
Energy: 0.47581759507969973
Energy: 0.551884803488973
Energy: 0.8441807593131115
Energy: 0.5518848034928646
Energy: 1.0854445033229325
Energy: 0.653172701289509
Energy: 1.0854445033267803
Energy: 0.6531727012856173
Energy: 1.0854445033229325
Energy: 0.653172701289509
Energy: 0.900967791616458
Energy: 0.6592374384169438
Energy: 0.900967791615485
Energy: 0.6592264257894088
Energy: 0.9009677916145564
Energy: 0.6592374384227814
Energy: 0.5517670664425903
Energy: 0.9725250774286003
Energy: 0.5517670664445361
Energy: 0.9725250774344381
Energy: 0.5517670664435632
Energy: 0.9725250774324921
Energy: 0.6474277978153529
Energy: 0.8854030540487552
Energy: 0.647427797813407
Energy: 0.8854030540497281
Energy: 0.6474277978182718
Energy: 0.8854030540477823
Energy: 1.0191370469513885
Energy: 0.8984166369904177
Energy: 0.47579272030357367
Energy: 0.8984166369904177
Energy: 1.0191370469504157
Energy: 0.8984166369904177
Energy: 1.0857325028037996
Energy: 0.8866462675483175
Energy: 1.0857325028018536
Energy: 0.8866851965050174
Energy: 1.0857325028057454
Energy: 0.8866462675483175
Energy: 0.9707251347956368
Energy: 1.0404571505605629
Energy: 0.9707251347946639
Energy: 0.8505893813655627
Energy: 0.9707251347975385
Energy: 1.0404571505615359
Energy: 0.8988770817239828
Energy: 0.6592062499552925
Energy: 0.898877081721064
Energy: 0.6592084309422509
Energy: 0.8988770817161992
Energy: 0.6592062499523736
Energy: 0.6475053647924871
Energy: 1.092021234524671
Energy: 0.6475053647992977
Energy: 1.092021234525644
Energy: 0.6475053648012435
Energy: 1.092021234523698
Energy: 0.8442240603792277
Energy: 0.9702785779821496
Energy: 0.47584324144013673
Energy: 0.9702785779782578
Energy: 0.8442240603792277
Energy: 0.9702785779811766
Energy: 0.8441807593121385
Energy: 0.551884803489946
Energy: 0.47581759507872673
Energy: 0.5518848034870271
Energy: 0.8441807593111655
Energy: 0.551884803489946
Energy: 1.0854445033229325
Energy: 0.653172701289509
Energy: 1.0854445033239055
Energy: 0.6531727012865902
Energy: 1.0854445033229325
Energy: 0.653172701288536

minimum gb energy = 0.47579272030357367 eV
minimum distance =  2.40407397454582 Angstroms
sigma value = 11


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

Energy: 0.9327902176801798
Energy: 0.8837790764081699
Energy: 0.9327902176816052
Energy: 0.8837790764074573
Energy: 0.9327902176808925
Energy: 0.8837790764081699
Energy: 1.0504820265542851
Energy: 0.8343718157425528
Energy: 1.050482026552147
Energy: 0.8343718157425528
Energy: 1.0504820265535721
Energy: 0.83437181574184
Energy: 0.986189179412804
Energy: 1.1888924577427384
Energy: 0.9861891794120912
Energy: 1.1888924577406654
Energy: 0.9861891794120912
Energy: 1.188892457742026
Energy: 0.9889511243887089
Energy: 0.8822993492179296
Energy: 0.9889511243865706
Energy: 0.8822993492179296
Energy: 0.9889511243894213
Energy: 0.8822993492179296
Energy: 0.8488540064540198
Energy: 0.8321648890529395
Energy: 0.8488540064540198
Energy: 0.8321648890529395
Energy: 0.8488540064547325
Energy: 0.832164889053652
Energy: 0.9087735308380814
Energy: 0.8637902008231635
Energy: 0.9087735308366558
Energy: 0.8637902008217382
Energy: 0.9087735308402194
Energy: 0.8637902008231635
Energy: 0.8720344823465712
Energy: 0.9280945216424377
Energy: 0.8720344823451458
Energy: 0.9280945216445758
Energy: 0.8720344823451458
Energy: 0.9280945216388743
Energy: 0.868135707464634
Energy: 0.8154063218618904
Energy: 0.8681357074553689
Energy: 0.8154063218611778
Energy: 0.8681357074567942
Energy: 0.8154063218611778
Energy: 0.8753373525192722
Energy: 0.8124795653937178
Energy: 0.8753373525214102
Energy: 0.8124795653937178
Energy: 0.8753373525249738
Energy: 0.8124795653937178
Energy: 0.8464505571888206
Energy: 1.0927072911669307
Energy: 0.8464505571859696
Energy: 1.0927072911669307
Energy: 0.8464505571888206
Energy: 1.092707291166218
Energy: 0.9442274508643835
Energy: 1.0459765938066454
Energy: 0.9442274508665217
Energy: 1.0459765938066454
Energy: 0.9442274508622454
Energy: 1.0459765938066454
Energy: 0.8493733850061284
Energy: 0.837280220517624
Energy: 0.8493733850082663
Energy: 0.8372802205169112
Energy: 0.8493733850075538
Energy: 0.837280220517624
Energy: 0.8613603101511567
Energy: 0.8835203330577968
Energy: 0.8613603101483057
Energy: 0.8835203330577968
Energy: 0.8613603101490185
Energy: 0.8835203330577968
Energy: 0.9601743227086936
Energy: 1.150010101089855
Energy: 0.9601743227094064
Energy: 1.1500101010855788
Energy: 0.9601743227108318
Energy: 1.1500101010862915
Energy: 1.0524098115175216
Energy: 0.8374436936288815
Energy: 1.052409811518234
Energy: 0.8374436936288815
Energy: 1.052409811518234
Energy: 0.837443693627456
Energy: 0.9187493639202816
Energy: 0.8692127832623733
Energy: 0.9187493639174309
Energy: 0.8692127832637988
Energy: 0.9187493639181435
Energy: 0.8692127832630862
Energy: 0.8493785855834616
Energy: 0.8335993930202255
Energy: 0.8493785855834616
Energy: 0.8335993930195126
Energy: 0.8493785855834616
Energy: 0.8335993930195126
Energy: 1.2015248542403663
Energy: 1.0043293499686619
Energy: 1.2015248542396537
Energy: 1.004329349965811
Energy: 1.2015248542396537
Energy: 1.0043293499629604
Energy: 0.9869487045340615
Energy: 0.884033127056646
Energy: 0.9869487045347742
Energy: 0.884033127056646
Energy: 0.9869487045340615
Energy: 0.8840331270559334
Energy: 0.8494264848344206
Energy: 0.8651376790790865
Energy: 0.8494264848322823
Energy: 0.8651376790819374
Energy: 0.8494264848301443
Energy: 0.8651376790769485
Energy: 0.8408914619448344
Energy: 0.8611402135066242
Energy: 0.8408914619455473
Energy: 0.8611402135059114
Energy: 0.8408914619462599
Energy: 0.8611402135059114
Energy: 0.9002234643282729
Energy: 0.9373989922910853
Energy: 0.9002234643289857
Energy: 0.9373989922925106
Energy: 0.9002234643289857
Energy: 0.9373989922946487
Energy: 0.8686736399812854
Energy: 0.87296997359652
Energy: 0.8686736399862743
Energy: 0.8729699735979453
Energy: 0.8686736399812854
Energy: 0.8729699735950945
Energy: 0.8742428704270057
Energy: 0.8410445399810151
Energy: 0.8742428704255804
Energy: 0.8410445399810151
Energy: 0.8742428704270057
Energy: 0.8410445399810151
Energy: 0.8413810604028406
Energy: 1.0929777514478227
Energy: 0.8413810604007024
Energy: 1.0929777514456847
Energy: 0.8413810604021278
Energy: 1.0929777514463974
Energy: 1.325631906902166
Energy: 1.0509770513107735
Energy: 1.3256319069014533
Energy: 1.0509770513114862
Energy: 1.325631906902166
Energy: 1.0509770513107735

minimum gb energy = 0.8124795653937178 eV
minimum distance =  2.24154670554638 Angstroms
sigma value = 41


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

Energy: 1.0157736500285286
Energy: 0.9040683949257123
Energy: 1.015773650030214
Energy: 0.9040683949257123
Energy: 1.0157736500290904
Energy: 0.9040683949257123
Energy: 1.0072118389199525
Energy: 0.9290677358915199
Energy: 1.0072118389199525
Energy: 0.9290677358903965
Energy: 1.0072118389188291
Energy: 0.9290677358903965
Energy: 1.0167639906294046
Energy: 1.4370292600234749
Energy: 1.0167639906277195
Energy: 1.4370292600240369
Energy: 1.0167639906277195
Energy: 1.4370292600234749
Energy: 0.9832111561124436
Energy: 0.9027585148157404
Energy: 0.9832111561130055
Energy: 0.9027585148157404
Energy: 0.9832111561124436
Energy: 0.9027585148151785
Energy: 0.86155532959052
Energy: 0.931136355662321
Energy: 0.8615553295910817
Energy: 0.9311363556617593
Energy: 0.86155532959052
Energy: 0.931136355662321
Energy: 0.9805758919596542
Energy: 0.9515303283742115
Energy: 0.9805758919647097
Energy: 0.9515303283742115
Energy: 0.980575891961901
Energy: 0.9515303283742115
Energy: 0.9221606625078751
Energy: 1.0164436388474816
Energy: 0.9221606625078751
Energy: 1.0164436388413025
Energy: 0.9221606625084369
Energy: 1.016443638841864
Energy: 0.8930821221074439
Energy: 0.9024778659227062
Energy: 0.8930821221074439
Energy: 0.9024778659215827
Energy: 0.8930821221085673
Energy: 0.9024778659221445
Energy: 0.8714518271711528
Energy: 0.910460055575104
Energy: 0.871451827170591
Energy: 0.910460055575104
Energy: 0.8714518271700293
Energy: 0.910460055575104
Energy: 0.9877060294326651
Energy: 1.0171040514366334
Energy: 0.9877060294343503
Energy: 1.017104051439442
Energy: 0.9877060294332266
Energy: 1.0171040514366334
Energy: 0.9871618457649081
Energy: 1.180536230613819
Energy: 0.9871618457637845
Energy: 1.1805362306160658
Energy: 0.9871618457654697
Energy: 1.1805362306149423
Energy: 0.8694958176367303
Energy: 0.9133294989067048
Energy: 0.8694958176344834
Energy: 0.9133294989050196
Energy: 0.8694958176361686
Energy: 0.9133294989050196
Energy: 0.8897761894300559
Energy: 0.9046391790131403
Energy: 0.8897761894306175
Energy: 0.9046391790131403
Energy: 0.8897761894300559
Energy: 0.9046391790131403
Energy: 0.8629456480689998
Energy: 1.0405630129434162
Energy: 0.862945648068438
Energy: 1.0405630129422927
Energy: 0.862945648068438
Energy: 1.0405630129456631
Energy: 0.9869834428482056
Energy: 0.9522408379822795
Energy: 0.9869834428465203
Energy: 0.9522408379828413
Energy: 0.986983442847082
Energy: 0.9522408379834032
Energy: 0.8628437543766514
Energy: 0.9720546006281623
Energy: 0.8628437543760897
Energy: 0.9720546006276006
Energy: 0.862843754375528
Energy: 0.9720546006287241
Energy: 0.897176777749923
Energy: 0.9047946093836414
Energy: 0.8971767777493611
Energy: 0.9047946093836414
Energy: 0.8971767777487994
Energy: 0.9047946093836414
Energy: 0.9342409486632707
Energy: 1.2755712900992324
Energy: 0.9342409486638326
Energy: 1.2755712900981089
Energy: 0.9342409486638326
Energy: 1.2755712900992324
Energy: 1.0110310380721388
Energy: 0.9314647097725839
Energy: 1.0110310380721388
Energy: 0.931464709772022
Energy: 1.0110310380721388
Energy: 0.9314647097737073
Energy: 0.9869437876306871
Energy: 0.9972824622862343
Energy: 0.9869437876306871
Energy: 0.9220858967630452
Energy: 0.9869437876301254
Energy: 0.9220858967624836
Energy: 0.8708092736136847
Energy: 0.9306238343978969
Energy: 0.8708092736148083
Energy: 0.930623834397335
Energy: 0.870809273613123
Energy: 0.9306238343978969
Energy: 0.9546980343180956
Energy: 1.1067151684557552
Energy: 0.9546980343180956
Energy: 1.1067151684535084
Energy: 0.9546980343175338
Energy: 1.1067151684591257
Energy: 0.9839938566184492
Energy: 0.9013431521930736
Energy: 0.9839938566173259
Energy: 0.9013431521925118
Energy: 0.983993856619011
Energy: 0.9013431521925118
Energy: 0.8627895394785747
Energy: 1.0156262945647931
Energy: 0.8627895394791365
Energy: 0.942590974593341
Energy: 0.8627895394785747
Energy: 0.9425909745899707
Energy: 0.8669380862099975
Energy: 0.9511700810100429
Energy: 0.8669380862105592
Energy: 0.951170081011728
Energy: 0.8669380862105592
Energy: 0.9511700810083575
Energy: 0.9222126145653509
Energy: 1.055160315263516
Energy: 0.9222126145642275
Energy: 1.055160315263516
Energy: 0.9222126145647891
Energy: 1.0551603152629545
Energy: 0.8907795244084116
Energy: 0.9014130960537817
Energy: 0.8907795244089735
Energy: 0.9014130960537817
Energy: 0.8907795244084116
Energy: 0.9014130960532201
Energy: 0.8732341345209079
Energy: 0.9598116369812851
Energy: 0.8732341345209079
Energy: 0.9272888095822509
Energy: 0.8732341345197845
Energy: 0.9272888095856213
Energy: 0.9874072426338504
Energy: 0.9385075529326096
Energy: 0.987407242632727
Energy: 0.9385075529326096
Energy: 0.9874072426332886
Energy: 0.9385075529320478
Energy: 1.2569996148303166
Energy: 0.9777956068815185
Energy: 1.256999614829755
Energy: 0.9777956068826419
Energy: 1.2569996148308786
Energy: 0.9777956068826419
Energy: 0.8731487304840366
Energy: 0.9248541930106103
Energy: 0.8731487304840366
Energy: 0.9248541930106103
Energy: 0.8731487304845983
Energy: 0.924854193011172
Energy: 0.8913516388623808
Energy: 0.9033583475274615
Energy: 0.891351638860134
Energy: 0.9033583475274615
Energy: 0.891351638861819
Energy: 0.9033583475274615
Energy: 0.867441929887286
Energy: 0.9447756338838601
Energy: 0.867441929887286
Energy: 0.9447756338838601
Energy: 0.8674419298878477
Energy: 0.9447756338832984

minimum gb energy = 0.86155532959052 eV
minimum distance =  2.23948127406935 Angstroms
sigma value = 33


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

Energy: 1.0438445913439343
Energy: 0.9733946518035682
Energy: 0.9970935350174382
Energy: 0.9733946518031382
Energy: 1.0438445913431458
Energy: 0.9733946518019913
Energy: 1.1809558420571742
Energy: 0.9714978019707607
Energy: 1.1809558420595394
Energy: 0.971497801971119
Energy: 1.1809558420576045
Energy: 0.9714978019762799
Energy: 1.0854886042497311
Energy: 1.1110475079060347
Energy: 1.0854886042505196
Energy: 1.1110475079056048
Energy: 1.0854886042481544
Energy: 1.111047507902881
Energy: 1.040917029570982
Energy: 0.9749737712266089
Energy: 1.0409170295737058
Energy: 0.9749737712266089
Energy: 1.0409170295713404
Energy: 0.9749737712242436
Energy: 0.9681704882301434
Energy: 1.1243180295109594
Energy: 0.9681730148206592
Energy: 1.1243180295093824
Energy: 0.9681704882297133
Energy: 1.1243180295046518
Energy: 1.039008540747108
Energy: 0.9432311813587636
Energy: 1.039008540745531
Energy: 0.9432311813587636
Energy: 1.039008540747108
Energy: 0.9432311813587636
Energy: 1.0257447124493673
Energy: 1.1143960315301868
Energy: 1.0257447124470018
Energy: 1.1143960315298285
Energy: 1.0257447124490089
Energy: 1.1143960315372827
Energy: 1.0094347454192512
Energy: 1.0430731255431933
Energy: 1.009434745421258
Energy: 1.0430731255431933
Energy: 1.009434745418104
Energy: 1.0430731255424046
Energy: 1.1131069451720619
Energy: 1.0055309883108217
Energy: 1.1129638421816506
Energy: 1.0055309883100332
Energy: 1.1131069451720619
Energy: 1.005530988316341
Energy: 1.1154660076025151
Energy: 0.9874237934066655
Energy: 1.1154660075962077
Energy: 0.987423793407024
Energy: 1.1154660075899
Energy: 0.9874237934074539
Energy: 1.0646468521685901
Energy: 1.014465074667762
Energy: 1.0646468521666548
Energy: 1.0144650746685504
Energy: 1.0646468521682317
Energy: 1.014465074683531
Energy: 1.0990803408663248
Energy: 0.9747531652146014
Energy: 1.0990803408576517
Energy: 0.9747531652142432
Energy: 1.0990803408611642
Energy: 0.9747531652169668
Energy: 0.9416929539412005
Energy: 1.1145206838271902
Energy: 0.9416929539412005
Energy: 1.11452068382676
Energy: 0.9416929539407705
Energy: 1.114520683823248
Energy: 1.0388321012988126
Energy: 1.0597332346363812
Energy: 1.0388321013011779
Energy: 1.0597332346363812
Energy: 1.0388321012983825
Energy: 1.059733234638388
Energy: 1.040929272196702
Energy: 0.9796405235076073
Energy: 1.0409292721919714
Energy: 0.9796405235076073
Energy: 1.0409292721963435
Energy: 0.9796405235147034
Energy: 1.0000613580898678
Energy: 1.0397153603545592
Energy: 1.0000613580882909
Energy: 1.0397153603529823
Energy: 1.0000613580898678
Energy: 1.0397153603553477
Energy: 1.0529770618672911
Energy: 0.9683334846228908
Energy: 1.052977061868438
Energy: 0.9683334846225324
Energy: 1.0529770618703733
Energy: 0.968333484619737
Energy: 0.9812373879996759
Energy: 1.1074640614875073
Energy: 0.9812998674578619
Energy: 1.1074640614871492
Energy: 0.9812373880000341
Energy: 1.1074640614961806
Energy: 1.1173274795951678
Energy: 1.0619007243650755
Energy: 1.1173274795998986
Energy: 1.0619007243642873
Energy: 1.1173274795935908
Energy: 1.0619007243650755
Energy: 1.0930382113053374
Energy: 0.9447320153225786
Energy: 1.0930382112947292
Energy: 0.9447320153237253
Energy: 1.0930382113049792
Energy: 0.9447320153194247
Energy: 0.9734570750931644
Energy: 0.997266525014751
Energy: 0.9734570750955299
Energy: 0.997266525014751
Energy: 0.9734570750931644
Energy: 0.9972665250131741
Energy: 0.9770061508924048
Energy: 1.1319474993920953
Energy: 0.9769738904865474
Energy: 1.1319474993838523
Energy: 0.9770061508916164
Energy: 1.1319474993917369
Energy: 1.0408288032690869
Energy: 0.9681717441369437
Energy: 1.0408288032655746
Energy: 0.9681717441353669
Energy: 1.0408288032695168
Energy: 0.96817174413379
Energy: 0.9706605774670294
Energy: 1.0460102529089133
Energy: 0.9706605774670294
Energy: 1.0460102529089133
Energy: 0.9706605774674596
Energy: 1.0460102529203101
Energy: 1.1088760273863656
Energy: 0.968336712749152
Energy: 1.108876027384359
Energy: 0.9683367127487218
Energy: 1.1088760273859357
Energy: 0.9683367127515173
Energy: 0.9493349546982429
Energy: 1.0386544817329084
Energy: 0.9493349547018268
Energy: 1.0386544817340555
Energy: 0.9493349546982429
Energy: 1.038654481719505
Energy: 1.0837257128171536
Energy: 1.0249458540951497
Energy: 1.0837257128167235
Energy: 1.0249458540959382
Energy: 1.0837257128171536
Energy: 1.0249458540947916
Energy: 1.0466058134778857
Energy: 0.9752702441780394
Energy: 0.9990114504043699
Energy: 0.9752702441792578
Energy: 1.0466058134786742
Energy: 0.9752702441792578
Energy: 1.007856249483629
Energy: 1.1153227356483857
Energy: 1.0078562494848473
Energy: 1.1153227356523279
Energy: 1.0078562494828405
Energy: 1.1153227356483857
Energy: 0.9931528304216567
Energy: 1.1144838783412307
Energy: 0.9931528304248105
Energy: 1.114483878349474
Energy: 0.9931528304216567
Energy: 1.1144838783491153
Energy: 1.0061602632527684
Energy: 0.96936796972556
Energy: 1.00616026325198
Energy: 0.9693679697247716
Energy: 1.0061602632527684
Energy: 0.9693679697274954
Energy: 0.9704270748584669
Energy: 1.1213846960681115
Energy: 0.9704245046408659
Energy: 1.1213846960696885
Energy: 0.9704270748584669
Energy: 1.1213846960747775
Energy: 1.0918831862432463
Energy: 0.9394564710806412
Energy: 1.0918831862424578
Energy: 0.9394564710809995
Energy: 1.0918831862412393
Energy: 0.9394564710830066
Energy: 1.0616793188698554
Energy: 1.0384324500242261
Energy: 1.0616793188694966
Energy: 1.0384324500242261
Energy: 1.0616793188694966
Energy: 1.0384324500250146
Energy: 1.0133733061247336
Energy: 1.0383919780235829
Energy: 1.013373306139284
Energy: 1.0383919780240127
Energy: 1.0133733061270989
Energy: 1.0383919780224358
Energy: 1.0922977757567771
Energy: 0.9993827081339703
Energy: 1.0927278834223408
Energy: 0.9993827081344006
Energy: 1.0922977757559889
Energy: 0.9993827081257275
Energy: 0.9701850934776499
Energy: 1.0560002875234222
Energy: 0.9701850934748545
Energy: 1.0560002876294332
Energy: 0.9701850934776499
Energy: 1.0560002878291987
Energy: 1.0573767439102657
Energy: 0.9682798767144039
Energy: 1.0573767439114128
Energy: 0.9682798767148341
Energy: 1.0573767439098358
Energy: 0.9682798767077379
Energy: 1.0550721412650572
Energy: 1.114675589425523
Energy: 1.055072251125202
Energy: 1.114675589423946
Energy: 1.0550721412642687
Energy: 1.114675589415703
Energy: 0.948278094857606
Energy: 1.1133685881727289
Energy: 0.9482780948615482
Energy: 1.1133685881739475
Energy: 0.948278094858036
Energy: 1.1133685881755244
Energy: 0.998870382578483
Energy: 0.9741681704200926
Energy: 0.9988703825906682
Energy: 0.9741681704205225
Energy: 0.9988703825788413
Energy: 0.9741681704169387
Energy: 1.1287247406678287
Energy: 0.9776954131745845
Energy: 1.1287247406670402
Energy: 0.977695413175373
Energy: 1.128724740668187
Energy: 0.9776954131780967
Energy: 1.0095368477286564
Energy: 1.0386067120888476
Energy: 1.0095368477274378
Energy: 1.0386067120896358
Energy: 1.0095368477294446
Energy: 1.0386067120836866
Energy: 1.041042844332185
Energy: 0.9686279645722214
Energy: 1.0410428443089617
Energy: 0.9686279645722214
Energy: 1.0410428443231539
Energy: 0.9686279645753753
Energy: 0.9703249709705769
Energy: 1.1117896798688782
Energy: 0.9703247322471885
Energy: 1.1117896798684483
Energy: 0.9703249709697885
Energy: 1.1117896798739673
Energy: 1.040964602239138
Energy: 0.9694524754702827
Energy: 1.040964602235554
Energy: 0.9694524754726481
Energy: 1.0409646022394963
Energy: 0.9694524754754434
Energy: 0.9771581139754929
Energy: 1.1155704987083765
Energy: 0.9771581139766397
Energy: 1.1155704987079464
Energy: 0.9771581139758513
Energy: 1.1155704987079464

minimum gb energy = 0.9394564710806412 eV
minimum distance =  2.23859754243949 Angstroms
sigma value = 67


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

Energy: 1.011292827149272
Energy: 0.9756119628362656
Energy: 1.011292827149272
Energy: 0.9756119628336307
Energy: 1.011292827149272
Energy: 0.9756119628336307
Energy: 1.0038680201127659
Energy: 0.9594295905051294
Energy: 1.0038680201127659
Energy: 0.9594295905051294
Energy: 1.0038680201127659
Energy: 0.9594295905051294
Energy: 1.1988654108992303
Energy: 1.1776987980381126
Energy: 1.198865410870248
Energy: 1.1776987980381126
Energy: 1.0027447818970583
Energy: 1.1776987980381126
Energy: 1.0038611479148536
Energy: 0.9594513037234326
Energy: 1.0038611479148536
Energy: 0.9594513037234326
Energy: 1.0038611479148536
Energy: 0.9594513037234326
Energy: 1.0112928271466373
Energy: 0.9756119628336307
Energy: 1.0112928271466373
Energy: 0.9756119628336307
Energy: 1.0112928271466373
Energy: 0.9756119628336307
Energy: 1.0038680201127659
Energy: 0.9594295905024948
Energy: 1.0038680201127659
Energy: 0.9594295905024948
Energy: 1.0038680201127659
Energy: 0.9594295905024948
Energy: 1.0027447818970583
Energy: 1.1776987980381126
Energy: 1.0027447818970583
Energy: 1.1776987980381126
Energy: 1.0027447818970583
Energy: 1.1776987980381126

minimum gb energy = 0.9594295905024948 eV
minimum distance =  2.28323337149308 Angstroms
sigma value = 3


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

Energy: 1.2680343562220233
Energy: 1.130110828431438
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Energy: 1.1045338180975555
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Energy: 1.1740447831901584
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Energy: 1.174044783193744
Energy: 1.1429298020131924
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Energy: 1.0854374598661745
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Energy: 1.178515409335485
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Energy: 1.1529813125266855
Energy: 1.179412771775415
Energy: 1.1574465912881173
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Energy: 1.179412771775415
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Energy: 1.072319335154741
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Energy: 1.072319335154741
Energy: 1.1450337016692216
Energy: 1.0728709973636694
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Energy: 1.145033701665636
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Energy: 1.186368140713588
Energy: 1.1027296695710824
Energy: 1.1863681407171733
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Energy: 1.1863681407171733
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Energy: 1.1775123757830133
Energy: 1.097398523630024
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Energy: 1.0718996579934632
Energy: 1.1252650047354913
Energy: 1.144690612283851
Energy: 1.125265004731906
Energy: 1.144690612283851
Energy: 1.1252650047354913
Energy: 1.1446906122874363
Energy: 1.186112232631518
Energy: 1.1617712416431274
Energy: 1.1861122326279327
Energy: 1.1617712416431274
Energy: 1.1861122326171765
Energy: 1.1617712416431274
Energy: 1.1235011296142228
Energy: 1.149120105443712
Energy: 1.1235011296142228
Energy: 1.149120105443712
Energy: 1.1235011296142228
Energy: 1.149120105443712
Energy: 1.1527831971097642
Energy: 1.143507195313109
Energy: 1.1527831971061788
Energy: 1.143507195313109
Energy: 1.1527831971061788
Energy: 1.143507195313109
Energy: 1.082741460919081
Energy: 1.1795035328095482
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Energy: 1.1795035328095482
Energy: 1.0827414609154957
Energy: 1.179503532806028
Energy: 1.2810441580970875
Energy: 1.1181679195303313
Energy: 1.2810441580935021
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Energy: 1.2810441580970875
Energy: 1.1181679195303313
Energy: 1.06456119022506
Energy: 1.209592062053723
Energy: 1.06456119022506
Energy: 1.209592062053723
Energy: 1.06456119022506
Energy: 1.209592062053723
Energy: 1.1885099713684533
Energy: 1.1433967587504188
Energy: 1.1885099713684533
Energy: 1.1433967587540041
Energy: 1.1885099713684533
Energy: 1.1433967587504188
Energy: 1.0920144053824679
Energy: 1.1898279708052393
Energy: 1.0920144053788823
Energy: 1.1898279708052393
Energy: 1.0920144053788823
Energy: 1.1898279708088249
Energy: 1.2771180567391143
Energy: 1.0754576851078603
Energy: 1.2771180567355287
Energy: 1.0754576851078603
Energy: 1.2771180567391143
Energy: 1.0754576851078603
Energy: 1.1043446571892797
Energy: 1.2435869549054492
Energy: 1.1043446571856943
Energy: 1.2435869549054492
Energy: 1.1043446571856943
Energy: 1.2435869549054492
Energy: 1.1702199030018574
Energy: 1.071673929098038
Energy: 1.170219903005443
Energy: 1.071673929098038
Energy: 1.1702199030018574
Energy: 1.071673929098038
Energy: 1.1792217720451315
Energy: 1.1044382236032222
Energy: 1.1792217720451315
Energy: 1.1044382236068078
Energy: 1.179221772041546
Energy: 1.1044382236032222
Energy: 1.2100018676546622
Energy: 1.0712086895923738
Energy: 1.2100018676510766
Energy: 1.0712086895923738
Energy: 1.2100018676510766
Energy: 1.0712086895923738
Energy: 1.1466747433978772
Energy: 1.149925346335562
Energy: 1.1466747433978772
Energy: 1.149925346335562
Energy: 1.1466747433978772
Energy: 1.149925346335562
Energy: 1.1575382406455292
Energy: 1.1108833002189122
Energy: 1.1575382406455292
Energy: 1.1108833002189122
Energy: 1.1575382406455292
Energy: 1.1108833002189122
Energy: 1.0924157578183582
Energy: 1.1728766971888231
Energy: 1.0924157578183582
Energy: 1.1728766971888231
Energy: 1.0924157578147728
Energy: 1.1728766971888231
Energy: 1.1475375669405092
Energy: 1.1449855625109906
Energy: 1.1475375669369237
Energy: 1.1449855625109906
Energy: 1.1475375669369237
Energy: 1.1449855625109906
Energy: 1.1424238222987966
Energy: 1.1501291470451585
Energy: 1.1424238222952112
Energy: 1.1501291470451585
Energy: 1.1424238222987966
Energy: 1.1501291470451585

minimum gb energy = 1.06456119022506 eV
minimum distance =  2.20499748524191 Angstroms
sigma value = 81


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

Energy: 1.3688074201102094
Energy: 1.164685792482014
Energy: 1.3688074201107017
Energy: 1.164685792482014
Energy: 1.3688074201102094
Energy: 1.164685792481522
Energy: 1.068858011306365
Energy: 1.1136127068782449
Energy: 1.0688580113043966
Energy: 1.1136127068782449
Energy: 1.068858011305381
Energy: 1.1136127068782449
Energy: 1.0622604399306406
Energy: 1.044976258099675
Energy: 1.0622604399291644
Energy: 1.0449762580991828
Energy: 1.0622604399296565
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Energy: 1.1106084479226546
Energy: 1.0763454644804928
Energy: 1.1106084479221625
Energy: 1.076345464480985
Energy: 1.1106084479231466
Energy: 1.0763454644819692
Energy: 1.2403053232716343
Energy: 1.1495606299377317
Energy: 1.2403053232736028
Energy: 1.1495606299377317
Energy: 1.2403053232721264
Energy: 1.1495606299367476
Energy: 1.1118158776589464
Energy: 1.1630023418277247
Energy: 1.111815877657962
Energy: 1.1630023418272328
Energy: 1.1118158776594385
Energy: 1.1630023418277247
Energy: 1.0393769332650964
Energy: 1.1636682850049647
Energy: 1.0393769332665728
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Energy: 1.0393769332646043
Energy: 1.1636682850054565
Energy: 1.114055775253463
Energy: 1.108057088956304
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Energy: 1.1080570889558117
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Energy: 1.108057088956304
Energy: 1.1593462934486551
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Energy: 1.1618145631589454
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Energy: 1.210284218166595
Energy: 1.161814563157961
Energy: 1.2102842181690552
Energy: 1.1620753670453017
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Energy: 1.1620753670457937
Energy: 1.1589507449170573
Energy: 1.1665854506600175
Energy: 1.1472408109188499
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Energy: 1.147240810919342
Energy: 1.1665854506600175
Energy: 1.1472408109188499
Energy: 1.21697330669803
Energy: 1.1146779064134344
Energy: 1.2169733066970456
Energy: 1.1146779064129424
Energy: 1.2169733066970456
Energy: 1.1146779064134344
Energy: 1.157104793979733
Energy: 1.0447115906320141
Energy: 1.1571047939782568
Energy: 1.0447115906320141
Energy: 1.157104793979241
Energy: 1.044711590631522
Energy: 1.1837139190043204
Energy: 1.0403530429421193
Energy: 1.1837139190033361
Energy: 1.0403530429421193
Energy: 1.1837139190053045
Energy: 1.0403530429421193
Energy: 1.114330396863493
Energy: 1.048192476012626
Energy: 1.114330396863985
Energy: 1.0481924760131178
Energy: 1.114330396863493
Energy: 1.0481924760131178
Energy: 1.2068547143744068
Energy: 1.1619873640327254
Energy: 1.2068547143739148
Energy: 1.1619873640322333
Energy: 1.2068547143739148
Energy: 1.1619873640322333
Energy: 1.139792833837537
Energy: 1.3046150030549153
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Energy: 1.3046150030549153
Energy: 1.139792833837537
Energy: 1.3046150030549153
Energy: 1.0464115388929651
Energy: 1.0934135686367736
Energy: 1.0464115388919812
Energy: 1.0934135686367736
Energy: 1.0464115388919812
Energy: 1.0934135686367736
Energy: 1.0767705573241635
Energy: 1.196536349159906
Energy: 1.0767705573226871
Energy: 1.1965363491594136
Energy: 1.0767705573236714
Energy: 1.1965363491589216
Energy: 1.1405345637937132
Energy: 1.1146522805962795
Energy: 1.1405345637927289
Energy: 1.1146522805957872
Energy: 1.140534563793221
Energy: 1.1146522805962795
Energy: 1.1151796239738414
Energy: 1.155739399339687
Energy: 1.1151796239743332
Energy: 1.155739399339687
Energy: 1.1151796239733494
Energy: 1.155739399339687
Energy: 1.2080010692466465
Energy: 1.0182349845765133
Energy: 1.2080010692451704
Energy: 1.0182349845765133
Energy: 1.2080010692461547
Energy: 1.0182349845760212
Energy: 1.1070160437255678
Energy: 1.1148774150259622
Energy: 1.1070160437260599
Energy: 1.1148774150249778
Energy: 1.1070160437290124
Energy: 1.1148774150259622
Energy: 1.1572213993194196
Energy: 1.1342574164147703
Energy: 1.1572213993199116
Energy: 1.1342574164142782
Energy: 1.1572213993199116
Energy: 1.1342574164152623
Energy: 1.1821295850639033
Energy: 1.2660137016764423
Energy: 1.1821295850609508
Energy: 1.2660137016759505
Energy: 1.1821295850589824
Energy: 1.2660137016769346
Energy: 1.1387795985549882
Energy: 1.1107808651909077
Energy: 1.1387795985564646
Energy: 1.1107808651933684
Energy: 1.1387795985559725
Energy: 1.110780865186971
Energy: 1.180918923216203
Energy: 1.1615973121448688
Energy: 1.1809189232152189
Energy: 1.1615973121438847
Energy: 1.180918923217187
Energy: 1.1615973121448688
Energy: 1.1141660264769357
Energy: 1.0683008061641006
Energy: 1.1141660264769357
Energy: 1.0683008061645927
Energy: 1.1141660264769357
Energy: 1.0683008061645927
Energy: 1.0484446740707776
Energy: 1.0399364987832653
Energy: 1.0484446740712696
Energy: 1.039936498782773
Energy: 1.0484446740717617
Energy: 1.039936498782773
Energy: 1.0783596916739095
Energy: 1.1815716191334165
Energy: 1.0783596916744018
Energy: 1.1815716191339083
Energy: 1.0783596916734175
Energy: 1.1815716191339083
Energy: 1.1481277298264898
Energy: 1.1145750996535624
Energy: 1.148127729823045
Energy: 1.1145750996530703
Energy: 1.1481277298259975
Energy: 1.1145750996535624
Energy: 1.167527932696516
Energy: 1.163395257215346
Energy: 1.167527932697008
Energy: 1.1633952572182986
Energy: 1.167527932697008
Energy: 1.163395257218791
Energy: 1.166710201684211
Energy: 1.0366794485341992
Energy: 1.166710201683719
Energy: 1.0366794485337072
Energy: 1.166710201683719
Energy: 1.0366794485337072
Energy: 1.0817187357263232
Energy: 1.332098844559467
Energy: 1.081718735725831
Energy: 1.332098844558975
Energy: 1.081718735725339
Energy: 1.332098844559959
Energy: 1.2076449874724084
Energy: 1.076745180653018
Energy: 1.2076449874724084
Energy: 1.076745180652034
Energy: 1.2076449874729005
Energy: 1.076745180652034
Energy: 1.114315183900497
Energy: 1.048392064983597
Energy: 1.114315183900497
Energy: 1.048392064983597
Energy: 1.114315183900497
Energy: 1.048392064984089
Energy: 1.1566827540635363
Energy: 1.1180740395124318
Energy: 1.1566827540635363
Energy: 1.1180740395114475
Energy: 1.1566827540640283
Energy: 1.1180740395129238

minimum gb energy = 1.0182349845760212 eV
minimum distance =  2.30180152551877 Angstroms
sigma value = 43


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

Energy: 1.3181863332580075
Energy: 1.1421474169465693
Energy: 1.3181863332580075
Energy: 1.1421474169465693
Energy: 1.3181863332580075
Energy: 1.1421474169465693
Energy: 1.1274064273574544
Energy: 1.0548176026062275
Energy: 1.1274064273562456
Energy: 1.0548176026062275
Energy: 1.1274064273562456
Energy: 1.0548176026068317
Energy: 1.1770723996665586
Energy: 1.2636346761086934
Energy: 1.1770723996659542
Energy: 1.263634676108089
Energy: 1.1770723996659542
Energy: 1.2636346761086934
Energy: 1.0537478386698222
Energy: 1.0778022782372645
Energy: 1.0537478386704267
Energy: 1.0778022782372645
Energy: 1.0537478386698222
Energy: 1.0778022782372645
Energy: 1.1898149197492414
Energy: 1.120700535777919
Energy: 1.1898149197492414
Energy: 1.1207005357791278
Energy: 1.189814919749846
Energy: 1.120700535777919
Energy: 1.090690757576958
Energy: 1.134935758594245
Energy: 1.0906907575751443
Energy: 1.1349357585936404
Energy: 1.090690757575749
Energy: 1.1349357585948492
Energy: 1.1244181498804249
Energy: 1.1991439484721471
Energy: 1.1244181498804249
Energy: 1.1991439484721471
Energy: 1.1244181498804249
Energy: 1.1991439484721471
Energy: 1.0947744792645169
Energy: 1.1400670907020607
Energy: 1.0947744792645169
Energy: 1.1400670907026653
Energy: 1.0947744792651215
Energy: 1.1400670907020607
Energy: 1.223566819543681
Energy: 1.0318301027675354
Energy: 1.2235668195430764
Energy: 1.0318301027675354
Energy: 1.2235668195430764
Energy: 1.0318301027675354
Energy: 1.0739669327666186
Energy: 1.135750274558263
Energy: 1.0739669327672232
Energy: 1.1357502745576586
Energy: 1.0739669327666186
Energy: 1.1357502745576586
Energy: 1.0971282751778573
Energy: 1.0680825145693427
Energy: 1.0971282751784617
Energy: 1.0680825145681339
Energy: 1.0971282751778573
Energy: 1.0680825145687383
Energy: 1.0946279427737091
Energy: 1.1304244614252263
Energy: 1.0946279427731045
Energy: 1.130424461425831
Energy: 1.0946279427743133
Energy: 1.1304244614264352
Energy: 1.1963624888614606
Energy: 1.135458559928897
Energy: 1.1963624888608562
Energy: 1.135458559928897
Energy: 1.1963624888608562
Energy: 1.135458559928897
Energy: 1.0330868430504283
Energy: 1.1361274520994185
Energy: 1.0330868430498241
Energy: 1.136127452100023
Energy: 1.0330868430492195
Energy: 1.1361274520994185
Energy: 1.0962931741194235
Energy: 1.1220759188338916
Energy: 1.096293174120028
Energy: 1.1220759188338916
Energy: 1.096293174120028
Energy: 1.1220759188338916
Energy: 1.0980716203305483
Energy: 1.1597270440490646
Energy: 1.0980716203311527
Energy: 1.159727044049669
Energy: 1.0980716203311527
Energy: 1.159727044049669
Energy: 1.1586963421404253
Energy: 1.0561606453655068
Energy: 1.1586963421392165
Energy: 1.0561606453649026
Energy: 1.1586963421398209
Energy: 1.0561606453655068
Energy: 1.2069051999634601
Energy: 1.0942957785618346
Energy: 1.2069051999634601
Energy: 1.0942957785618346
Energy: 1.2069051999634601
Energy: 1.0942957785618346
Energy: 1.205902254247045
Energy: 1.0743170878650037
Energy: 1.205902254247045
Energy: 1.0743170878650037
Energy: 1.2059022542464408
Energy: 1.0743170878650037
Energy: 1.1585288305123005
Energy: 1.055039486098369
Energy: 1.1585288305129047
Energy: 1.0550394860989734
Energy: 1.1585288305140864
Energy: 1.055039486098369
Energy: 1.0978671032986207
Energy: 1.118814543570251
Energy: 1.0978671032986207
Energy: 1.118814543570251
Energy: 1.0978671032998295
Energy: 1.1188145435708554
Energy: 1.2135176363778557
Energy: 1.138252317450725
Energy: 1.2135176363778557
Energy: 1.1382523174513293
Energy: 1.2135176363778557
Energy: 1.1382523174513293
Energy: 1.033122976446788
Energy: 1.1482736969741656
Energy: 1.033122976447997
Energy: 1.148273696973561
Energy: 1.0331229764461836
Energy: 1.148273696973561
Energy: 1.1691524013892938
Energy: 1.1351828558756345
Energy: 1.1691524013874803
Energy: 1.1351828558762391
Energy: 1.169152401388085
Energy: 1.1351828558756345
Energy: 1.0943927992967062
Energy: 1.0778758966318325
Energy: 1.0943927992967062
Energy: 1.0778758966324369
Energy: 1.0943927992967062
Energy: 1.0778758966324369
Energy: 1.2132487684515154
Energy: 1.138411295415354
Energy: 1.2132487684533289
Energy: 1.138411295415354
Energy: 1.21324876845212
Energy: 1.1384112954159586
Energy: 1.1074138536711082
Energy: 1.0545270134619273
Energy: 1.1074138536717126
Energy: 1.0545270134619273
Energy: 1.1074138536717126
Energy: 1.0545270134619273
Energy: 1.1415327006050868
Energy: 1.0322518669351606
Energy: 1.1415327006050868
Energy: 1.032251866935765
Energy: 1.1415327006044824
Energy: 1.032251866935765
Energy: 1.0943261040732193
Energy: 1.146037632457484
Energy: 1.0943261040738235
Energy: 1.146037632457484
Energy: 1.0943261040738235
Energy: 1.146037632457484
Energy: 1.1364285608824003
Energy: 1.1606180609066004
Energy: 1.1364285608830047
Energy: 1.160618060907205
Energy: 1.1364285608830047
Energy: 1.160618060907205
Energy: 1.0910395925801826
Energy: 1.1350468933673796
Energy: 1.0910395925795782
Energy: 1.1350468933673796
Energy: 1.0910395925807872
Energy: 1.135046893367984

minimum gb energy = 1.0318301027675354 eV
minimum distance =  2.25516902954148 Angstroms
sigma value = 57


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

Energy: 1.2466661804955033
Energy: 1.0304330287301662
Energy: 1.2466661804947208
Energy: 1.0304330287301662
Energy: 1.2466661804947208
Energy: 1.0304330287309489
Energy: 1.076277114132467
Energy: 0.9753453582722051
Energy: 1.076277114132467
Energy: 0.9753453582729876
Energy: 1.0762771141332497
Energy: 0.9753453582722051
Energy: 1.121229846284045
Energy: 1.1935560132811385
Energy: 1.1212298462832622
Energy: 1.1935560132811385
Energy: 1.1212298462832622
Energy: 1.1935560132811385
Energy: 1.0836606227035608
Energy: 1.0990853302013004
Energy: 1.0836606227051262
Energy: 1.0990853302013004
Energy: 1.0836606227051262
Energy: 1.0990853302013004
Energy: 1.3136939108192374
Energy: 1.0966374478952359
Energy: 1.3136939108192374
Energy: 1.096637447894453
Energy: 1.3136939108192374
Energy: 1.096637447894453
Energy: 1.1547768795781608
Energy: 1.0367222646065435
Energy: 1.1547768795781608
Energy: 1.036722264604978
Energy: 1.1547768795781608
Energy: 1.0367222646057606
Energy: 1.0936803415934042
Energy: 1.163287353981319
Energy: 1.0936803415934042
Energy: 1.1632873539828843
Energy: 1.0936803415941867
Energy: 1.1632873539821018
Energy: 1.0851390528628697
Energy: 1.031291792298554
Energy: 1.0851390528636522
Energy: 1.031291792298554
Energy: 1.0851390528620872
Energy: 1.0312917922977711
Energy: 1.0938493293963412
Energy: 0.9760179413478854
Energy: 1.0938493293963412
Energy: 0.9760179413471027
Energy: 1.0938493293971239
Energy: 0.9760179413471027
Energy: 0.966699235337184
Energy: 1.07937145165096
Energy: 0.9666992353348361
Energy: 1.07937145165096
Energy: 0.9666992353364015
Energy: 1.07937145165096
Energy: 1.094681702982822
Energy: 1.097952506016083
Energy: 1.0946817029836047
Energy: 1.0979525060168656
Energy: 1.0946817029836047
Energy: 1.097952506016083
Energy: 1.0895993259536347
Energy: 1.1534837067155828
Energy: 1.0895993259528522
Energy: 1.1534837067148
Energy: 1.0895993259536347
Energy: 1.1534837067163655
Energy: 1.1016571754045232
Energy: 0.9758806338660507
Energy: 1.1016571754045232
Energy: 0.9758806338660507
Energy: 1.101657175405306
Energy: 0.975880633867616
Energy: 1.175451247403686
Energy: 0.9839385362686368
Energy: 1.1754512474044685
Energy: 0.9839385362686368
Energy: 1.1754512474029035
Energy: 0.9839385362694194
Energy: 1.0876977514490194
Energy: 0.9817491583410913
Energy: 1.0876977514529325
Energy: 0.9817491583410913
Energy: 1.0876977514490194
Energy: 0.9817491583403088
Energy: 1.1473187243741994
Energy: 1.1536363371412313
Energy: 1.1473187243741994
Energy: 1.1536363371412313
Energy: 1.1473187243749818
Energy: 1.1536363371412313
Energy: 0.9670283244693175
Energy: 1.0765271322961174
Energy: 0.9670283244693175
Energy: 1.0765271322961174
Energy: 0.9670283244693175
Energy: 1.0765271322953345
Energy: 1.0921919348764517
Energy: 0.9673007384415435
Energy: 1.092191934875669
Energy: 0.9673007384423261
Energy: 1.0921919348764517
Energy: 0.9673007384415435
Energy: 0.9671315237095284
Energy: 1.076505349401156
Energy: 0.9671315237079631
Energy: 1.076505349401156
Energy: 0.9671315237095284
Energy: 1.076505349401156
Energy: 1.1472706079111483
Energy: 1.153626246335969
Energy: 1.1472706079111483
Energy: 1.1536262463351865
Energy: 1.1472706079111483
Energy: 1.1536262463351865
Energy: 1.087567582604334
Energy: 0.9817701120966392
Energy: 1.0875675826027686
Energy: 0.9817701120982046
Energy: 1.0875675826051165
Energy: 0.9817701120974218
Energy: 1.1755438237869285
Energy: 1.0963195332335585
Energy: 1.1755438237869285
Energy: 1.0963195332327758
Energy: 1.1755438237861457
Energy: 1.0963195332335585
Energy: 1.1017158823815867
Energy: 0.9758930773107531
Energy: 1.1017158823808042
Energy: 0.9758930773107531
Energy: 1.1017158823815867
Energy: 0.9758930773107531
Energy: 1.08946274345432
Energy: 1.1533563096075519
Energy: 1.08946274345432
Energy: 1.1533563096098995
Energy: 1.0894627434527548
Energy: 1.153356309609117

minimum gb energy = 0.9666992353348361 eV
minimum distance =  2.27430955905963 Angstroms
sigma value = 17


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

Energy: 1.1091990471765438
Energy: 0.9910856363129723
Energy: 1.1091990471776507
Energy: 0.9910856363129723
Energy: 1.1091990471765438
Energy: 0.9910856363129723
Energy: 0.943522890807276
Energy: 0.9347361963302494
Energy: 0.943522890807276
Energy: 0.9347361963302494
Energy: 0.943522890807276
Energy: 0.9347361963302494
Energy: 1.1208071204643737
Energy: 1.105102761434848
Energy: 1.1208071204643737
Energy: 1.105102761434848
Energy: 1.1208071204643737
Energy: 1.105102761434848
Energy: 0.8839674811939103
Energy: 1.0656587620937636
Energy: 0.8839674811961239
Energy: 1.0656587620948705
Energy: 0.8839674811950172
Energy: 1.0656587620937636
Energy: 1.0829284988788819
Energy: 1.0242019505388844
Energy: 1.0829284988777752
Energy: 1.024201950539991
Energy: 1.0829284988788819
Energy: 1.0242019505388844
Energy: 0.9815809663626003
Energy: 1.0605665955223418
Energy: 0.9815809663614935
Energy: 1.0605665955223418
Energy: 0.9815809663614935
Energy: 1.0605665955223418
Energy: 1.0575029007603853
Energy: 0.9395851049924866
Energy: 1.0575029007603853
Energy: 0.9395851049924866
Energy: 1.0575029007603853
Energy: 0.9395851049924866
Energy: 0.8839934278589369
Energy: 1.0822494892115713
Energy: 0.8839934278600438
Energy: 1.0822494892115713
Energy: 0.8839934278589369
Energy: 1.0822494892126782
Energy: 1.0265963245341672
Energy: 0.9346370981676341
Energy: 1.0265963245352738
Energy: 0.9346370981687409
Energy: 1.0265963245341672
Energy: 0.9346370981676341
Energy: 1.0037394597338314
Energy: 0.9457998976150348
Energy: 1.0037394597338314
Energy: 0.9457998976161417
Energy: 1.0037394597338314
Energy: 0.9457998976161417
Energy: 0.9875883328566601
Energy: 1.0612360249423207
Energy: 0.9875883328555534
Energy: 1.0612360249423207
Energy: 0.9875883328566601
Energy: 1.0612360249412138
Energy: 1.0465013655966704
Energy: 0.9338430710848431
Energy: 1.0465013655966704
Energy: 0.9338430710848431
Energy: 1.0465013655977773
Energy: 0.9338430710848431
Energy: 0.8838587537042577
Energy: 1.0580157282542169
Energy: 0.8838587537053645
Energy: 1.0580157282542169
Energy: 0.8838587537042577
Energy: 1.0580157282542169
Energy: 1.0032568121160452
Energy: 1.0343662427361837
Energy: 1.0032568121160452
Energy: 1.0343662427361837
Energy: 1.0032568121160452
Energy: 1.0343662427361837
Energy: 0.9805299845755329
Energy: 1.1687628729432238
Energy: 0.9805299845766396
Energy: 1.1687628729432238
Energy: 0.980529984574426
Energy: 1.1687628729432238
Energy: 0.9810597245174462
Energy: 0.9340063944078958
Energy: 0.9810597245163395
Energy: 0.9340063944078958
Energy: 0.9810597245174462
Energy: 0.9340063944101095
Energy: 1.0010184643273234
Energy: 1.0349539571519404
Energy: 1.0010184643273234
Energy: 1.0349539571508335
Energy: 1.0010184643273234
Energy: 1.0349539571519404

minimum gb energy = 0.8838587537042577 eV
minimum distance =  2.25645283572555 Angstroms
sigma value = 17


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

Energy: 1.024084127806356
Energy: 0.911372135447343
Energy: 1.0240841278059283
Energy: 0.911372135447343
Energy: 1.0240841278055008
Energy: 0.911372135447343
Energy: 0.9115945843885491
Energy: 0.8887267581752573
Energy: 0.9115945843919685
Energy: 0.8887267581765395
Energy: 0.9115945843881217
Energy: 0.8887267581752573
Energy: 0.9949763679157732
Energy: 0.9516720461319296
Energy: 0.994976367912354
Energy: 0.9516720461319296
Energy: 0.9949763679144911
Energy: 0.9516720461319296
Energy: 0.8411507629409678
Energy: 0.9722233129485317
Energy: 0.8411507629405405
Energy: 0.9722256505497211
Energy: 0.8411507629418224
Energy: 0.9722233129502411
Energy: 0.915642258718386
Energy: 0.8676341656658483
Energy: 0.9156422587179588
Energy: 0.8676341656645661
Energy: 0.9156422587179588
Energy: 0.8676341656649935
Energy: 0.9390038861046225
Energy: 0.9161298392814041
Energy: 0.9390038861071869
Energy: 0.9161298392805494
Energy: 0.939003886104195
Energy: 0.9161298392818314
Energy: 0.9135044390241835
Energy: 0.8919425296823494
Energy: 0.9135044390262818
Energy: 0.891942529681922
Energy: 0.9135044390241835
Energy: 0.891942529681922
Energy: 0.910537960927392
Energy: 1.0094461133014654
Energy: 0.9105379609231179
Energy: 1.0094461133006103
Energy: 0.9105379609295291
Energy: 1.0094461133006103
Energy: 0.9325903968658386
Energy: 0.9646158510177938
Energy: 0.9325903968658386
Energy: 0.9646158510173664
Energy: 0.9325903968666933
Energy: 0.9646158510173664
Energy: 0.916145313562989
Energy: 0.8241517409016698
Energy: 0.9161453135646986
Energy: 0.8241517409016698
Energy: 0.9161453135621341
Energy: 0.8241517409012423
Energy: 0.8405558603214413
Energy: 0.9836584589192634
Energy: 0.8405558603210139
Energy: 0.9836584589166989
Energy: 0.8405558603222961
Energy: 0.9836584589226828
Energy: 0.9869401083599519
Energy: 0.8903334896396656
Energy: 0.9869401083595244
Energy: 0.8903334896400931
Energy: 0.9869401083599519
Energy: 0.8903334896418026
Energy: 0.9331716130957239
Energy: 0.8942173461689256
Energy: 0.9331716130965787
Energy: 0.8942173461684981
Energy: 0.9331716130970061
Energy: 0.8942173461689256
Energy: 0.9159563280663056
Energy: 0.9926885274136277
Energy: 0.9159563280663056
Energy: 0.9926885274144824
Energy: 0.9159563280645959
Energy: 0.9926885274144824
Energy: 0.966755936474943
Energy: 0.8890679763614284
Energy: 0.9667559364732333
Energy: 0.8890679763614284
Energy: 0.9667559364757977
Energy: 0.8890679763618559
Energy: 0.8397765933343393
Energy: 0.9506247572966235
Energy: 0.8397765933313863
Energy: 0.9506247572970511
Energy: 0.8397765933334844
Energy: 0.9506247572966235
Energy: 0.9323705390815371
Energy: 0.9307944756211886
Energy: 0.9323705390802548
Energy: 0.9307944756207612
Energy: 0.9323705390806822
Energy: 0.9307944756207612
Energy: 0.9467811852240484
Energy: 1.1228154521107314
Energy: 0.9467811852236211
Energy: 1.1228154521107314
Energy: 0.9467811852231935
Energy: 1.1228154521111589
Energy: 0.9106518534973109
Energy: 0.9517094326287154
Energy: 0.9106518534968836
Energy: 0.9517094326287154
Energy: 0.9106518534977385
Energy: 0.9517094326252961
Energy: 0.9308860005379479
Energy: 0.8224031739223153
Energy: 0.9308860005388028
Energy: 0.8224031739218881
Energy: 0.9308860005379479
Energy: 0.8224031739223153
Energy: 0.9107844091577952
Energy: 0.9519148635160273
Energy: 0.9107844091616418
Energy: 0.9519148635194465
Energy: 0.9107844091582226
Energy: 0.9519148635108984
Energy: 0.946931212007943
Energy: 1.122792580160724
Energy: 0.9469312120096526
Energy: 1.1227925801611511
Energy: 0.9469312120062332
Energy: 1.122792580160724
Energy: 0.9321682155247342
Energy: 0.9305719429876746
Energy: 0.9321682155247342
Energy: 0.9305719429868199
Energy: 0.9321682155247342
Energy: 0.9305719429872473
Energy: 0.8396053276915385
Energy: 1.0109798159054642
Energy: 0.8396053276953853
Energy: 1.0109798159046095
Energy: 0.8396053276898289
Energy: 1.010979815905037
Energy: 0.9667270437768394
Energy: 0.8891193834855798
Energy: 0.9667270437751296
Energy: 0.8891193834855798
Energy: 0.9667270437759846
Energy: 0.8891193834855798
Energy: 0.9158259413146719
Energy: 0.9926367695655951
Energy: 0.9158259413172364
Energy: 0.9926367695655951
Energy: 0.9158259413146719
Energy: 0.9926367695655951
Energy: 0.9331504897780843
Energy: 0.8941187887493942
Energy: 0.933150489779794
Energy: 0.894118788748112
Energy: 0.9331504897789391
Energy: 0.8941187887502491
Energy: 0.9869859503283394
Energy: 0.890000603049227
Energy: 0.9869859503296217
Energy: 0.890000603049227
Energy: 0.9869859503287669
Energy: 0.8900006030496543
Energy: 0.8404742071306724
Energy: 0.9836937073585403
Energy: 0.8404742071328095
Energy: 0.9836937073615323
Energy: 0.8404742071302451
Energy: 0.9836937073542662
Energy: 0.9159186635210641
Energy: 0.8241337237097437
Energy: 0.9159186635202093
Energy: 0.8241337237097437
Energy: 0.9159186635206368
Energy: 0.8241337237097437
Energy: 0.9330964403688555
Energy: 0.9646531734508748
Energy: 0.9330964403692829
Energy: 0.9646531734487377
Energy: 0.9330964403697103
Energy: 0.9646531734500198
Energy: 0.9109079080122573
Energy: 1.0095093564075386
Energy: 0.9109079080105477
Energy: 1.0095093564075386
Energy: 0.9109079080143945
Energy: 1.0095093564071111
Energy: 0.9116501105565048
Energy: 0.8918845680683295
Energy: 0.9116501105565048
Energy: 0.8918845680687568
Energy: 0.9116501105565048
Energy: 0.8918845680687568
Energy: 0.9390350584030045
Energy: 0.8833403994171221
Energy: 0.939035058403432
Energy: 0.8833403994166946
Energy: 0.9390350584025772
Energy: 0.8833403994162672
Energy: 0.9153065113398742
Energy: 0.8675535489339093
Energy: 0.915306511345858
Energy: 0.8675535489343368
Energy: 0.9153065113420114
Energy: 0.8675535489330545
Energy: 0.8410620779933766
Energy: 0.9496567287671964
Energy: 0.8410620779903847
Energy: 0.9496567287667689
Energy: 0.8410620779920943
Energy: 0.9496567287659141
Energy: 0.9951829871281498
Energy: 0.9519358776694581
Energy: 0.9951829871290047
Energy: 0.9519358776698856
Energy: 0.995182987127295
Energy: 0.9519358776698856
Energy: 0.9114721268187814
Energy: 0.8671532997963338
Energy: 0.9114721268183542
Energy: 0.8671532997963338
Energy: 0.9114721268183542
Energy: 0.8671532997967611
Energy: 1.0240841278037913
Energy: 0.9113721354456333
Energy: 1.024084127804646
Energy: 0.9113721354447785
Energy: 1.0240841278050736
Energy: 0.9113721354460607
Energy: 0.9115945843868395
Energy: 0.8754768511960712
Energy: 0.911594584389404
Energy: 0.8754768511956438
Energy: 0.9115945843881217
Energy: 0.8754768511960712
Energy: 0.9949763679149184
Energy: 0.951672046127228
Energy: 0.9949763679140635
Energy: 0.9516720461263731
Energy: 0.9949763679149184
Energy: 0.9516720461263731
Energy: 0.841150762940113
Energy: 0.9301818208577316
Energy: 0.84115076294225
Energy: 0.9301818208590139
Energy: 0.841150762940113
Energy: 0.9301818208598687
Energy: 0.9156422587200956
Energy: 0.8676341656679853
Energy: 0.9156422587192408
Energy: 0.8676341656679853
Energy: 0.9156422587175312
Energy: 0.867634165667558

minimum gb energy = 0.8224031739218881 eV
minimum distance =  2.29630223527902 Angstroms
sigma value = 57


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

Energy: 0.9559019113738577
Energy: 0.854348260590768
Energy: 0.9559019113745535
Energy: 0.8543482605900721
Energy: 0.9559019113752496
Energy: 0.854348260590768
Energy: 0.8495480928825075
Energy: 0.8191308394940021
Energy: 0.8495480928818117
Energy: 0.8191308394940021
Energy: 0.8495480928818117
Energy: 0.8191308394933061
Energy: 0.9620110299812392
Energy: 0.9008257073100314
Energy: 0.9620110299840231
Energy: 0.9008257073100314
Energy: 0.962011029983327
Energy: 0.9008257073107272
Energy: 0.8057887982670114
Energy: 0.899847838605346
Energy: 0.8057887982677074
Energy: 0.899847838605346
Energy: 0.8057887982663156
Energy: 0.8998478386067379
Energy: 0.8487393836139134
Energy: 0.7775198276427281
Energy: 0.8487393836173931
Energy: 0.7775198276455118
Energy: 0.8487393836153052
Energy: 0.777519827643424
Energy: 0.8991646126019374
Energy: 0.8349604802969298
Energy: 0.8991646125998496
Energy: 0.8349604802962339
Energy: 0.8991646126005456
Energy: 0.8349604802962339
Energy: 0.7994641365026465
Energy: 0.8742809803422351
Energy: 0.7994641365026465
Energy: 0.8742809803443229
Energy: 0.7994641365019505
Energy: 0.8742809803436271
Energy: 0.9232365898538496
Energy: 0.8539837764604159
Energy: 0.9232365898475863
Energy: 0.8539837764673751
Energy: 0.9232365898531537
Energy: 0.85398377645972
Energy: 0.8288849719000735
Energy: 0.8373052872153183
Energy: 0.8288849719021614
Energy: 0.837305287216014
Energy: 0.8288849719021614
Energy: 0.8373052872181019
Energy: 0.858409374356161
Energy: 0.8424507076986817
Energy: 0.8584093743547693
Energy: 0.8424507076993775
Energy: 0.858409374356161
Energy: 0.8424507076986817
Energy: 0.7927025564143793
Energy: 0.9469035233424486
Energy: 0.7927025564129874
Energy: 0.9469035233424486
Energy: 0.7927025564129874
Energy: 0.9469035233424486
Energy: 0.863177053922726
Energy: 0.8003775927636425
Energy: 0.863177053922726
Energy: 0.8003775927650343
Energy: 0.863177053922726
Energy: 0.8003775927643383
Energy: 0.8549519117701456
Energy: 0.9537655873950206
Energy: 0.8549519117694495
Energy: 0.9537655873943247
Energy: 0.8549519117680577
Energy: 0.9537655873943247
Energy: 0.8042879608707282
Energy: 0.8983278692284384
Energy: 0.8042879608700324
Energy: 0.8983278692270464
Energy: 0.8042879608693364
Energy: 0.8983278692291343
Energy: 0.9254098742014706
Energy: 0.8463485066364331
Energy: 0.9254098742000788
Energy: 0.8463485066364331
Energy: 0.9254098742007747
Energy: 0.8463485066357372
Energy: 0.8525749807217617
Energy: 0.8491200503349812
Energy: 0.852574980727329
Energy: 0.8491200503363731
Energy: 0.8525749807252412
Energy: 0.8491200503349812
Energy: 0.8607499726524742
Energy: 0.9568502755005006
Energy: 0.8607499726510824
Energy: 0.9568502755005006
Energy: 0.8607499726524742
Energy: 0.9568502755005006
Energy: 0.8967749072724143
Energy: 0.8503259303981898
Energy: 0.8967749072751978
Energy: 0.8503259303988858
Energy: 0.8967749072745022
Energy: 0.8503259303981898
Energy: 0.8041096101051811
Energy: 0.9081387042703107
Energy: 0.8041096101058772
Energy: 0.9081387042668942
Energy: 0.8041096101058772
Energy: 0.9081387042606309
Energy: 0.8042078666342299
Energy: 0.9017328592043165
Energy: 0.8042078666349256
Energy: 0.9017328592043165
Energy: 0.8042078666342299
Energy: 0.9017328592050123
Energy: 0.8855702782221384
Energy: 0.91787157479408
Energy: 0.8855702782235302
Energy: 0.917871574793384
Energy: 0.8855702782256181
Energy: 0.9178715747954718
Energy: 0.7925368200962043
Energy: 1.0026121368323226
Energy: 0.7925368200969003
Energy: 1.0026121368392817
Energy: 0.7925368200955085
Energy: 1.0026121368337146
Energy: 0.8757429391635324
Energy: 0.858846731448497
Energy: 0.8757429391621406
Energy: 0.8588467314471051
Energy: 0.8757429391621406
Energy: 0.858846731448497
Energy: 0.8546633891585997
Energy: 0.9102753077687739
Energy: 0.8546633891641672
Energy: 0.9102753077687739
Energy: 0.8546633891634713
Energy: 0.9102753077687739
Energy: 0.8545974690396655
Energy: 1.0661255037716297
Energy: 0.8545974690375777
Energy: 1.0661255037716297
Energy: 0.8545974690396655
Energy: 1.0661255037716297
Energy: 0.851145300212088
Energy: 0.8586411861677825
Energy: 0.851145300212088
Energy: 0.8586411861677825
Energy: 0.8511453002100003
Energy: 0.8586411861677825
Energy: 0.792069770761637
Energy: 0.9082504225660168
Energy: 0.7920697707665085
Energy: 0.9082504225646248
Energy: 0.7920697707644206
Energy: 0.908250422563929

minimum gb energy = 0.7775198276427281 eV
minimum distance =  2.25850263807298 Angstroms
sigma value = 43


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

Energy: 0.8273954833618005
Energy: 0.79622002155949
Energy: 0.8273954833612935
Energy: 0.79622002155949
Energy: 0.8273954833623075
Energy: 0.79622002155949
Energy: 0.8526158447824472
Energy: 0.7718581306769181
Energy: 0.8526158447844754
Energy: 0.7718581306769181
Energy: 0.8526158447844754
Energy: 0.771858130677425
Energy: 0.861499964592955
Energy: 0.8440404488544235
Energy: 0.8360367613987313
Energy: 0.8440404488544235
Energy: 0.8614999645924479
Energy: 0.8440404488549306
Energy: 0.8041975959749662
Energy: 0.8080375856477643
Energy: 0.8041975959790227
Energy: 0.8080375856472573
Energy: 0.8041975959749662
Energy: 0.8080375856482712
Energy: 0.8461614500845355
Energy: 0.7236211270258973
Energy: 0.8461614500840285
Energy: 0.7236211270253903
Energy: 0.8461614500835213
Energy: 0.7236211270253903
Energy: 0.8041521824178107
Energy: 0.7737930283657732
Energy: 0.8041521824183179
Energy: 0.7737930283657732
Energy: 0.804152182419332
Energy: 0.7737930283662803
Energy: 0.7311045662355911
Energy: 0.7855219565172955
Energy: 0.7311045662350839
Energy: 0.7855219565172955
Energy: 0.731104566234577
Energy: 0.7855219565167885
Energy: 0.8464887053164318
Energy: 0.7004528240791402
Energy: 0.8464887053164318
Energy: 0.7004528240786331
Energy: 0.8464887053149105
Energy: 0.7004528240786331
Energy: 0.7555401815075501
Energy: 0.7658056727858945
Energy: 0.7555401815075501
Energy: 0.7658056727864015
Energy: 0.755540181507043
Energy: 0.7658056727858945
Energy: 0.8525969882437452
Energy: 0.7479231842629354
Energy: 0.8525969882437452
Energy: 0.7479231842629354
Energy: 0.8525969882442522
Energy: 0.7479231842634426
Energy: 0.9154171795792154
Energy: 0.7404320878144189
Energy: 0.9154171795792154
Energy: 0.7404320878113766
Energy: 0.9154171795776943
Energy: 0.7404320878149259
Energy: 0.726790681015358
Energy: 0.7637146184366835
Energy: 0.726790681015358
Energy: 0.7637146184366835
Energy: 0.726790681014851
Energy: 0.7637146184361766
Energy: 0.8517356417377437
Energy: 0.714614630232176
Energy: 0.8517356417387577
Energy: 0.714614630231669
Energy: 0.8517356417377437
Energy: 0.714614630232176
Energy: 0.9126469047371822
Energy: 0.7609407747227176
Energy: 0.9126469047371822
Energy: 0.7609407747206893
Energy: 0.9126469047366753
Energy: 0.7609407747227176
Energy: 0.7435477710309899
Energy: 0.7631184058693111
Energy: 0.7435477710304829
Energy: 0.7631184058688041
Energy: 0.7435477710309899
Energy: 0.7631184058693111
Energy: 0.8046320570875682
Energy: 0.7891223698549158
Energy: 0.8046320570885822
Energy: 0.7891223698554228
Energy: 0.8046320570885822
Energy: 0.7891223698544088
Energy: 0.7295226737090328
Energy: 0.8247555522262702
Energy: 0.7295226737120751
Energy: 0.8247555522262702
Energy: 0.7295226737100469
Energy: 0.824755552225763
Energy: 0.7693609190962408
Energy: 0.7232627812078612
Energy: 0.7693609190962408
Energy: 0.7232627812088753
Energy: 0.7693609190957338
Energy: 0.7232627812078612
Energy: 0.7589583819853757
Energy: 0.8463138297007312
Energy: 0.7589583819858827
Energy: 0.8463138297007312
Energy: 0.7589583819858827
Energy: 0.846313829700224
Energy: 0.7658582873982839
Energy: 0.8295358436435656
Energy: 0.7658582873972698
Energy: 0.8295358436430587
Energy: 0.7658582873982839
Energy: 0.8295358436435656
Energy: 0.8287817765938857
Energy: 0.7720031873544138
Energy: 0.8287817765923647
Energy: 0.7720031873549208
Energy: 0.8287817765938857
Energy: 0.7720031873544138
Energy: 0.8066111885454785
Energy: 0.8452432034980938
Energy: 0.8066111885454785
Energy: 0.8452432034975867
Energy: 0.8066111885454785
Energy: 0.8452432034986009
Energy: 0.7921025645916268
Energy: 0.8471395698756119
Energy: 0.792102564592641
Energy: 0.8471395698756119
Energy: 0.7921025645921339
Energy: 0.8471395698751049
Energy: 0.8137418920827717
Energy: 0.7716632374796863
Energy: 0.8137418920832789
Energy: 0.7716632374791794
Energy: 0.8137418920837858
Energy: 0.7716632374771512
Energy: 0.7300437852720748
Energy: 0.753200027953544
Energy: 0.7300437852735959
Energy: 0.753200027953544
Energy: 0.7300437852725818
Energy: 0.7532000279540512
Energy: 0.7297003893312619
Energy: 0.8092471022781648
Energy: 0.729700389331769
Energy: 0.8092471022781648
Energy: 0.729700389332276
Energy: 0.8092471022786718
Energy: 0.7964186324407727
Energy: 0.7518755250131424
Energy: 0.7964186324412798
Energy: 0.7518755250131424
Energy: 0.7964186324417868
Energy: 0.7518755250131424
Energy: 0.6934219860242921
Energy: 0.823747982980824
Energy: 0.6934219860242921
Energy: 0.823747982980317
Energy: 0.6934219860247991
Energy: 0.823747982981331
Energy: 0.7559328652993829
Energy: 0.7599340876786117
Energy: 0.75593286529989
Energy: 0.7599340876786117
Energy: 0.755932865300397
Energy: 0.7599340876786117
Energy: 0.7435998093711653
Energy: 0.700215622303952
Energy: 0.7435998093711653
Energy: 0.7002156223024306
Energy: 0.7435998093726867
Energy: 0.7002156223034448
Energy: 0.781390859487145
Energy: 0.8216104561393007
Energy: 0.781390859487145
Energy: 0.8216104561387938
Energy: 0.7005851847438771
Energy: 0.8216104561387938
Energy: 0.7564381708871183
Energy: 0.7343077921785972
Energy: 0.7564381708866111
Energy: 0.7343077921780902
Energy: 0.7564381708866111
Energy: 0.7343077921785972
Energy: 0.722190163834166
Energy: 0.8263296766222747
Energy: 0.722190163834166
Energy: 0.826329676623796
Energy: 0.7221901638351341
Energy: 0.8263296766227818
Energy: 0.9122988525365546
Energy: 0.7431757609926622
Energy: 0.9122988525360476
Energy: 0.7431757609931693
Energy: 0.9122988525365546
Energy: 0.7431757609951974
Energy: 0.7868509652416039
Energy: 0.7180226687141669
Energy: 0.7868509652416039
Energy: 0.7180226687136598
Energy: 0.7868509652421111
Energy: 0.7180226687141669
Energy: 0.6797691982279617
Energy: 0.8249757422991272
Energy: 0.6797691982289759
Energy: 0.8249757423021696
Energy: 0.6797691982294828
Energy: 0.8249757422986203

minimum gb energy = 0.6797691982279617 eV
minimum distance =  2.22929558292608 Angstroms
sigma value = 81


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

Energy: 0.4698176360031152
Energy: 0.5179540180086757
Energy: 0.1433058019840872
Energy: 0.5179540180086757
Energy: 0.4698176360031152
Energy: 0.5179540180086757
Energy: 0.9848897279456181
Energy: 0.1446833240995509
Energy: 0.9848897279437552
Energy: 0.1446833240995509
Energy: 0.9848897279456181
Energy: 0.1446833240995509
Energy: 0.5219738336441359
Energy: 0.14374083233166238
Energy: 0.5219738336441359
Energy: 0.14374083233166238
Energy: 0.5219738336441359
Energy: 0.14374083232979934
Energy: 0.1433058019840872
Energy: 0.5179540180086757
Energy: 0.14330580198222415
Energy: 0.5179540180086757
Energy: 0.14330580198222415
Energy: 0.5179540180086757
Energy: 0.9848897279437552
Energy: 0.1446833240995509
Energy: 0.9848897279456181
Energy: 0.1446833240995509
Energy: 0.9848897279437552
Energy: 0.14468332410141396
Energy: 0.5219738336441359
Energy: 0.14374083233166238
Energy: 0.5219738336441359
Energy: 0.14374083232979934
Energy: 0.5219738336441359
Energy: 0.14374083233166238
Energy: 0.46981763600497833
Energy: 0.5179540180105386
Energy: 0.14330580198222415
Energy: 0.5179540180105386
Energy: 0.46981763600497833
Energy: 0.5179540180105386
Energy: 0.9848897279437552
Energy: 0.14468332410141396
Energy: 0.9848897279456181
Energy: 0.14468332410141396
Energy: 0.9848897279456181
Energy: 0.144683324103277
Energy: 0.5219738336459989
Energy: 0.14374083233166238
Energy: 0.5219738336459989
Energy: 0.14374083233166238
Energy: 0.5219738336459989
Energy: 0.14374083233166238
Energy: 0.1433058019840872
Energy: 0.5179540180105386
Energy: 0.14330580198222415
Energy: 0.5179540180105386
Energy: 0.14330580198222415
Energy: 0.5179540180124017

minimum gb energy = 0.14330580198222415 eV
minimum distance =  2.40931264499134 Angstroms
sigma value = 3


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

Energy: 0.963085490621543
Energy: 0.800225883659586
Energy: 0.9630854906209855
Energy: 0.8002258836601435
Energy: 0.9630854906204279
Energy: 0.8002258836601435
Energy: 0.7235723741517937
Energy: 0.7254158246177008
Energy: 0.7235723741512361
Energy: 0.7254158246171434
Energy: 0.7235723741512361
Energy: 0.7254158246160284
Energy: 0.8230392706800254
Energy: 0.7251296902038029
Energy: 0.8230392706805829
Energy: 0.7251296902032455
Energy: 0.8230392706800254
Energy: 0.7251296902038029
Energy: 0.8701622761819939
Energy: 0.7833115184599777
Energy: 0.8701622761831089
Energy: 0.7833115184588626
Energy: 0.8701622761825514
Energy: 0.7833115184588626
Energy: 0.68298326380273
Energy: 0.8067419676168474
Energy: 0.6829832638032876
Energy: 0.8067419676179625
Energy: 0.6829832638010576
Energy: 0.8067419676179625
Energy: 0.7650524616568782
Energy: 0.8551860162046664
Energy: 0.7650524616585508
Energy: 0.8551860162052239
Energy: 0.7650524616585508
Energy: 0.8551860162046664
Energy: 0.8435166553634832
Energy: 0.7825347483377271
Energy: 0.8435166553634832
Energy: 0.7825347483371695
Energy: 0.8435166553634832
Energy: 0.7825347483371695
Energy: 0.6806017230290753
Energy: 0.8078409041501273
Energy: 0.6806017230290753
Energy: 0.8078409041506849
Energy: 0.6806017230279603
Energy: 0.8078409041506849
Energy: 0.8410567605875158
Energy: 0.854232403268349
Energy: 0.8410567605886307
Energy: 0.854232403268349
Energy: 0.8410567605875158
Energy: 0.854232403268349
Energy: 0.775948548528078
Energy: 0.708605299490706
Energy: 0.775948548529193
Energy: 0.7086052994901486
Energy: 0.775948548529193
Energy: 0.7086052994912636
Energy: 0.7152852738869567
Energy: 0.8081798114427032
Energy: 0.7152852738863992
Energy: 0.8081798114421458
Energy: 0.7152852738880718
Energy: 0.8081798114421458
Energy: 0.8658366959006607
Energy: 0.87579603587362
Energy: 0.8658366959006607
Energy: 0.87579603587362
Energy: 0.8658366958995457
Energy: 0.87579603587362
Energy: 0.8240107520306242
Energy: 0.6767655197552317
Energy: 0.8240107520295094
Energy: 0.6767655197546742
Energy: 0.8240107520306242
Energy: 0.6767655197552317
Energy: 0.7399831141031123
Energy: 0.7048118142138322
Energy: 0.7399831141031123
Energy: 0.7048118142138322
Energy: 0.7399831141036699
Energy: 0.7048118142143897
Energy: 0.8409565344567177
Energy: 0.8520005154015451
Energy: 0.8409565344583905
Energy: 0.8520005154009876
Energy: 0.8409565344561601
Energy: 0.8520005154009876
Energy: 0.8151094167258113
Energy: 0.6738811528788811
Energy: 0.8151094167252537
Energy: 0.6738811528816686
Energy: 0.8151094167252537
Energy: 0.6738811528799961
Energy: 0.8062514974881896
Energy: 0.8835660025832359
Energy: 0.8062514974893046
Energy: 0.8835660025832359
Energy: 0.8062514974887471
Energy: 0.8835660025832359
Energy: 0.73342343531491
Energy: 0.8313282030959038
Energy: 0.73342343531491
Energy: 0.8313282030959038
Energy: 0.7334234353154675
Energy: 0.8313282030959038
Energy: 0.8233728908197687
Energy: 0.7010679896710907
Energy: 0.8233728908192112
Energy: 0.7010679896699756
Energy: 0.8233728908203263
Energy: 0.7010679896699756
Energy: 0.7926770010915126
Energy: 0.8491803981373235
Energy: 0.7926770010915126
Energy: 0.8491803981367659
Energy: 0.7926770010915126
Energy: 0.8491803981367659
Energy: 0.7719050246834706
Energy: 0.8061472343065722
Energy: 0.7719050246834706
Energy: 0.8061472343060146
Energy: 0.7719050246840281
Energy: 0.8061472343060146
Energy: 0.7736039015814693
Energy: 0.8088491296662663
Energy: 0.7736039015792392
Energy: 0.8088491296662663
Energy: 0.7736039015809117
Energy: 0.8088491296662663
Energy: 0.8140919671712643
Energy: 0.915419978498398
Energy: 0.8140919671729371
Energy: 0.9154199784989555
Energy: 0.8140919671729371
Energy: 0.9154199784989555
Energy: 0.8267772507499542
Energy: 0.6996825654905924
Energy: 0.8267772507510694
Energy: 0.6996825654928225
Energy: 0.8267772507505118
Energy: 0.6996825654911498
Energy: 0.8711499624749901
Energy: 0.7650638422754756
Energy: 0.8711499624755477
Energy: 0.7650638422754756
Energy: 0.8711499624749901
Energy: 0.7650638422754756
Energy: 0.7630859012441212
Energy: 0.8716605912055532
Energy: 0.7630859012446788
Energy: 0.8716605912061107
Energy: 0.7630859012430062
Energy: 0.8716605912055532
Energy: 0.9116525600135479
Energy: 0.6997445754240714
Energy: 0.9116525600141056
Energy: 0.699744575424629
Energy: 0.9116525600141056
Energy: 0.6997445754229563
Energy: 0.8409606820635038
Energy: 0.7719749959041045
Energy: 0.8409606820629464
Energy: 0.7719749959035468
Energy: 0.8409606820635038
Energy: 0.7719749959041045
Energy: 0.7261262783038072
Energy: 0.8070033236205855
Energy: 0.7261262783043647
Energy: 0.8070033236200279
Energy: 0.7261262783038072
Energy: 0.8070033236200279
Energy: 0.9049094591156972
Energy: 0.7356726467978877
Energy: 0.9049094591134672
Energy: 0.7356726467973302
Energy: 0.9049094591145822
Energy: 0.7356726467978877
Energy: 0.8623306820563161
Energy: 0.8414620059524618
Energy: 0.8623306820563161
Energy: 0.8414620059519042
Energy: 0.8623306820563161
Energy: 0.8414620059519042
Energy: 0.7018882244280659
Energy: 0.7932758270251896
Energy: 0.7018882244286233
Energy: 0.7932758270257472
Energy: 0.7018882244275083
Energy: 0.7932758270257472
Energy: 0.6853659417091763
Energy: 0.7902170193195563
Energy: 0.6853659417097338
Energy: 0.7902170193201138
Energy: 0.6853659417091763
Energy: 0.7902170193201138

minimum gb energy = 0.6738811528788811 eV
minimum distance =  2.26120300414123 Angstroms
sigma value = 67


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

Energy: 1.0609080466658996
Energy: 0.9243158444358085
Energy: 1.0609080466651053
Energy: 0.9243158444373973
Energy: 1.0609080466651053
Energy: 0.924315844436603
Energy: 0.9255564960014022
Energy: 0.9467143335813457
Energy: 0.9255564960021965
Energy: 0.9467143335805515
Energy: 0.9255564960014022
Energy: 0.9467143335813457
Energy: 0.938988201861231
Energy: 0.9484220785765174
Energy: 0.9389882018628198
Energy: 0.9484220785765174
Energy: 0.9031974127344273
Energy: 0.9484220785765174
Energy: 1.028453482239781
Energy: 0.9176161719974566
Energy: 1.028453482239781
Energy: 0.9176161719974566
Energy: 1.028453482239781
Energy: 0.9176161719966623
Energy: 0.8004018532800586
Energy: 0.8974130677876236
Energy: 0.8004018532768811
Energy: 0.8974130677876236
Energy: 0.8004018532792642
Energy: 0.8974130677876236
Energy: 0.9671631643078679
Energy: 0.9695210433235875
Energy: 0.9671631643078679
Energy: 0.9695210433235875
Energy: 0.9671631643078679
Energy: 0.9695210433235875
Energy: 0.9102078194200599
Energy: 0.8570964868600013
Energy: 0.9102078194200599
Energy: 0.8570964868607956
Energy: 0.9102078194216489
Energy: 0.8570964868607956
Energy: 0.871327792027573
Energy: 0.8952326102544478
Energy: 0.871327792027573
Energy: 0.8952326102536535
Energy: 0.871327792027573
Energy: 0.8952326102552424
Energy: 0.9955178735934866
Energy: 1.0106633119719657
Energy: 0.9955178735911034
Energy: 1.0106633119711714
Energy: 0.9955178735911034
Energy: 1.0106633119711714
Energy: 0.9165442297672945
Energy: 0.8191205478734932
Energy: 0.9165442297672945
Energy: 0.8191205478750818
Energy: 0.9165442297672945
Energy: 0.8191205478750818
Energy: 0.9192543674080694
Energy: 0.8122320094218193
Energy: 0.9192543674088638
Energy: 0.8122320094218193
Energy: 0.9192543674080694
Energy: 0.8122320094218193
Energy: 0.9122033034002687
Energy: 0.9619808635535421
Energy: 0.9122033034018574
Energy: 0.9619808635535421
Energy: 0.9122033034018574
Energy: 0.9619808635535421
Energy: 0.956991787652969
Energy: 0.8091607308924255
Energy: 0.9569917876505858
Energy: 0.8091607308932198
Energy: 0.9569917876513802
Energy: 0.8091607308940144
Energy: 0.9035269644905538
Energy: 1.0018563140027805
Energy: 0.9035269644921428
Energy: 1.0018563140035748
Energy: 0.9035269644921428
Energy: 1.0018563140027805
Energy: 0.9287997454115404
Energy: 0.8345166220545691
Energy: 0.928799745413129
Energy: 0.8345166220545691
Energy: 0.9287997454115404
Energy: 0.8345166220545691
Energy: 1.0145663802556082
Energy: 0.9344607817693673
Energy: 1.0145663802548137
Energy: 0.9344607817685728
Energy: 1.0145663802548137
Energy: 0.9344607817693673
Energy: 0.9051238576671997
Energy: 0.994478643356316
Energy: 0.9051238576648165
Energy: 0.994478643356316
Energy: 0.905123857667994
Energy: 0.9944786433555217
Energy: 0.8858737523416668
Energy: 0.8069228700951133
Energy: 0.8858737523440502
Energy: 0.8069228700959079
Energy: 0.8858737523432556
Energy: 0.8069228700959079
Energy: 0.9637356438625148
Energy: 0.980082221495877
Energy: 0.9637356438601317
Energy: 0.9800822214950824
Energy: 0.963735643860926
Energy: 0.980082221495877
Energy: 0.8094896998081262
Energy: 0.9490781114093937
Energy: 0.8094896998089208
Energy: 0.9490781114093937
Energy: 0.8094896998081262
Energy: 0.9490781114101879
Energy: 1.0081114942600717
Energy: 0.8166032538417859
Energy: 1.008111494260866
Energy: 0.8166032538417859
Energy: 1.0081114942600717
Energy: 0.8166032538417859
Energy: 1.0148154421215434
Energy: 1.0214294942922137
Energy: 1.0148154421215434
Energy: 1.0214294942930082
Energy: 1.0148154421223379
Energy: 1.0214294942930082
Energy: 0.8022422217473888
Energy: 0.9889996598745697
Energy: 0.8022422217473888
Energy: 0.9889996598745697
Energy: 0.8022422217458
Energy: 0.9889996598753642

minimum gb energy = 0.8004018532768811 eV
minimum distance =  2.29374364653959 Angstroms
sigma value = 33


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

Energy: 1.1288011820310206
Energy: 0.9774289498988386
Energy: 1.1288011820320287
Energy: 0.9774289498988386
Energy: 1.1288011820315247
Energy: 0.9774289498978307
Energy: 0.997297362068141
Energy: 1.0200079283339705
Energy: 0.9972973620676371
Energy: 1.0200079283339705
Energy: 0.9972973620676371
Energy: 1.0200079283334667
Energy: 1.0649905241294677
Energy: 1.043212010483856
Energy: 1.0649905241289637
Energy: 1.043212010483856
Energy: 1.0649905241289637
Energy: 1.043212010483856
Energy: 1.0751173540462575
Energy: 0.9826158477554233
Energy: 1.0751173540462575
Energy: 0.9826158477554233
Energy: 1.0751173540452494
Energy: 0.9826158477559274
Energy: 0.9178564923939428
Energy: 1.0156760631235953
Energy: 0.917856492392935
Energy: 1.0156760631240993
Energy: 0.9178564923954546
Energy: 1.0156760631240993
Energy: 1.1245570967577083
Energy: 1.1136046491800036
Energy: 1.1245570967556926
Energy: 1.1136046491815152
Energy: 1.1245570967572043
Energy: 1.0952718015031142
Energy: 0.9924894370592499
Energy: 0.933247357275398
Energy: 0.9924894370602578
Energy: 0.9332473572748938
Energy: 0.9924894370602578
Energy: 0.9332473572748938
Energy: 0.9655721331204579
Energy: 1.0522058951268412
Energy: 0.9655721331219695
Energy: 1.0522058951268412
Energy: 0.9655721331229776
Energy: 1.0522058951268412
Energy: 0.9946298538272256
Energy: 1.0513311774890002
Energy: 0.9946298538267216
Energy: 1.0513311774884961
Energy: 0.9946298538257136
Energy: 1.0513311774884961
Energy: 1.10959283224009
Energy: 0.8977911204769722
Energy: 1.1095928322421058
Energy: 0.8977911204774761
Energy: 1.1095928322405941
Energy: 0.9243353448096453
Energy: 1.00929219629923
Energy: 1.04498083351518
Energy: 1.0092921963007417
Energy: 1.0449808335161879
Energy: 1.0092921963007417
Energy: 1.04498083351518
Energy: 0.9964767246370966
Energy: 0.9949165908549509
Energy: 0.9964767246370966
Energy: 0.9949165908554549
Energy: 0.9964767246365926
Energy: 0.9949165908554549
Energy: 1.1121007845801478
Energy: 0.9972501715721331
Energy: 1.112100784581156
Energy: 0.9972501715726371
Energy: 1.112100784579644
Energy: 0.9972501715726371
Energy: 0.9887577150825893
Energy: 1.0469072931701087
Energy: 0.9887577150841013
Energy: 1.0469072931701087
Energy: 0.9887577150825893
Energy: 1.0469072931701087
Energy: 1.0380592626660494
Energy: 1.0155865964417565
Energy: 1.0380592626680651
Energy: 1.0155865964417565
Energy: 1.038059262667561
Energy: 1.0155865964422603
Energy: 1.0749149756371432
Energy: 1.0649469005643877
Energy: 1.074914975637647
Energy: 1.0649469005643877
Energy: 1.0749149756371432
Energy: 1.0649469005643877
Energy: 0.8990218996665063
Energy: 1.043352983542296
Energy: 0.8990218996690261
Energy: 1.043352983542296
Energy: 0.8990218996675142
Energy: 1.0433529835428
Energy: 1.0898350453019214
Energy: 1.0980632064464548
Energy: 1.0898350453014176
Energy: 1.0980632064464548
Energy: 1.0898350453019214
Energy: 1.0980632064459508
Energy: 0.9859629863187673
Energy: 0.9957312001288471
Energy: 0.9859629863187673
Energy: 0.9957312001298548
Energy: 0.9859629863197751
Energy: 0.9957312001248154
Energy: 0.9646911253507501
Energy: 1.0532315163871089
Energy: 0.9646911253512541
Energy: 1.0532315163871089
Energy: 0.9646911253512541
Energy: 1.0532315163871089
Energy: 1.0663014974014795
Energy: 1.0525874603018934
Energy: 1.0663014974014795
Energy: 1.0525874603013894
Energy: 1.0663014974024874
Energy: 1.0525874603018934
Energy: 1.039260367506012
Energy: 0.8805518216268948
Energy: 1.039260367506012
Energy: 0.8805518216279028
Energy: 1.0392603675050038
Energy: 0.8805518216284068
Energy: 1.0072935274282597
Energy: 1.0451992687326606
Energy: 1.00729352742574
Energy: 1.0451992687336227
Energy: 1.0072935274277557
Energy: 1.0451992687331644
Energy: 1.1172994308799862
Energy: 0.98908784765927
Energy: 1.117299430880994
Energy: 0.98908784765927
Energy: 1.1172994308804902
Energy: 0.989087847659774
Energy: 0.993108611361323
Energy: 0.9911273366285105
Energy: 0.993108611361323
Energy: 0.9911273366290144
Energy: 0.993108611361323
Energy: 0.9911273366290144
Energy: 1.0067877122625377
Energy: 1.0676544976216078
Energy: 1.006787712260018
Energy: 1.0676544976211035
Energy: 1.0067877122620337
Energy: 1.0676544976231195
Energy: 0.9922303391055941
Energy: 0.8797408362660704
Energy: 0.9922303391040822
Energy: 0.8797408362660704
Energy: 0.9922303391050901
Energy: 0.8797408362660704
Energy: 1.0644586279970119
Energy: 1.10246470796102
Energy: 1.064458627997516
Energy: 1.102464707961524
Energy: 1.0644586279965078
Energy: 1.102464707961524
Energy: 0.9648965519413467
Energy: 1.0158407817207982
Energy: 0.9648965519423548
Energy: 1.0158407817207982
Energy: 0.9648965519403389
Energy: 1.0158407817202941
Energy: 0.9931422217569567
Energy: 0.9287420598438657
Energy: 0.9931422217594763
Energy: 0.9287420598438657
Energy: 0.9931422217574607
Energy: 0.9287420598438657
Energy: 1.1198505438689872
Energy: 1.0962715199586601
Energy: 1.119850543870499
Energy: 1.096271519958156
Energy: 1.1198505438694912
Energy: 1.096271519958156
Energy: 0.9178002585093007
Energy: 1.0206163459839732
Energy: 0.9178002585098047
Energy: 1.0206163459839732
Energy: 0.9178002585082928
Energy: 1.0206163459839732
Energy: 1.0739943474343088
Energy: 1.0274829570122952
Energy: 1.0739943474338047
Energy: 1.0274829570122952
Energy: 1.0739943474327966
Energy: 1.0274829570127992
Energy: 1.0332062333997865
Energy: 1.0191607559685552
Energy: 1.0332062334018024
Energy: 1.019160755969563
Energy: 1.0332062333997865
Energy: 1.019160755969059
Energy: 0.9888166279107065
Energy: 1.0434778746052955
Energy: 0.9888166279107065
Energy: 1.0434778746052955
Energy: 0.9888166279107065
Energy: 1.0434778746047917
Energy: 1.1116955637277357
Energy: 0.977961396764701
Energy: 1.1116955637287438
Energy: 0.9779613967652049
Energy: 1.1116955637277357
Energy: 0.977961396764701
Energy: 0.9936078325885318
Energy: 1.022412770745203
Energy: 0.9936078325860122
Energy: 1.022412770746211
Energy: 0.9936078325885318
Energy: 1.0224127707446993

minimum gb energy = 0.8797408362660704 eV
minimum distance =  2.24549573978802 Angstroms
sigma value = 41


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

Energy: 1.1904453202480139
Energy: 1.1116250793713698
Energy: 1.1904453202466379
Energy: 1.1116250793699938
Energy: 1.1904453202480139
Energy: 1.1116250793699938
Energy: 1.0927429146316845
Energy: 1.1189665251518284
Energy: 1.0927429146303085
Energy: 1.1189665251504524
Energy: 1.0927429146316845
Energy: 1.1189665251518284
Energy: 1.2514239583612172
Energy: 1.1140093213243125
Energy: 1.234300760896003
Energy: 1.1140093213243125
Energy: 1.234300760896003
Energy: 1.1140093213243125
Energy: 1.170856327703461
Energy: 1.1486867538877643
Energy: 1.170856327704837
Energy: 1.1486867538877643
Energy: 1.170856327704837
Energy: 1.1486867538877643
Energy: 1.0801999187672866
Energy: 1.1065251122370192
Energy: 1.0801999187672866
Energy: 1.1065251122370192
Energy: 1.0801999187686626
Energy: 1.1065251122370192
Energy: 1.2384545314071744
Energy: 1.180561943132559
Energy: 1.2384545314071744
Energy: 1.1805619431311831
Energy: 1.2384545314071744
Energy: 1.180561943132559
Energy: 1.1657752370414323
Energy: 1.0597221397694205
Energy: 1.1657752370414323
Energy: 1.0597221397694205
Energy: 1.1657752370414323
Energy: 1.0597221397680447
Energy: 1.1638927075583338
Energy: 1.1205957980032062
Energy: 1.1638927075569578
Energy: 1.1205957980018302
Energy: 1.1638927075583338
Energy: 1.1205957980018302
Energy: 1.0971045354171522
Energy: 1.1036135212681157
Energy: 1.0971045354171522
Energy: 1.1036135212694915
Energy: 1.0971045354185283
Energy: 1.1036135212694915
Energy: 1.1713738079923637
Energy: 1.1264263346085082
Energy: 1.1713738079909877
Energy: 1.1264263346085082
Energy: 1.1713738079909877
Energy: 1.1264263346085082
Energy: 1.0973269212889913
Energy: 1.1142201094117359
Energy: 1.0973269212903674
Energy: 1.1142201094117359
Energy: 1.0973269212889913
Energy: 1.1142201094117359
Energy: 1.148672227411825
Energy: 1.1361606418784362
Energy: 1.148672227411825
Energy: 1.1361606418784362
Energy: 1.148672227413201
Energy: 1.1361606418784362
Energy: 1.1687017546573866
Energy: 1.1378400502364867
Energy: 1.1687017546573866
Energy: 1.1378400502351107
Energy: 1.1687017546573866
Energy: 1.1378400502392385
Energy: 1.0800442208295513
Energy: 1.1198436630581543
Energy: 1.0800442208295513
Energy: 1.1198436630581543
Energy: 1.0800442208295513
Energy: 1.1198436630581543

minimum gb energy = 1.0597221397680447 eV
minimum distance =  2.24431728439441 Angstroms
sigma value = 11


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

Energy: 1.3130010020823801
Energy: 1.2807174964758572
Energy: 1.313001002081776
Energy: 1.2807174964758572
Energy: 1.313001002081776
Energy: 1.2807174964764618
Energy: 1.190537904473149
Energy: 1.2212982485211208
Energy: 1.190537904473149
Energy: 1.2212982485211208
Energy: 1.1905379044725448
Energy: 1.2212982485211208
Energy: 1.2957654992841154
Energy: 1.2200436164647384
Energy: 1.2957654992841154
Energy: 1.2200436164641337
Energy: 1.2957654992835108
Energy: 1.2200436164641337
Energy: 1.2433528548027608
Energy: 1.183573494456462
Energy: 1.2433528548033654
Energy: 1.183573494456462
Energy: 1.2433528548027608
Energy: 1.183573494456462
Energy: 1.269960008505629
Energy: 1.2060002679402906
Energy: 1.2699600085068379
Energy: 1.2060002679402906
Energy: 1.2699600085050247
Energy: 1.2060002679402906
Energy: 1.2148399460358947
Energy: 1.2689552009889637
Energy: 1.2148399460352903
Energy: 1.2689552009889637
Energy: 1.2148399460352903
Energy: 1.2689552009889637
Energy: 1.2393672549510841
Energy: 1.2230675910181958
Energy: 1.2393672549504797
Energy: 1.2230675910181958
Energy: 1.2393672549516888
Energy: 1.2230675910181958
Energy: 1.2254955917123087
Energy: 1.2425145485652918
Energy: 1.2254955917123087
Energy: 1.2425145485652918
Energy: 1.2254955917123087
Energy: 1.242514548565896
Energy: 1.2511658091152538
Energy: 1.238259640779037
Energy: 1.2511658091152538
Energy: 1.2382596407784325
Energy: 1.2511658091146491
Energy: 1.2382596407778281
Energy: 1.2074994642846328
Energy: 1.2491405671440936
Energy: 1.2074994642846328
Energy: 1.2491405671440936
Energy: 1.2074994642840284
Energy: 1.2491405671440936
Energy: 1.219084876043517
Energy: 1.228052213029184
Energy: 1.219084876043517
Energy: 1.228052213029184
Energy: 1.2190848760441213
Energy: 1.228052213029184
Energy: 1.2409994561042725
Energy: 1.2637081459377861
Energy: 1.2409994561042725
Energy: 1.2637081459377861
Energy: 1.240999456106086
Energy: 1.2637081459377861
Energy: 1.2429440459722558
Energy: 1.2180373339690234
Energy: 1.2429440459716514
Energy: 1.2180373339690234
Energy: 1.2429440459722558
Energy: 1.2180373339690234
Energy: 1.2433286045502518
Energy: 1.2576132081769995
Energy: 1.2433286045508563
Energy: 1.2576132081769995
Energy: 1.2433286045496474
Energy: 1.2576132081769995
Energy: 1.22203781323954
Energy: 1.2426746851693269
Energy: 1.2200305611263615
Energy: 1.2426746851693269
Energy: 1.220030561128175
Energy: 1.2426746851699313
Energy: 1.2412474210044602
Energy: 1.2210469375736692
Energy: 1.2412474210032511
Energy: 1.2210469375736692
Energy: 1.2412474210044602
Energy: 1.2210469375736692
Energy: 1.1877650033388443
Energy: 1.2197905698650928
Energy: 1.1877650033394485
Energy: 1.2197905698644882
Energy: 1.1877650033388443
Energy: 1.2197905698650928
Energy: 1.2530921852728565
Energy: 1.2542787035684615
Energy: 1.253092185273461
Energy: 1.2542787035684615
Energy: 1.253092185273461
Energy: 1.2542787035690661
Energy: 1.2072367607897645
Energy: 1.1729942341264565
Energy: 1.2072367607903691
Energy: 1.1729942341264565
Energy: 1.2072367607897645
Energy: 1.1729942341264565
Energy: 1.2363557874241247
Energy: 1.2213350918166093
Energy: 1.2363557874235203
Energy: 1.2213350918166093
Energy: 1.2363557874235203
Energy: 1.2213350918172137
Energy: 1.206412877412804
Energy: 1.220078271268093
Energy: 1.2064128774121996
Energy: 1.220078271268093
Energy: 1.2064128774115952
Energy: 1.220078271268093
Energy: 1.2981780148870972
Energy: 1.2566553282147688
Energy: 1.2981780148870972
Energy: 1.2566553282147688
Energy: 1.2981780148870972
Energy: 1.2566553282147688
Energy: 1.2285252171672936
Energy: 1.220301092334119
Energy: 1.2285252171672936
Energy: 1.220301092334119
Energy: 1.2285252171672936
Energy: 1.220301092334119
Energy: 1.2690272433616774
Energy: 1.2190049647781107
Energy: 1.2690272433610728
Energy: 1.2190049647781107
Energy: 1.2690272433610728
Energy: 1.2190049647787153
Energy: 1.2150557130861974
Energy: 1.2296053806029807
Energy: 1.2150557130861974
Energy: 1.2296053806029807
Energy: 1.2150557130861974
Energy: 1.2296053806023763
Energy: 1.2151953588952582
Energy: 1.2202598190463017
Energy: 1.215195358894654
Energy: 1.2202598190456972
Energy: 1.215195358894654
Energy: 1.2202598190456972
Energy: 1.217591106991018
Energy: 1.2840974346131693
Energy: 1.2175911069898089
Energy: 1.2840974346131693
Energy: 1.2175911069898089
Energy: 1.2840974346131693
Energy: 1.2431637175323609
Energy: 1.2190695665407858
Energy: 1.2431637175317563
Energy: 1.2190695665407858
Energy: 1.2431637175323609
Energy: 1.21906956654139
Energy: 1.2426907360073745
Energy: 1.2451178005165493
Energy: 1.2426907360073745
Energy: 1.2451178005165493
Energy: 1.2426907360073745
Energy: 1.2451178005165493
Energy: 1.2248919496477104
Energy: 1.178390294444208
Energy: 1.2248919496477104
Energy: 1.1783902944448124
Energy: 1.2248919496477104
Energy: 1.1783902944448124
Energy: 1.2101122910395807
Energy: 1.2522361446972772
Energy: 1.210112291040185
Energy: 1.252236144698486
Energy: 1.210112291040185
Energy: 1.2522361446948593

minimum gb energy = 1.1729942341264565 eV
minimum distance =  2.24548020940562 Angstroms
sigma value = 57


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

Energy: 1.1583837396783037
Energy: 1.2208502626572508
Energy: 1.1583837396783037
Energy: 1.2208502626572508
Energy: 1.1583837396783037
Energy: 1.2208502626572508
Energy: 1.2367501070879365
Energy: 1.2472755092665295
Energy: 1.2367501070879365
Energy: 1.2472755092665295
Energy: 1.2367501070890121
Energy: 1.2472755092654537
Energy: 1.2350522834982167
Energy: 1.1936250375581399
Energy: 1.2350522834982167
Energy: 1.1936250375581399
Energy: 1.2350522834982167
Energy: 1.1936250375581399
Energy: 1.1699976431119246
Energy: 1.3978070628935817
Energy: 1.1699976431119246
Energy: 1.2913073511104856
Energy: 1.1699976431119246
Energy: 1.2913073511094102
Energy: 1.2349025999180672
Energy: 1.1936513082450184
Energy: 1.234902599919143
Energy: 1.1936513082450184
Energy: 1.2349025999169918
Energy: 1.1936513082450184
Energy: 1.2366629768219664
Energy: 1.2778471043901347
Energy: 1.2366629768219664
Energy: 1.2778471043901347
Energy: 1.2366629768219664
Energy: 1.2778471043922859
Energy: 1.1583837396750767
Energy: 1.2208502626615532
Energy: 1.1583837396761525
Energy: 1.2208502626604776
Energy: 1.1583837396761525
Energy: 1.2208502626615532
Energy: 1.2367501070911635
Energy: 1.2472755092654537
Energy: 1.2367501070911635
Energy: 1.2472755092665295
Energy: 1.236750107090088
Energy: 1.2472755092643781
Energy: 1.2350522835025193
Energy: 1.1936250375592155
Energy: 1.2350522835014435
Energy: 1.1936250375592155
Energy: 1.2350522835025193
Energy: 1.1936250375602913
Energy: 1.169997643113
Energy: 1.3978070628968087
Energy: 1.169997643113
Energy: 1.2913073511072586
Energy: 1.1699976431119246
Energy: 1.2913073511072586
Energy: 1.2349025999169918
Energy: 1.1936513082460938
Energy: 1.2349025999169918
Energy: 1.1936513082460938
Energy: 1.234902599919143
Energy: 1.1936513082460938
Energy: 1.2366629768230422
Energy: 1.2472235610708984
Energy: 1.2366629768230422
Energy: 1.2472235610708984
Energy: 1.2366629768230422
Energy: 1.2472235610719742
Energy: 1.1583837396783037
Energy: 1.2208502626572508
Energy: 1.1583837396783037
Energy: 1.2208502626583264
Energy: 1.1583837396783037
Energy: 1.2208502626583264
Energy: 1.2367501070879365
Energy: 1.2472755092665295
Energy: 1.2367501070890121
Energy: 1.2472755092665295
Energy: 1.2367501070890121
Energy: 1.2472755092654537
Energy: 1.2350522834982167
Energy: 1.1936250375581399
Energy: 1.2350522834982167
Energy: 1.1936250375581399
Energy: 1.2350522834982167
Energy: 1.1936250375581399
Energy: 1.169997643113
Energy: 1.2913073511104856
Energy: 1.169997643113
Energy: 1.2913073511104856
Energy: 1.169997643113
Energy: 1.2913073511094102
Energy: 1.2349025999180672
Energy: 1.1936513082439426
Energy: 1.2349025999180672
Energy: 1.1936513082439426
Energy: 1.2349025999180672
Energy: 1.1936513082439426

minimum gb energy = 1.1583837396750767 eV
minimum distance =  2.23345039741803 Angstroms
sigma value = 9


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

Energy: 1.2777251440733857
Energy: 1.3491882757104372
Energy: 1.2777251440733857
Energy: 1.3491882757104372
Energy: 1.2777251440733857
Energy: 1.3491882757104372
Energy: 1.29975680425148
Energy: 1.267340543479953
Energy: 1.29975680425148
Energy: 1.267340543479953
Energy: 1.2997568042506018
Energy: 1.267340543479953
Energy: 1.3548682010116482
Energy: 1.2706062298288345
Energy: 1.35486820101077
Energy: 1.2706062298288345
Energy: 1.3548682010116482
Energy: 1.2706062298288345
Energy: 1.2334630467604992
Energy: 1.3443005953399076
Energy: 1.2334630467587426
Energy: 1.3443005953399076
Energy: 1.233463046759621
Energy: 1.3443005953399076
Energy: 1.2677722133387819
Energy: 1.2645981016578816
Energy: 1.2677722133405382
Energy: 1.2645981016570034
Energy: 1.2677722133405382
Energy: 1.2645981016570034
Energy: 1.2721729646900286
Energy: 1.2568132866436919
Energy: 1.2721729646909068
Energy: 1.2568132866428137
Energy: 1.2721729646909068
Energy: 1.2568132866428137
Energy: 1.2334897578029593
Energy: 1.315260889001722
Energy: 1.2334897578012025
Energy: 1.315260889001722
Energy: 1.2334897578020811
Energy: 1.3152608890008437
Energy: 1.2291699133389637
Energy: 1.2947912461369366
Energy: 1.2291699133380856
Energy: 1.2947912461369366
Energy: 1.2291699133372072
Energy: 1.2947912461378148
Energy: 1.3772835519226205
Energy: 1.2653500792997343
Energy: 1.3772835519226205
Energy: 1.2653500793006127
Energy: 1.3772835519226205
Energy: 1.2653500793006127
Energy: 1.2296039866243387
Energy: 1.2980668664636925
Energy: 1.2296039866243387
Energy: 1.2980668664636925
Energy: 1.2296039866243387
Energy: 1.2980668664636925
Energy: 1.2442051088036674
Energy: 1.3068748943862072
Energy: 1.244205108806302
Energy: 1.3068748943862072
Energy: 1.2442051088036674
Energy: 1.3068748943862072
Energy: 1.3227651022708453
Energy: 1.2535210207088727
Energy: 1.3227651022717237
Energy: 1.2535210207088727
Energy: 1.3227651022717237
Energy: 1.2535210207088727
Energy: 1.2305584098416784
Energy: 1.3240909408880024
Energy: 1.2305584098434348
Energy: 1.3240909408880024
Energy: 1.2305584098425566
Energy: 1.3240909408880024
Energy: 1.285506658682994
Energy: 1.3001851838508403
Energy: 1.285506658682994
Energy: 1.3001851838508403
Energy: 1.285506658682994
Energy: 1.3001851838508403
Energy: 1.3227168211094484
Energy: 1.257005122829154
Energy: 1.3227168211103266
Energy: 1.2570051228282757
Energy: 1.3227168211094484
Energy: 1.2570051228282757
Energy: 1.2852310353438392
Energy: 1.3057884431360236
Energy: 1.2852310353447172
Energy: 1.3057884431360236
Energy: 1.2852310353447172
Energy: 1.3057884431360236
Energy: 1.2878478132674982
Energy: 1.3046377413512482
Energy: 1.2878478132674982
Energy: 1.3046377413512482
Energy: 1.2878478132683766
Energy: 1.3046377413512482
Energy: 1.394732043585377
Energy: 1.2569527958686142
Energy: 1.394732043585377
Energy: 1.2569527958686142
Energy: 1.394732043585377
Energy: 1.2569527958686142
Energy: 1.2493895910444093
Energy: 1.3106940417832984
Energy: 1.2493895910444093
Energy: 1.3106940417832984
Energy: 1.2493895910444093
Energy: 1.3106940417832984
Energy: 1.2570603929150432
Energy: 1.2562347165948302
Energy: 1.2570603929159219
Energy: 1.2562347165939518
Energy: 1.2570603929168
Energy: 1.2562347165948302
Energy: 1.3535661382531126
Energy: 1.2522336620805092
Energy: 1.3535661382531126
Energy: 1.2522336620805092
Energy: 1.3535661382531126
Energy: 1.2522336620805092

minimum gb energy = 1.2291699133372072 eV
minimum distance =  2.20789438830172 Angstroms
sigma value = 27


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

Energy: 1.309536893888167
Energy: 1.2652212948958752
Energy: 1.3095368938889074
Energy: 1.265221294895135
Energy: 1.3095368938889074
Energy: 1.2652212948958752
Energy: 1.2798743640475219
Energy: 1.2101880953995066
Energy: 1.2798743640475219
Energy: 1.2101880953995066
Energy: 1.2798743640467816
Energy: 1.2101880953987663
Energy: 1.2917958176790372
Energy: 1.2058201080147897
Energy: 1.2917958176797775
Energy: 1.2058201080147897
Energy: 1.2917958176790372
Energy: 1.2058201080147897
Energy: 1.1791770449006027
Energy: 1.225553722728559
Energy: 1.1791770449006027
Energy: 1.225553722729299
Energy: 1.179177044901343
Energy: 1.225553722729299
Energy: 1.208018983912044
Energy: 1.249822439463811
Energy: 1.208018983912044
Energy: 1.249822439463811
Energy: 1.2080189839127844
Energy: 1.2498224394645512
Energy: 1.2207777098411838
Energy: 1.2421511685005087
Energy: 1.2207777098397032
Energy: 1.2421511685012487
Energy: 1.220777709838963
Energy: 1.2421511685012487
Energy: 1.2199994755345738
Energy: 1.2820093852333698
Energy: 1.2199994755338335
Energy: 1.2820093852333698
Energy: 1.2199994755353138
Energy: 1.2820093852326295
Energy: 1.2685823473698137
Energy: 1.2815980863486838
Energy: 1.2685823473705542
Energy: 1.2815980863479435
Energy: 1.2685823473698137
Energy: 1.2815980863486838
Energy: 1.246837594157138
Energy: 1.210379222866134
Energy: 1.2468375941563976
Energy: 1.210379222866134
Energy: 1.2468375941578784
Energy: 1.210379222866134
Energy: 1.179197767842774
Energy: 1.2736058753291168
Energy: 1.179197767842774
Energy: 1.2736058753291168
Energy: 1.179197767842774
Energy: 1.2736058753291168
Energy: 1.179406931780009
Energy: 1.2577830143567115
Energy: 1.1794069317785285
Energy: 1.2577830143567115
Energy: 1.179406931780009
Energy: 1.2577830143567115
Energy: 1.2990385823828985
Energy: 1.1791259291816956
Energy: 1.299038582384379
Energy: 1.1791259291816956
Energy: 1.299038582383639
Energy: 1.1791259291816956
Energy: 1.2848612146441925
Energy: 1.2758133576924755
Energy: 1.2848612146441925
Energy: 1.2758133576924755
Energy: 1.2848612146441925
Energy: 1.2758133576924755
Energy: 1.2065318081397018
Energy: 1.255063105440934
Energy: 1.2065318081389618
Energy: 1.255063105440934
Energy: 1.2065318081397018
Energy: 1.255063105440934
Energy: 1.2229832758545671
Energy: 1.2852549275403364
Energy: 1.2229832758545671
Energy: 1.2852549275395964
Energy: 1.2229832758545671
Energy: 1.2852549275395964
Energy: 1.2282037888702644
Energy: 1.2317564412485005
Energy: 1.228203788868784
Energy: 1.231756441249241
Energy: 1.228203788869524
Energy: 1.23175644124702
Energy: 1.179451231288384
Energy: 1.2849897327314939
Energy: 1.1794512312898646
Energy: 1.2849897327314939
Energy: 1.1794512312898646
Energy: 1.2849897327314939
Energy: 1.2294284327380594
Energy: 1.2067023264317505
Energy: 1.2294284327380594
Energy: 1.2067023264310102
Energy: 1.229428432737319
Energy: 1.2067023264317505
Energy: 1.2402925376428704
Energy: 1.2110505002676002
Energy: 1.240292537645091
Energy: 1.2110505002690808
Energy: 1.2402925376436105
Energy: 1.2110505002683405
Energy: 1.309536893888167
Energy: 1.265221294897356
Energy: 1.309536893888167
Energy: 1.265221294897356
Energy: 1.3095368938889074
Energy: 1.265221294897356
Energy: 1.2798743640460413
Energy: 1.2101880953965451
Energy: 1.2798743640460413
Energy: 1.2101880953965451
Energy: 1.2798743640460413
Energy: 1.2101880953965451
Energy: 1.2917958176819981
Energy: 1.2058201080162705
Energy: 1.291795817681258
Energy: 1.2058201080162705
Energy: 1.2917958176819981
Energy: 1.2058201080162705
Energy: 1.1791770449006027
Energy: 1.2255537227255977
Energy: 1.1791770449006027
Energy: 1.2255537227255977
Energy: 1.1791770449020833
Energy: 1.2255537227255977
Energy: 1.208018983912044
Energy: 1.249822439466032
Energy: 1.208018983912044
Energy: 1.2498224394645512
Energy: 1.2080189839127844
Energy: 1.2498224394652917
Energy: 1.2207777098397032
Energy: 1.242151168499028
Energy: 1.220777709838963
Energy: 1.2421511684982876
Energy: 1.220777709838963
Energy: 1.242151168499028

minimum gb energy = 1.1791259291816956 eV
minimum distance =  2.21683433356983 Angstroms
sigma value = 19


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

Energy: 1.2171322658351984
Energy: 1.285512451991895
Energy: 1.2171322658358374
Energy: 1.2855124519912562
Energy: 1.2171322658351984
Energy: 1.285512451991895
Energy: 1.2038915170070086
Energy: 1.1603104617320856
Energy: 1.2038915170070086
Energy: 1.160310461730808
Energy: 1.2038915170089257
Energy: 1.1603104617314466
Energy: 1.2995624889535837
Energy: 1.1447868499810885
Energy: 1.2399193741257895
Energy: 1.1447868499810885
Energy: 1.2399193741257895
Energy: 1.1447868499810885
Energy: 1.1618526841755925
Energy: 1.2782881525878929
Energy: 1.1618526841755925
Energy: 1.2782881525878929
Energy: 1.1618526841755925
Energy: 1.2782881525878929
Energy: 1.1846593759784227
Energy: 1.210030937290661
Energy: 1.1846593759797008
Energy: 1.210030937290661
Energy: 1.1846593759790618
Energy: 1.210030937290661
Energy: 1.2917479167517112
Energy: 1.1741727612481276
Energy: 1.2917479167517112
Energy: 1.1741727612481276
Energy: 1.2917479167517112
Energy: 1.1741727612481276
Energy: 1.1455928176780792
Energy: 1.262402252643789
Energy: 1.145592817678718
Energy: 1.262402252643789
Energy: 1.1455928176780792
Energy: 1.262402252644428
Energy: 1.187536278712443
Energy: 1.2435239939759748
Energy: 1.187536278712443
Energy: 1.2435239939746972
Energy: 1.187536278712443
Energy: 1.2435239939753358
Energy: 1.3164076620550533
Energy: 1.1428560491266688
Energy: 1.3164076620550533
Energy: 1.1428560491266688
Energy: 1.3164076620550533
Energy: 1.1428560491266688
Energy: 1.1974059049398205
Energy: 1.1852567081784797
Energy: 1.1974059049404595
Energy: 1.1852567081791188
Energy: 1.1974059049404595
Energy: 1.1852567081791188
Energy: 1.1452195839935637
Energy: 1.2751853015888404
Energy: 1.1452195839935637
Energy: 1.2751853015882013
Energy: 1.1452195839935637
Energy: 1.2751853015888404
Energy: 1.2468235446835791
Energy: 1.141313665681148
Energy: 1.2468235446842182
Energy: 1.141313665681148
Energy: 1.2468235446835791
Energy: 1.141313665681148
Energy: 1.165332890746056
Energy: 1.1783326677232104
Energy: 1.165332890746056
Energy: 1.1783326677232104
Energy: 1.165332890746695
Energy: 1.1783326677238493
Energy: 1.1694300932241826
Energy: 1.277430149198963
Energy: 1.1694300932248216
Energy: 1.277430149198963
Energy: 1.1694300932241826
Energy: 1.277430149198963
Energy: 1.2515732673467848
Energy: 1.1417477649296852
Energy: 1.251573267346146
Energy: 1.1417477649290462
Energy: 1.2515732673474238
Energy: 1.1417477649290462
Energy: 1.2324609995937037
Energy: 1.1348508126422094
Energy: 1.2324609995930644
Energy: 1.1348508126428483
Energy: 1.2324609995924254
Energy: 1.1348508126422094
Energy: 1.1602346726543666
Energy: 1.233165059535066
Energy: 1.1602346726537276
Energy: 1.2331650595357049
Energy: 1.1602346726550057
Energy: 1.233165059535066
Energy: 1.2130936747867633
Energy: 1.2114774529587715
Energy: 1.2130936747874024
Energy: 1.2114774529587715
Energy: 1.2130936747854855
Energy: 1.2114774529581325
Energy: 1.2556431615050918
Energy: 1.1710610828666386
Energy: 1.2556431615057309
Energy: 1.1710610828666386
Energy: 1.2556431615057309
Energy: 1.1710610828666386
Energy: 1.1651890370498168
Energy: 1.2751947151964427
Energy: 1.1651890370498168
Energy: 1.2751947151964427
Energy: 1.165189037049178
Energy: 1.2751947151964427
Energy: 1.1285319588664042
Energy: 1.2451364803142018
Energy: 1.1285319588664042
Energy: 1.245136480313563
Energy: 1.1285319588664042
Energy: 1.245136480312924
Energy: 1.3206031266020273
Energy: 1.1434497389351324
Energy: 1.3206031266026665
Energy: 1.1434497389351324
Energy: 1.3206031266020273
Energy: 1.1434497389351324
Energy: 1.2076764608441448
Energy: 1.1769498033555592
Energy: 1.2076764608428667
Energy: 1.1769498033549202
Energy: 1.2076764608435058
Energy: 1.1769498033574763
Energy: 1.2068824219461531
Energy: 1.2887466779067693
Energy: 1.2068824219461531
Energy: 1.2887466779067693
Energy: 1.2068824219455139
Energy: 1.2887466779067693
Energy: 1.26293043498699
Energy: 1.1364042415718578
Energy: 1.26293043498699
Energy: 1.1364042415712188
Energy: 1.262930434987629
Energy: 1.1364042415712188
Energy: 1.1853811003816508
Energy: 1.164378677672085
Energy: 1.1853811003822898
Energy: 1.1643786776727243
Energy: 1.1853811003816508
Energy: 1.1643786776727243
Energy: 1.134549782208304
Energy: 1.2718370797334329
Energy: 1.134549782208304
Energy: 1.2718370797334329
Energy: 1.134549782207665
Energy: 1.2718370797327938
Energy: 1.2479861680827915
Energy: 1.1708723138568873
Energy: 1.2479861680815134
Energy: 1.1708723138568873
Energy: 1.2479861680821525
Energy: 1.1708723138568873
Energy: 1.2245737387973292
Energy: 1.1709191884025312
Energy: 1.2245737387960511
Energy: 1.1709191884025312
Energy: 1.2245737387973292
Energy: 1.1709191884025312

minimum gb energy = 1.1285319588664042 eV
minimum distance =  2.2007887750217 Angstroms
sigma value = 101


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

Energy: 1.1381654616084527
Energy: 1.2920824460746716
Energy: 1.1381654616084527
Energy: 1.2920824460741098
Energy: 1.1381654616078911
Energy: 1.2920824460752334
Energy: 1.2007396285407894
Energy: 1.1181641648890186
Energy: 1.2007396285402276
Energy: 1.1181641648890186
Energy: 1.2007396285407894
Energy: 1.1175836528195262
Energy: 1.1725017446159165
Energy: 1.1028478079530502
Energy: 1.1725017446159165
Energy: 1.1028478079530502
Energy: 1.1725017446153545
Energy: 1.1028478079530502
Energy: 1.0747054853208806
Energy: 1.22618651051417
Energy: 1.0747054853214422
Energy: 1.2261865105130465
Energy: 1.0747054853214422
Energy: 1.2223844184028696
Energy: 1.1124165212308588
Energy: 1.1517018925604028
Energy: 1.1124165212302968
Energy: 1.1517018925609646
Energy: 1.1124165212314203
Energy: 1.1517018925604028
Energy: 1.2125358131916737
Energy: 1.101566357484099
Energy: 1.2125358131905504
Energy: 1.101566357484099
Energy: 1.2125358131877417
Energy: 1.101566357484099
Energy: 1.103860985441395
Energy: 1.179831164554174
Energy: 1.1038609854408332
Energy: 1.1798311645547357
Energy: 1.1038609854397097
Energy: 1.1798311645536121
Energy: 1.0823844359953234
Energy: 1.334196669080527
Energy: 1.082384435993638
Energy: 1.2094407678327164
Energy: 1.0823844359947614
Energy: 1.2094407678304695
Energy: 1.2512694679977348
Energy: 1.0955530846054735
Energy: 1.2512694679982965
Energy: 1.0955530846054735
Energy: 1.2512694679971732
Energy: 1.0955530846054735
Energy: 1.167303309737245
Energy: 1.2220039117423744
Energy: 1.1673033097366832
Energy: 1.1551839730693247
Energy: 1.1673033097366832
Energy: 1.1515304156291217
Energy: 1.0781916344990679
Energy: 1.3504569556390957
Energy: 1.0781916344973828
Energy: 1.3504569556390957
Energy: 1.0781916344996294
Energy: 1.3504569556390957
Energy: 1.2234723281169204
Energy: 1.1020102784772994
Energy: 1.223472328115797
Energy: 1.102010278477861
Energy: 1.223472328115797
Energy: 1.1020102784772994
Energy: 1.242564838814177
Energy: 1.1012228376831839
Energy: 1.2425648388153003
Energy: 1.1012228376826225
Energy: 1.2425648388158623
Energy: 1.1012228376826225
Energy: 1.14430163779357
Energy: 1.2791523827934446
Energy: 1.1443016377946935
Energy: 1.2670605079050008
Energy: 1.1443016377941317
Energy: 1.2936167864492256
Energy: 1.1611712539981331
Energy: 1.1511558874006333
Energy: 1.161171253998695
Energy: 1.1511558874006333
Energy: 1.161171253998695
Energy: 1.151155887401195
Energy: 1.1727285245119325
Energy: 1.0991612107457283
Energy: 1.1727285245124943
Energy: 1.0991612107462898
Energy: 1.1727285245119325
Energy: 1.0991612107462898
Energy: 1.0763386858503547
Energy: 1.2020619027049362
Energy: 1.0763386858514783
Energy: 1.2020619027049362
Energy: 1.0763386858509167
Energy: 1.2020619027054977
Energy: 1.080469008409721
Energy: 1.159807793490451
Energy: 1.0804690084091593
Energy: 1.159807793490451
Energy: 1.0804690084091593
Energy: 1.1598077934898892
Energy: 1.2131111878522878
Energy: 1.095354808589834
Energy: 1.2131111878483558
Energy: 1.0953548085903955
Energy: 1.2131111878461087
Energy: 1.0953548085903955
Energy: 1.1069017975335396
Energy: 1.1033421567578146
Energy: 1.1069017975324158
Energy: 1.1033421567578146
Energy: 1.1069017975357864
Energy: 1.1033421567583763
Energy: 1.0784382485902668
Energy: 1.3603036985715076
Energy: 1.0784382485885817
Energy: 1.3603036985715076
Energy: 1.0784382485902668
Energy: 1.3603036985715076
Energy: 1.2161691169360886
Energy: 1.096589415371923
Energy: 1.2161691169349653
Energy: 1.0965894153713611
Energy: 1.2161691169355269
Energy: 1.096589415371923
Energy: 1.2558698473260308
Energy: 1.1009781146007462
Energy: 1.2558698473260308
Energy: 1.1009781146007462
Energy: 1.2558698473254688
Energy: 1.1009781146007462
Energy: 1.0745979640264993
Energy: 1.2689170835465458
Energy: 1.0745979640242522
Energy: 1.2689170835465458
Energy: 1.0745979640259375
Energy: 1.268917083545984
Energy: 1.2071887077887633
Energy: 1.1446962126868732
Energy: 1.2071887077898869
Energy: 1.1446962126857496
Energy: 1.2071887077882015
Energy: 1.1446962126863112
Energy: 1.2506477735550574
Energy: 1.0991570790276126
Energy: 1.2506477735550574
Energy: 1.099157079027051
Energy: 1.2506477735556192
Energy: 1.0991570790276126
Energy: 1.1381499014804615
Energy: 1.2480486102180446
Energy: 1.1381499014838319
Energy: 1.2480486102180446
Energy: 1.1381499014827083
Energy: 1.2480486102180446
Energy: 1.1381565304827217
Energy: 1.1404469676688334
Energy: 1.1381565304815981
Energy: 1.1404469676688334
Energy: 1.1381565304827217
Energy: 1.1404469676693951
Energy: 1.2688232102664256
Energy: 1.0937899340591184
Energy: 1.2688232102664256
Energy: 1.0937899340591184
Energy: 1.268823210265864
Energy: 1.0937899340596802
Energy: 1.080662734266417
Energy: 1.1548427529854342
Energy: 1.0806627342658555
Energy: 1.1548427529854342
Energy: 1.080662734266979
Energy: 1.1548427529854342
Energy: 1.0764387107365283
Energy: 1.2357591065898283
Energy: 1.0764387107376516
Energy: 1.2357591065892666
Energy: 1.0764387107359663
Energy: 1.2357591065898283
Energy: 1.276687563724731
Energy: 1.096673537669839
Energy: 1.276687563724731
Energy: 1.096673537669839
Energy: 1.2766875637241695
Energy: 1.096673537669839
Energy: 1.2204255769245604
Energy: 1.100984633202716
Energy: 1.2204255769262455
Energy: 1.100984633202716
Energy: 1.220425576925684
Energy: 1.1009846332021542

minimum gb energy = 1.0745979640242522 eV
minimum distance =  2.22319646238994 Angstroms
sigma value = 33


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

Energy: 0.020408726385047603
Energy: 0.8836704152615251
Energy: 0.020408726385047603
Energy: 0.8836704152619917
Energy: 0.020408726385047603
Energy: 0.8836704152619917
Energy: 0.021852096659737877
Energy: 0.48388039021661927
Energy: 0.021852096659737877
Energy: 0.48388039021661927
Energy: 0.021852096659737877
Energy: 0.4838803902170341
Energy: 0.8843180944113251
Energy: 0.48323895551441776
Energy: 0.8843181164300361
Energy: 0.4832389555139511
Energy: 0.8843181841826526
Energy: 0.4832389555134843
Energy: 0.02185209666067132
Energy: 0.4838803902170341
Energy: 0.021852096660204597
Energy: 0.48388039021750073
Energy: 0.021852096659737877
Energy: 0.4838803902170341

minimum gb energy = 0.020408726385047603 eV
minimum distance =  2.48706248728086 Angstroms
sigma value = 1