Model name: model_name=EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_AlAgAuCuNiPdPt__MO_115316750986_001 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=3.487144187092781 cohesive_energy=4.453657130216031 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: -8.48587586902969e-25 eV ======================================== theta = 0.0 ======================================== Energy: 0.018519703997890172 Energy: 1.289989122631579 Energy: 0.018519703997890172 Energy: 1.289989122631579 Energy: 0.018519703997890172 Energy: 1.289989122631579 Energy: 1.289989122631579 Energy: 1.263516106924914 Energy: 1.289989122631579 Energy: 1.2635161069245768 Energy: 1.289989122631579 Energy: 1.2635161069245768 Energy: 0.018519703997890172 Energy: 1.2899891226312419 Energy: 0.018519703997890172 Energy: 1.2899891226312419 Energy: 0.018519703997890172 Energy: 1.2899891226312419 Energy: 1.289989122631579 Energy: 1.2635161069245768 Energy: 1.289989122631579 Energy: 1.2635161069245768 Energy: 1.289989122631579 Energy: 1.2635161069245768 Energy: 0.018519703997890172 Energy: 1.289989122631579 Energy: 0.0185197039982272 Energy: 1.289989122631579 Energy: 0.018519703997890172 Energy: 1.289989122631579 Energy: 1.289989122631579 Energy: 1.26351610692424 Energy: 1.289989122631579 Energy: 1.2635161069245768 Energy: 1.289989122631579 Energy: 1.2635161069245768 minimum gb energy = 0.018519703997890172 eV minimum distance = 2.32355023374112 Angstroms sigma value = 1 ======================================== theta = 20.049975724151484 ======================================== Energy: 1.573083233552317 Energy: 1.4798925674491004 Energy: 1.573083233552317 Energy: 1.4798925674491004 Energy: 1.573083233552317 Energy: 1.4798925674491004 Energy: 1.7058828302573439 Energy: 1.3645471816274897 Energy: 1.7058828302581552 Energy: 1.3645471816266785 Energy: 1.7058828302573439 Energy: 1.3645471816266785 Energy: 1.4781386620529484 Energy: 1.5623685017699063 Energy: 1.4781386620529484 Energy: 1.5623685017699063 Energy: 1.4781386620529484 Energy: 1.5623685017707174 Energy: 1.6511859943397595 Energy: 1.4449441988162048 Energy: 1.6511859943397595 Energy: 1.4449441988162048 Energy: 1.6511859943397595 Energy: 1.4449441988162048 Energy: 1.4988570527100864 Energy: 1.5819162979485615 Energy: 1.4988570527100864 Energy: 1.581916297946939 Energy: 1.4988570527100864 Energy: 1.581916297946939 Energy: 1.572663542519722 Energy: 1.4041027536892625 Energy: 1.572663542519722 Energy: 1.4041027536892625 Energy: 1.5726635425189108 Energy: 1.4041027536892625 Energy: 1.4870476620350979 Energy: 1.548144000208175 Energy: 1.4870476620342865 Energy: 1.548144000208175 Energy: 1.4870476620342865 Energy: 1.548144000208175 Energy: 1.4384100573905494 Energy: 1.6669683454913782 Energy: 1.4384100573905494 Energy: 1.6669683454913782 Energy: 1.4384100573905494 Energy: 1.6669683454913782 Energy: 1.6053905681734812 Energy: 1.5591159254468867 Energy: 1.6053905681734812 Energy: 1.5591159254468867 Energy: 1.6053905681734812 Energy: 1.5591159254468867 Energy: 1.3497020524504593 Energy: 1.6492382233338134 Energy: 1.3497020524504593 Energy: 1.6492382233338134 Energy: 1.349702052449648 Energy: 1.6492382233338134 Energy: 1.8279582177974198 Energy: 1.4034507239012801 Energy: 1.8279582177974198 Energy: 1.4034507239012801 Energy: 1.8279582177974198 Energy: 1.4034507239012801 Energy: 1.3128969139739264 Energy: 1.648232271221114 Energy: 1.3128969139747377 Energy: 1.648232271221114 Energy: 1.3128969139739264 Energy: 1.648232271221114 Energy: 1.6957941905137717 Energy: 1.3023195732156323 Energy: 1.6957941905129605 Energy: 1.3023195732156323 Energy: 1.6957941905129605 Energy: 1.3023195732156323 Energy: 1.4244665726677772 Energy: 1.4596171026665699 Energy: 1.4244665726677772 Energy: 1.4596171026665699 Energy: 1.4244665726677772 Energy: 1.4596171026665699 Energy: 1.7551549588389395 Energy: 1.3600274228859142 Energy: 1.7551549588389395 Energy: 1.3600274228859142 Energy: 1.7551549588381283 Energy: 1.3600274228859142 Energy: 1.7548761452744752 Energy: 1.5759921492155198 Energy: 1.7548761452744752 Energy: 1.5759921492155198 Energy: 1.7548761452744752 Energy: 1.5759921492155198 Energy: 1.535495293018229 Energy: 1.522487514656696 Energy: 1.535495293018229 Energy: 1.522487514656696 Energy: 1.5354952930190402 Energy: 1.522487514656696 Energy: 1.5352799603470602 Energy: 1.4480601232767143 Energy: 1.5352799603470602 Energy: 1.4480601232767143 Energy: 1.5352799603470602 Energy: 1.4480601232767143 Energy: 1.353656707198785 Energy: 1.4448657175720119 Energy: 1.353656707198785 Energy: 1.4448657175720119 Energy: 1.353656707198785 Energy: 1.4448657175720119 Energy: 1.5770456386401843 Energy: 1.4039543066790048 Energy: 1.5770456386401843 Energy: 1.4039543066790048 Energy: 1.5770456386401843 Energy: 1.4039543066790048 Energy: 1.3793196219911705 Energy: 1.6742394406060674 Energy: 1.3793196219919817 Energy: 1.6742394406060674 Energy: 1.3793196219919817 Energy: 1.6742394406052559 Energy: 1.5889571321315363 Energy: 1.5511589868415705 Energy: 1.5889571321323475 Energy: 1.5511589868415705 Energy: 1.5889571321323475 Energy: 1.5511589868423816 Energy: 1.2939964985584875 Energy: 1.681256046988156 Energy: 1.2939964985584875 Energy: 1.681256046988156 Energy: 1.2939964985584875 Energy: 1.681256046988156 minimum gb energy = 1.2939964985584875 eV minimum distance = 2.24294576563953 Angstroms sigma value = 33 ======================================== theta = 22.84350731792459 ======================================== Energy: 1.728119479153117 Energy: 1.6546892878728163 Energy: 1.6661378732944085 Energy: 1.6546892878760044 Energy: 1.728119479153117 Energy: 1.6546892878751236 Energy: 1.6877079817802072 Energy: 1.4608940024223374 Energy: 1.6877079817802072 Energy: 1.4608940024223374 Energy: 1.6877079817797458 Energy: 1.4608940024223374 Energy: 1.411195232409503 Energy: 1.459739070277656 Energy: 1.411195232409503 Energy: 1.459739070277656 Energy: 1.411195232409503 Energy: 1.459739070277656 Energy: 1.6956453826411584 Energy: 1.61496050821447 Energy: 1.6956453826411584 Energy: 1.61496050821447 Energy: 1.6956453826416198 Energy: 1.61496050821447 Energy: 1.550158663294133 Energy: 1.5294106660435904 Energy: 1.550158663294133 Energy: 1.529410666043129 Energy: 1.550158663294133 Energy: 1.529410666043129 Energy: 1.4510284593898142 Energy: 1.3876585640087247 Energy: 1.4510284593888911 Energy: 1.3876585640087247 Energy: 1.4510284593888911 Energy: 1.3876585640087247 Energy: 1.6928262351776346 Energy: 1.387695904628905 Energy: 1.6926204022409765 Energy: 1.3876959232842168 Energy: 1.6928262351771732 Energy: 1.3876959016806956 Energy: 1.364364450038984 Energy: 1.7288506290233794 Energy: 1.3643480698926518 Energy: 1.7288506290229182 Energy: 1.364364450038984 Energy: 1.7288506290233794 Energy: 1.3894736023032899 Energy: 1.4143885165311547 Energy: 1.3894736023032899 Energy: 1.4143885165311547 Energy: 1.389473602302367 Energy: 1.4143885165311547 Energy: 1.3855297136883498 Energy: 1.7392395646376175 Energy: 1.3855286956383817 Energy: 1.7392395646376175 Energy: 1.3855297136883498 Energy: 1.7392395646371561 Energy: 1.5054548174338782 Energy: 1.3892002525601368 Energy: 1.505454817484134 Energy: 1.3892002525601368 Energy: 1.5054548091956717 Energy: 1.3892002525601368 Energy: 1.4111936503237215 Energy: 1.5063481590405394 Energy: 1.4111933246688528 Energy: 1.5063481590405394 Energy: 1.4111936503237215 Energy: 1.5063481590405394 Energy: 1.5861624524810225 Energy: 1.3730040712047842 Energy: 1.5861624524810225 Energy: 1.3730040712047842 Energy: 1.5861624524810225 Energy: 1.3730040712047842 Energy: 1.5830880265525828 Energy: 1.6668265069108859 Energy: 1.5830880265530445 Energy: 1.6668265069108859 Energy: 1.5830880265530445 Energy: 1.6668265069108859 Energy: 1.5722068082402674 Energy: 1.4594373345028075 Energy: 1.5722068082402674 Energy: 1.459437334503269 Energy: 1.5722068082402674 Energy: 1.459437334503269 Energy: 1.4114514922814738 Energy: 1.4614337689874186 Energy: 1.4114514922814738 Energy: 1.4614337689874186 Energy: 1.4114514922814738 Energy: 1.4614337689874186 Energy: 1.6926897519914421 Energy: 1.616706788238027 Energy: 1.6926897519914421 Energy: 1.616706788238027 Energy: 1.6926897519914421 Energy: 1.6167067882384885 Energy: 1.5497446441302845 Energy: 1.4103609210389183 Energy: 1.5497446441302845 Energy: 1.4103609210389183 Energy: 1.5497446441302845 Energy: 1.4103609210389183 Energy: 1.4540115944614407 Energy: 1.4379407169397609 Energy: 1.4540115944614407 Energy: 1.4379407169397609 Energy: 1.454011594460979 Energy: 1.4379407169397609 Energy: 1.663543025717898 Energy: 1.649809564976059 Energy: 1.663543025717898 Energy: 1.649809564976059 Energy: 1.663543025717898 Energy: 1.649809564976059 Energy: 1.3209224967415318 Energy: 1.689238253444485 Energy: 1.3209224967415318 Energy: 1.689238253444485 Energy: 1.3209224967415318 Energy: 1.689238253444485 Energy: 1.4611410971026502 Energy: 1.4148113556784692 Energy: 1.4611410971026502 Energy: 1.4148113556780078 Energy: 1.4611410971026502 Energy: 1.4148113556784692 Energy: 1.3855209930955374 Energy: 1.7373322668709237 Energy: 1.3855210830644211 Energy: 1.7373322668700006 Energy: 1.3855209930959989 Energy: 1.7373322668700006 Energy: 1.6179636588993616 Energy: 1.551254038684275 Energy: 1.6179636549991505 Energy: 1.551254038684275 Energy: 1.6179635081612853 Energy: 1.551254038684275 Energy: 1.4110292981387633 Energy: 1.45387115371995 Energy: 1.4111607562619233 Energy: 1.45387115371995 Energy: 1.4110292981387633 Energy: 1.45387115371995 Energy: 1.730197626150459 Energy: 1.628477812897229 Energy: 1.669451521910675 Energy: 1.6284778128967676 Energy: 1.730197626150459 Energy: 1.628477812897229 Energy: 1.7291641152935162 Energy: 1.6132617078179572 Energy: 1.6684260875146155 Energy: 1.6132617078184186 Energy: 1.7291641152935162 Energy: 1.6132617078184186 Energy: 1.4104318351407286 Energy: 1.3873296894095775 Energy: 1.4104318351407286 Energy: 1.3873296894095775 Energy: 1.4104318351407286 Energy: 1.3873296894095775 Energy: 1.74294211247164 Energy: 1.4604289802544899 Energy: 1.7429421124711786 Energy: 1.4604289802540287 Energy: 1.7429421124711786 Energy: 1.4604289802540287 Energy: 1.3857992809185522 Energy: 1.5077514283544111 Energy: 1.3857992809185522 Energy: 1.5077491867603705 Energy: 1.3857992809185522 Energy: 1.507751332542552 Energy: 1.5496725424849846 Energy: 1.4144517041222853 Energy: 1.549672542485446 Energy: 1.4144517041222853 Energy: 1.549672542485446 Energy: 1.4144517041222853 Energy: 1.3732465439253223 Energy: 1.4286080235039778 Energy: 1.3732465439253223 Energy: 1.4286080243434287 Energy: 1.3732465439253223 Energy: 1.4286080231414084 Energy: 1.6945245528691908 Energy: 1.649803866131456 Energy: 1.6945061715660006 Energy: 1.6498038661319174 Energy: 1.6945245528691908 Energy: 1.649803866131456 Energy: 1.4616952727074226 Energy: 1.5713578815236193 Energy: 1.4616952727074226 Energy: 1.5713578815236193 Energy: 1.4616952727074226 Energy: 1.5713578815236193 Energy: 1.459181268542815 Energy: 1.411512408794287 Energy: 1.4591812685432763 Energy: 1.4115124087938253 Energy: 1.459181268542815 Energy: 1.4115124087947482 Energy: 1.6233705218685477 Energy: 1.6973700699064367 Energy: 1.6233705218685477 Energy: 1.6973700699064367 Energy: 1.623370521869009 Energy: 1.6973700699064367 Energy: 1.4107367767375216 Energy: 1.5498318503632986 Energy: 1.410748186121865 Energy: 1.5498318503632986 Energy: 1.4107367767375216 Energy: 1.5498318503632986 Energy: 1.4508125383950692 Energy: 1.4513477019011758 Energy: 1.4508125383950692 Energy: 1.4513477019016374 Energy: 1.4508125383950692 Energy: 1.4513477019011758 Energy: 1.5831068142967417 Energy: 1.6670512871403866 Energy: 1.5831068142967417 Energy: 1.6670512871403866 Energy: 1.5831068142962805 Energy: 1.6670512871403866 Energy: 1.728426201146115 Energy: 1.3201659046572685 Energy: 1.7284262011465763 Energy: 1.3201659046577299 Energy: 1.7284262011465763 Energy: 1.3201659046572685 Energy: 1.4113133103345699 Energy: 1.3862588532512718 Energy: 1.4113133103350308 Energy: 1.3862588532512718 Energy: 1.4113133103345699 Energy: 1.3862588532517335 minimum gb energy = 1.3201659046572685 eV minimum distance = 2.3300639146312 Angstroms sigma value = 51 ======================================== theta = 26.525352016609688 ======================================== Energy: 1.5394233856990251 Energy: 1.5680957284130437 Energy: 1.5394233856990251 Energy: 1.5680957284130437 Energy: 1.5394233856990251 Energy: 1.5680957284130437 Energy: 1.6608067489503064 Energy: 1.461497276874575 Energy: 1.6608067489503064 Energy: 1.461497276874575 Energy: 1.6608067489503064 Energy: 1.461497276874575 Energy: 1.482455930678505 Energy: 1.5493823174302634 Energy: 1.482455930678505 Energy: 1.5493823174302634 Energy: 1.482455930678505 Energy: 1.5493823174313326 Energy: 1.5353584139112113 Energy: 1.3429869423859149 Energy: 1.5353584139112113 Energy: 1.3429869423859149 Energy: 1.5353584139112113 Energy: 1.3429869423859149 Energy: 1.5546193007727134 Energy: 1.4965026037972644 Energy: 1.5546193007727134 Energy: 1.4965026037972644 Energy: 1.5546193007727134 Energy: 1.4965026037972644 Energy: 1.445114125652016 Energy: 1.496386314773697 Energy: 1.445114125652016 Energy: 1.496386314773697 Energy: 1.445114125652016 Energy: 1.496386314773697 Energy: 1.5399344141967026 Energy: 1.4963754602761803 Energy: 1.5399344141967026 Energy: 1.4963754602761803 Energy: 1.5399344141967026 Energy: 1.4963754602761803 Energy: 1.420104626871848 Energy: 1.4982317081530991 Energy: 1.420104626871848 Energy: 1.4982317081530991 Energy: 1.420104626871848 Energy: 1.4982317081530991 Energy: 1.7426408512390978 Energy: 1.3370311839163733 Energy: 1.7426408512390978 Energy: 1.3370311839163733 Energy: 1.7426408512390978 Energy: 1.3370311839163733 Energy: 1.364431721452695 Energy: 1.5713861848825932 Energy: 1.3644317214537645 Energy: 1.5713861848825932 Energy: 1.364431721452695 Energy: 1.5713861848825932 Energy: 1.6214291029765748 Energy: 1.3438609607302296 Energy: 1.6214291029765748 Energy: 1.3438609607302296 Energy: 1.6214291029765748 Energy: 1.3438609607302296 Energy: 1.5354857985331913 Energy: 1.5713549541963965 Energy: 1.5354857985331913 Energy: 1.5713549541963965 Energy: 1.5354857985331913 Energy: 1.5713549541963965 Energy: 1.657951304925899 Energy: 1.4595783530425392 Energy: 1.657951304925899 Energy: 1.4595783530425392 Energy: 1.657951304925899 Energy: 1.4595783530425392 Energy: 1.4825451613477512 Energy: 1.4395315371080106 Energy: 1.4825451613477512 Energy: 1.4395315371080106 Energy: 1.4825451613466822 Energy: 1.4395315371080106 Energy: 1.541884172964907 Energy: 1.5467754892393646 Energy: 1.541884172964907 Energy: 1.5467754892393646 Energy: 1.541884172964907 Energy: 1.5467754892393646 Energy: 1.5546557836129233 Energy: 1.4963007217392823 Energy: 1.5546557836129233 Energy: 1.4963007217392823 Energy: 1.5546557836129233 Energy: 1.4963007217392823 Energy: 1.5555182282185287 Energy: 1.6195044215539995 Energy: 1.5555182282185287 Energy: 1.6195044215539995 Energy: 1.5555182282185287 Energy: 1.6195044215539995 Energy: 1.5402354279685382 Energy: 1.5018350852669151 Energy: 1.5402354279685382 Energy: 1.5018350852669151 Energy: 1.5402354279685382 Energy: 1.5018350852679843 minimum gb energy = 1.3370311839163733 eV minimum distance = 2.2407913783728 Angstroms sigma value = 19 ======================================== theta = 31.586338096527925 ======================================== Energy: 1.277516317653059 Energy: 1.3081099243650216 Energy: 1.277516317653059 Energy: 1.3081099243650216 Energy: 1.2775163176536932 Energy: 1.3081099243650216 Energy: 1.4312737282626775 Energy: 1.5529852186833546 Energy: 1.4312737282626775 Energy: 1.5529852186839888 Energy: 1.4312737282626775 Energy: 1.5529852186833546 Energy: 1.2337413581136456 Energy: 1.5499983380986304 Energy: 1.2337413581136456 Energy: 1.5499983380986304 Energy: 1.2337413581130114 Energy: 1.5499983380986304 Energy: 1.3426235526405965 Energy: 1.2338428217047623 Energy: 1.3426235526405965 Energy: 1.2338428217047623 Energy: 1.3426235526405965 Energy: 1.2338428217047623 Energy: 1.2661211263193415 Energy: 1.2738059837413016 Energy: 1.2661211263193415 Energy: 1.2738059837413016 Energy: 1.2661211263193415 Energy: 1.2738059837413016 Energy: 1.2660780603059727 Energy: 1.2738008983737161 Energy: 1.2660780603053385 Energy: 1.2738008983737161 Energy: 1.2660780603053385 Energy: 1.2738008983737161 Energy: 1.3426086843569243 Energy: 1.2338447777699582 Energy: 1.3426086843569243 Energy: 1.2338447777699582 Energy: 1.3426086843569243 Energy: 1.2338447777699582 Energy: 1.2337851284385355 Energy: 1.5499920948142611 Energy: 1.2337851284391699 Energy: 1.5499920948142611 Energy: 1.2337851284391699 Energy: 1.5499920948142611 Energy: 1.4312189642403645 Energy: 1.5529738752434832 Energy: 1.4312189642403645 Energy: 1.5529738752434832 Energy: 1.4312189642397304 Energy: 1.5529738752434832 Energy: 1.277516317653059 Energy: 1.3081099243650216 Energy: 1.277516317653059 Energy: 1.3081099243650216 Energy: 1.2775163176536932 Energy: 1.3081099243650216 Energy: 1.4312737282626775 Energy: 1.5529852186833546 Energy: 1.4312737282626775 Energy: 1.5529852186839888 Energy: 1.4312737282626775 Energy: 1.5529852186833546 Energy: 1.2337413581130114 Energy: 1.5499983380986304 Energy: 1.2337413581136456 Energy: 1.5499983380986304 Energy: 1.2337413581130114 Energy: 1.5499983380986304 Energy: 1.3426235526405965 Energy: 1.2338428217047623 Energy: 1.3426235526405965 Energy: 1.2338428217047623 Energy: 1.3426235526405965 Energy: 1.2338428217047623 Energy: 1.2661211263193415 Energy: 1.2738059837419358 Energy: 1.2661211263193415 Energy: 1.2738059837413016 Energy: 1.2661211263193415 Energy: 1.2738059837419358 Energy: 1.2660780603053385 Energy: 1.2738008983737161 Energy: 1.2660780603053385 Energy: 1.2738008983737161 Energy: 1.2660780603059727 Energy: 1.2738008983737161 Energy: 1.3426086843569243 Energy: 1.2338447777699582 Energy: 1.3426086843569243 Energy: 1.2338447777699582 Energy: 1.3426086843569243 Energy: 1.2338447777699582 Energy: 1.2337851284385355 Energy: 1.5499920948142611 Energy: 1.2337851284391699 Energy: 1.5499920948142611 Energy: 1.2337851284391699 Energy: 1.5499920948142611 Energy: 1.4312189642403645 Energy: 1.5529738752434832 Energy: 1.4312189642403645 Energy: 1.5529738752434832 Energy: 1.4312189642403645 Energy: 1.5529738752434832 Energy: 1.277516317653059 Energy: 1.3081099243650216 Energy: 1.2775163176536932 Energy: 1.3081099243650216 Energy: 1.2775163176536932 Energy: 1.3081099243650216 Energy: 1.4312737282626775 Energy: 1.5529852186833546 Energy: 1.4312737282626775 Energy: 1.5529852186833546 Energy: 1.4312737282626775 Energy: 1.5529852186833546 Energy: 1.2337413581130114 Energy: 1.5499983380986304 Energy: 1.2337413581130114 Energy: 1.5499983380986304 Energy: 1.2337413581136456 Energy: 1.5499983380986304 Energy: 1.3426235526405965 Energy: 1.2338428217053967 Energy: 1.3426235526405965 Energy: 1.2338428217047623 Energy: 1.3426235526405965 Energy: 1.2338428217041282 Energy: 1.2661211263193415 Energy: 1.2738059837419358 Energy: 1.2661211263193415 Energy: 1.2738059837419358 Energy: 1.2661211263193415 Energy: 1.2738059837413016 Energy: 1.2660780603053385 Energy: 1.2738008983737161 Energy: 1.2660780603059727 Energy: 1.2738008983743503 Energy: 1.2660780603053385 Energy: 1.2738008983743503 Energy: 1.3426086843569243 Energy: 1.2338447777699582 Energy: 1.3426086843569243 Energy: 1.2338447777699582 Energy: 1.3426086843569243 Energy: 1.2338447777699582 Energy: 1.2337851284391699 Energy: 1.5499920948142611 Energy: 1.2337851284385355 Energy: 1.5499920948142611 Energy: 1.2337851284391699 Energy: 1.5499920948136272 Energy: 1.4312189642403645 Energy: 1.5529738752434832 Energy: 1.4312189642403645 Energy: 1.5529738752434832 Energy: 1.4312189642403645 Energy: 1.5529738752434832 Energy: 1.277516317653059 Energy: 1.3081099243650216 Energy: 1.277516317653059 Energy: 1.3081099243650216 Energy: 1.277516317653059 Energy: 1.3081099243650216 Energy: 1.4312737282626775 Energy: 1.5529852186833546 Energy: 1.4312737282626775 Energy: 1.5529852186833546 Energy: 1.4312737282620431 Energy: 1.5529852186833546 Energy: 1.2337413581136456 Energy: 1.5499983380986304 Energy: 1.2337413581130114 Energy: 1.5499983380986304 Energy: 1.2337413581136456 Energy: 1.5499983380986304 minimum gb energy = 1.2337413581130114 eV minimum distance = 2.25255624102903 Angstroms sigma value = 27 ======================================== theta = 38.94244126898138 ======================================== Energy: 1.2445127662156272 Energy: 1.2132595847614092 Energy: 1.2445127662156272 Energy: 1.2132595847614092 Energy: 1.2445127662156272 Energy: 1.2132595847614092 Energy: 1.432999153536263 Energy: 1.2549822348077635 Energy: 1.432999153533156 Energy: 1.2549822348077635 Energy: 1.4329991535300493 Energy: 1.2549822348077635 Energy: 1.2737031849246434 Energy: 1.3969237333266937 Energy: 1.2737031849230902 Energy: 1.3969237333266937 Energy: 1.2737031849122158 Energy: 1.3969237333266937 Energy: 1.417324583428909 Energy: 1.177014159691939 Energy: 1.417324583428909 Energy: 1.177014159691939 Energy: 1.417324583428909 Energy: 1.177014159691939 Energy: 1.4151723829963234 Energy: 1.1770062171246418 Energy: 1.4151723829963234 Energy: 1.1770062171246418 Energy: 1.4151723829963234 Energy: 1.1770062171246418 Energy: 1.438958848549841 Energy: 1.4904637873356403 Energy: 1.438958848549841 Energy: 1.4904637873356403 Energy: 1.438958848549841 Energy: 1.4904637873356403 Energy: 1.3324982237240663 Energy: 1.2584054390950499 Energy: 1.3324982237240663 Energy: 1.2584054390950499 Energy: 1.3324982237240663 Energy: 1.2584054390950499 Energy: 1.2378263113174255 Energy: 1.2190002499513055 Energy: 1.2378263113174255 Energy: 1.2190002499513055 Energy: 1.2378263113174255 Energy: 1.2190002499513055 Energy: 1.4315582020077597 Energy: 1.2734737351110013 Energy: 1.4315582020077597 Energy: 1.273473748634021 Energy: 1.4315582020077597 Energy: 1.2734737744471485 Energy: 1.385359012801361 Energy: 1.4285348535789621 Energy: 1.385359012801361 Energy: 1.4285348535789621 Energy: 1.385359012801361 Energy: 1.4285348535789621 Energy: 1.4194571873363202 Energy: 1.1777209293150377 Energy: 1.419457187320821 Energy: 1.1777209293150377 Energy: 1.2146926624867047 Energy: 1.1777209293150377 Energy: 1.4916256864804998 Energy: 1.3520840213501004 Energy: 1.4916256864789463 Energy: 1.3520840213501004 Energy: 1.4916256864804998 Energy: 1.3520840213501004 minimum gb energy = 1.1770062171246418 eV minimum distance = 2.23141729710029 Angstroms sigma value = 9 ======================================== theta = 44.00342734889962 ======================================== Energy: 1.2425611363034652 Energy: 1.188535507663447 Energy: 1.2425611363034652 Energy: 1.1885355076630104 Energy: 1.2425611363039015 Energy: 1.1885355076630104 Energy: 1.1808276982453625 Energy: 1.2005761970023516 Energy: 1.1808276982453625 Energy: 1.2005761970023516 Energy: 1.1808276982453625 Energy: 1.2005761970023516 Energy: 1.0963970200656172 Energy: 1.2104171307853802 Energy: 1.0963970200656172 Energy: 1.2104171307849438 Energy: 1.0963970200656172 Energy: 1.2104171307849438 Energy: 1.1166363214491646 Energy: 1.0712483826766006 Energy: 1.1166363214491646 Energy: 1.0712483826761643 Energy: 1.1166363214491646 Energy: 1.0712483826766006 Energy: 1.2076833915253227 Energy: 1.1681421770335352 Energy: 1.2076833915253227 Energy: 1.1681421770330986 Energy: 1.2076833915253227 Energy: 1.1681421770335352 Energy: 1.2232006667010553 Energy: 1.238859104841473 Energy: 1.2232006667010553 Energy: 1.245763524491122 Energy: 1.2232006667010553 Energy: 1.2388591048410365 Energy: 1.1403457047606849 Energy: 1.271874082694256 Energy: 1.1403457047602483 Energy: 1.271874082694256 Energy: 1.1403457047606849 Energy: 1.271874082694256 Energy: 1.0489657121862364 Energy: 1.212652613156063 Energy: 1.0489657121862364 Energy: 1.212652613156063 Energy: 1.0489657121862364 Energy: 1.212652613156063 Energy: 1.2159953229741471 Energy: 1.1683838647892213 Energy: 1.2159953229728377 Energy: 1.1683838647896578 Energy: 1.215995322973274 Energy: 1.1683838647892213 Energy: 1.2134244323227206 Energy: 1.246820449489792 Energy: 1.2134244323227206 Energy: 1.246820449489792 Energy: 1.2134244323227206 Energy: 1.246820449489792 Energy: 1.1131924697587565 Energy: 1.080848727489606 Energy: 1.1131924697587565 Energy: 1.080848727489606 Energy: 1.1131924697587565 Energy: 1.080848727489606 Energy: 1.1544949085939427 Energy: 1.260321463273512 Energy: 1.1544949085935061 Energy: 1.2603214632739488 Energy: 1.1544949085939427 Energy: 1.2603214632739488 Energy: 1.174764822773358 Energy: 1.182713215525404 Energy: 1.174764822773358 Energy: 1.1827132155258404 Energy: 1.174764822773358 Energy: 1.1827132155258404 Energy: 1.2368721424220686 Energy: 1.1071904031035138 Energy: 1.236872142421632 Energy: 1.1071904031035138 Energy: 1.236872142421632 Energy: 1.107190403102641 Energy: 1.091416027168087 Energy: 1.2021694452468197 Energy: 1.091416027168087 Energy: 1.2021694452468197 Energy: 1.0914160271676507 Energy: 1.2021694452472562 Energy: 1.1087658348788854 Energy: 1.1800669740030088 Energy: 1.1087658348788854 Energy: 1.1800669740030088 Energy: 1.108765834878449 Energy: 1.1800669740030088 Energy: 1.4216406461955202 Energy: 1.0719043816959837 Energy: 1.4216406461955202 Energy: 1.0719043816959837 Energy: 1.4216406461955202 Energy: 1.0719043816959837 Energy: 1.1053367625683923 Energy: 1.1628868021254726 Energy: 1.1053367625683923 Energy: 1.1628868021254726 Energy: 1.1053367625683923 Energy: 1.1628868021254726 Energy: 1.0443306230674374 Energy: 1.4353638378238918 Energy: 1.0443306230674374 Energy: 1.4353638378238918 Energy: 1.0443306230674374 Energy: 1.4353638378238918 Energy: 1.2999852717558393 Energy: 1.078978936487213 Energy: 1.2999852717558393 Energy: 1.078978936488959 Energy: 1.2999852717558393 Energy: 1.0789789364893954 Energy: 1.0443422037100143 Energy: 1.435975105242481 Energy: 1.0443422037095778 Energy: 1.435975105242917 Energy: 1.0443422037100143 Energy: 1.435975105242481 Energy: 1.1053626473131553 Energy: 1.1630423353573518 Energy: 1.1053626473131553 Energy: 1.1630423353573518 Energy: 1.1053626473135916 Energy: 1.1630423353569157 Energy: 1.421432085715894 Energy: 1.0719355565634312 Energy: 1.4214320857163305 Energy: 1.0719355565629947 Energy: 1.4214320857163305 Energy: 1.0719355565629947 Energy: 1.1086647101934606 Energy: 1.2156332794410942 Energy: 1.1086647101934606 Energy: 1.2156332794410942 Energy: 1.1086647101938971 Energy: 1.2156332794410942 Energy: 1.091367431714595 Energy: 1.201883423178865 Energy: 1.091367431714595 Energy: 1.201883423178865 Energy: 1.0913674317141586 Energy: 1.201883423178865 Energy: 1.2371178856650433 Energy: 1.20717574909238 Energy: 1.2371178856646068 Energy: 1.20717574909238 Energy: 1.2371178856650433 Energy: 1.2071757490928168 Energy: 1.1747451816570424 Energy: 1.1826416171386376 Energy: 1.1747451816570424 Energy: 1.182641617139074 Energy: 1.1747451816570424 Energy: 1.1826416171386376 Energy: 1.1544479877460618 Energy: 1.1650738043045439 Energy: 1.1544479877460618 Energy: 1.1650738043045439 Energy: 1.1544479877460618 Energy: 1.1650738043045439 Energy: 1.1128810558140958 Energy: 1.080813237716198 Energy: 1.1128810558140958 Energy: 1.080813237716198 Energy: 1.1128810558140958 Energy: 1.0808132377157615 Energy: 1.2130029852387545 Energy: 1.1313779418055316 Energy: 1.213002985239191 Energy: 1.1313779418050953 Energy: 1.2130029852387545 Energy: 1.131377941806365 Energy: 1.2157459505573518 Energy: 1.16836538866917 Energy: 1.2157459505573518 Energy: 1.16836538866917 Energy: 1.2157459505573518 Energy: 1.16836538866917 Energy: 1.048972477794503 Energy: 1.2125279041598416 Energy: 1.048972477794503 Energy: 1.2125279041598416 Energy: 1.048972477794503 Energy: 1.212527904160278 Energy: 1.1402928438214197 Energy: 1.2715137637910534 Energy: 1.1402928438218563 Energy: 1.2715137637910534 Energy: 1.1402928438218563 Energy: 1.2715137637914902 Energy: 1.2231538546531286 Energy: 1.1926662594795132 Energy: 1.2231538546531286 Energy: 1.1926662594795132 Energy: 1.2231538546531286 Energy: 1.1926662594795132 Energy: 1.207855098519709 Energy: 1.1682073816177538 Energy: 1.207855098519709 Energy: 1.1682073816181904 Energy: 1.2078550985192724 Energy: 1.1682073816177538 Energy: 1.1165835823841344 Energy: 1.0711625620581735 Energy: 1.1165835823841344 Energy: 1.0711625620581735 Energy: 1.1165835823841344 Energy: 1.0711625620577372 Energy: 1.0963479386474768 Energy: 1.2104938494271125 Energy: 1.0963479386470403 Energy: 1.2104938494271125 Energy: 1.0963479386470403 Energy: 1.2104938494271125 Energy: 1.1804049053997525 Energy: 1.0805807549335296 Energy: 1.1804049053997525 Energy: 1.0805807549339663 Energy: 1.1804049053997525 Energy: 1.0805807549335296 Energy: 1.242561136303029 Energy: 1.1885355076630104 Energy: 1.242561136303029 Energy: 1.1885355076630104 Energy: 1.2425611363034652 Energy: 1.1885355076630104 Energy: 1.1808276982436168 Energy: 1.1598373507265625 Energy: 1.1808276982436168 Energy: 1.1598373507261257 Energy: 1.180827698244053 Energy: 1.1598373507265625 Energy: 1.0963970200656172 Energy: 1.2104171307853802 Energy: 1.0963970200656172 Energy: 1.2104171307849438 Energy: 1.0963970200656172 Energy: 1.2104171307853802 Energy: 1.1166363214491646 Energy: 1.0712483826761643 Energy: 1.1166363214491646 Energy: 1.0712483826761643 Energy: 1.1166363214491646 Energy: 1.0712483826761643 Energy: 1.2076833915253227 Energy: 1.1681421770330986 Energy: 1.2076833915253227 Energy: 1.1681421770330986 Energy: 1.2076833915253227 Energy: 1.1681421770330986 minimum gb energy = 1.0443306230674374 eV minimum distance = 2.27683580712219 Angstroms sigma value = 57 ======================================== theta = 50.47880364135782 ======================================== Energy: 1.1153749193372493 Energy: 1.0272793534606508 Energy: 0.5464488320407181 Energy: 1.0272793534606508 Energy: 1.1153749193372493 Energy: 1.0272793534606508 Energy: 1.1621213386563203 Energy: 1.0145887418875796 Energy: 1.1621213386563203 Energy: 1.0143601927184365 Energy: 1.1621213386563203 Energy: 1.0145887418875796 Energy: 1.0821963143207223 Energy: 1.3242785536013726 Energy: 1.0821963143207223 Energy: 0.9549158602751295 Energy: 1.0821963143207223 Energy: 1.3242785536013726 Energy: 1.029389208291497 Energy: 0.7355103218062952 Energy: 1.029389208291497 Energy: 0.7354985186280958 Energy: 1.029389208291497 Energy: 0.7355103218062952 Energy: 0.6779160526986796 Energy: 1.1680082351008598 Energy: 0.6779160526986796 Energy: 1.1680082351008598 Energy: 0.6779160526986796 Energy: 1.1680082351008598 Energy: 0.92587876658958 Energy: 1.0830015795338548 Energy: 0.5456265322597585 Energy: 1.0830015795338548 Energy: 0.92587876658958 Energy: 1.0830015795338548 Energy: 0.9259230206805819 Energy: 0.6090895815104771 Energy: 0.5455250845812164 Energy: 0.6090895815114707 Energy: 0.9259230206805819 Energy: 0.6090895815104771 Energy: 1.1638397865848646 Energy: 0.6833148101463169 Energy: 1.1638397865848646 Energy: 0.6833148101463169 Energy: 1.1638397865848646 Energy: 0.6833148101463169 Energy: 1.030155976160159 Energy: 0.7355058428266515 Energy: 1.030155976160159 Energy: 0.735497553467334 Energy: 1.030155976160159 Energy: 0.735505842825658 Energy: 0.6068679911642728 Energy: 1.2345348016005842 Energy: 0.6068679911642728 Energy: 1.2345348016005842 Energy: 0.6068679911642728 Energy: 1.2345348016005842 Energy: 0.678759553700138 Energy: 1.0175799374744667 Energy: 0.678759553700138 Energy: 1.0175799374744667 Energy: 0.678759553700138 Energy: 1.0175799374744667 Energy: 1.1153749193372493 Energy: 1.0272793534606508 Energy: 0.5464488320407181 Energy: 1.0272793534606508 Energy: 1.1153749193362557 Energy: 1.0272793534606508 Energy: 1.1621213386563203 Energy: 1.0145887418875796 Energy: 1.1621213386563203 Energy: 1.014360192717443 Energy: 1.1621213386563203 Energy: 1.0145887418875796 Energy: 1.0821963143207223 Energy: 1.3242785536013726 Energy: 1.0821963143207223 Energy: 0.9549158602751295 Energy: 1.0821963143207223 Energy: 1.3242785536013726 Energy: 1.0293892082924907 Energy: 0.7355103218062952 Energy: 1.029389208291497 Energy: 0.7354985186280958 Energy: 1.029389208291497 Energy: 0.7355103218062952 Energy: 0.6779160526986796 Energy: 1.1680082351008598 Energy: 0.6779160526986796 Energy: 1.1680082351008598 Energy: 0.6779160526986796 Energy: 1.1680082351008598 Energy: 0.92587876658958 Energy: 1.0830015795338548 Energy: 0.5456265322597585 Energy: 1.0830015795328614 Energy: 0.92587876658958 Energy: 1.0830015795338548 Energy: 0.9259230206805819 Energy: 0.6090895815104771 Energy: 0.5455250845812164 Energy: 0.6090895815104771 Energy: 0.9259230206805819 Energy: 0.6090895815114707 Energy: 1.1638397865848646 Energy: 0.6833148101463169 Energy: 1.1638397865848646 Energy: 0.6833148101463169 Energy: 1.1638397865848646 Energy: 0.6833148101463169 minimum gb energy = 0.5455250845812164 eV minimum distance = 2.3748639014181 Angstroms sigma value = 11 ======================================== theta = 55.8767054592047 ======================================== Energy: 0.9523949326788989 Energy: 0.9427328371036029 Energy: 0.9523949326788989 Energy: 0.9427328371036029 Energy: 0.9523949326788989 Energy: 0.9427328371043308 Energy: 1.1897408384830732 Energy: 1.0178064877771913 Energy: 1.1897408384830732 Energy: 1.0178064877771913 Energy: 1.1897408384830732 Energy: 1.0178064877771913 Energy: 1.2059776545289391 Energy: 1.3342347852493317 Energy: 1.205977654529667 Energy: 1.3342347852493317 Energy: 1.2059776545289391 Energy: 1.3342347852486038 Energy: 1.282200700412857 Energy: 0.8894430245474173 Energy: 1.282200700412857 Energy: 0.8894430245466893 Energy: 1.282200700412857 Energy: 0.8894430245466893 Energy: 0.8973722798659236 Energy: 0.8641255301145258 Energy: 0.8973722798659236 Energy: 0.8641255301145258 Energy: 0.8973722798659236 Energy: 0.8641255301145258 Energy: 1.0639550099181023 Energy: 0.8788822461925068 Energy: 1.0639550099181023 Energy: 0.8788822461925068 Energy: 1.0639550099188302 Energy: 0.8788822461925068 Energy: 0.9495349879703932 Energy: 0.9300079056178445 Energy: 0.9495349879697316 Energy: 0.9300079056185723 Energy: 0.9495349879697316 Energy: 0.9300079056178445 Energy: 1.1814331919156107 Energy: 0.8219194537318144 Energy: 1.1814331919156107 Energy: 0.8219194537318144 Energy: 1.1814331919156107 Energy: 0.8219194537325423 Energy: 1.0592995713260116 Energy: 0.8287747773754083 Energy: 1.0592995713260116 Energy: 0.8287747773754083 Energy: 1.0592995713260116 Energy: 0.8287747773754083 Energy: 0.8374262441740624 Energy: 1.2628876603253951 Energy: 0.8374262441740624 Energy: 1.2628876603253951 Energy: 0.8374262441740624 Energy: 1.2628876603246675 Energy: 1.0681920015260051 Energy: 1.0750916118090066 Energy: 1.0681920015260051 Energy: 1.0750916118090066 Energy: 1.0681920015260051 Energy: 1.0750916118090066 Energy: 0.8991748490063498 Energy: 0.8678110621702724 Energy: 0.8991748490063498 Energy: 0.8678110621702724 Energy: 0.8991748490063498 Energy: 0.8678110621702724 Energy: 1.047483144320662 Energy: 0.8981567005439209 Energy: 1.047483144320662 Energy: 0.8981567005439209 Energy: 1.047483144320662 Energy: 0.8981567005439209 Energy: 1.1851523335322627 Energy: 1.2986265620065516 Energy: 1.1851523335322627 Energy: 1.2986265620065516 Energy: 1.1851523335322627 Energy: 1.2986265620065516 Energy: 1.1876084280435186 Energy: 1.0139211992721238 Energy: 1.1876084280435186 Energy: 1.0139211992713957 Energy: 1.1876084280435186 Energy: 1.0139211992713957 Energy: 0.9120561576154579 Energy: 1.1798278979505747 Energy: 0.9120561576154579 Energy: 1.1798278979505747 Energy: 0.9120561576147299 Energy: 1.1798278979513022 Energy: 1.034447360998144 Energy: 1.008183592509398 Energy: 1.034447360998144 Energy: 1.0081835925086702 Energy: 1.034447360998144 Energy: 1.0081835925086702 Energy: 1.4778618696794412 Energy: 0.9775432965102688 Energy: 1.4778618696787134 Energy: 0.9775432965124523 Energy: 1.4778618696787134 Energy: 0.9775432965131802 Energy: 1.081297522090577 Energy: 0.8827493381179544 Energy: 1.081297522089849 Energy: 0.8827493381179544 Energy: 1.081297522089849 Energy: 0.8827493381172266 Energy: 0.8972117695891056 Energy: 1.0371116874102988 Energy: 0.897211769595656 Energy: 1.0371116874102988 Energy: 0.8972117695774603 Energy: 1.0371116874102988 Energy: 0.8410612988643299 Energy: 0.8829883482467054 Energy: 0.8410612988643299 Energy: 0.8829883482467054 Energy: 0.8410612988643299 Energy: 0.8829883482467054 Energy: 0.890053094905872 Energy: 0.9301623703258994 Energy: 0.890053094905872 Energy: 0.9301623703258994 Energy: 0.890053094905872 Energy: 0.9301623703258994 Energy: 1.043478759898248 Energy: 1.0357391701992702 Energy: 1.043478759898248 Energy: 1.0357391701992702 Energy: 1.043478759898248 Energy: 1.0357391701992702 Energy: 1.0566839603181348 Energy: 0.8826350970972151 Energy: 1.0566839603181348 Energy: 0.8826350970964872 Energy: 1.0566839603181348 Energy: 0.8826350970979431 Energy: 0.841112885277826 Energy: 1.262055766149513 Energy: 0.841112885277826 Energy: 1.262055766149513 Energy: 0.841112885277826 Energy: 1.262055766149513 Energy: 1.6584408136861981 Energy: 1.0732031220524414 Energy: 1.6584408136861981 Energy: 1.0732031220524414 Energy: 1.6584408136861981 Energy: 1.0732031220531693 minimum gb energy = 0.8219194537318144 eV minimum distance = 2.28510178111834 Angstroms sigma value = 41 ======================================== theta = 58.99241699313286 ======================================== Energy: 1.0828124574759712 Energy: 0.9723998291529053 Energy: 1.0828124574759712 Energy: 0.9723998291529053 Energy: 1.0828124574759712 Energy: 0.9723998291529053 Energy: 1.0172106658641562 Energy: 1.2042051231656035 Energy: 1.0172106658641562 Energy: 1.2042051231656035 Energy: 1.0172106658641562 Energy: 1.2042051231656035 Energy: 1.1330423239695917 Energy: 1.1028934970493565 Energy: 1.1330423239695917 Energy: 1.1028934970493565 Energy: 1.1330423239695917 Energy: 1.1028934970493565 Energy: 1.0014999698579607 Energy: 0.9360385976173876 Energy: 1.0014999698579607 Energy: 0.9360385976173876 Energy: 1.0014999698579607 Energy: 0.9360385976173876 Energy: 0.9344671980608884 Energy: 1.015704164855679 Energy: 0.9344671980608884 Energy: 1.0157041648562528 Energy: 0.9344671980608884 Energy: 1.0157041648562528 Energy: 1.2370036857918931 Energy: 1.21724733234278 Energy: 1.2370036857918931 Energy: 1.21724733234278 Energy: 1.2370036857918931 Energy: 1.21724733234278 Energy: 0.9327797100642102 Energy: 1.3930021636674532 Energy: 0.9327797100642102 Energy: 1.3930021636674532 Energy: 0.9327797100636366 Energy: 1.3930021636674532 Energy: 0.9016892777834157 Energy: 0.9361657267678484 Energy: 0.9016892777834157 Energy: 0.936165726768422 Energy: 0.9016892777834157 Energy: 0.936165726768422 Energy: 0.9508109479949861 Energy: 1.0064836282725234 Energy: 0.9508109479944126 Energy: 1.0064836282725234 Energy: 0.9508109479949861 Energy: 1.0064836282725234 Energy: 0.9879535452611197 Energy: 1.0183404017007114 Energy: 0.9879535452611197 Energy: 1.018340401701285 Energy: 0.9879535452611197 Energy: 1.018340401701285 Energy: 0.9962849596977804 Energy: 1.0333470468468788 Energy: 0.9962849596972069 Energy: 1.0333470468468788 Energy: 0.9962849596972069 Energy: 1.0333470468468788 Energy: 0.8949148365122302 Energy: 1.1792561980473104 Energy: 0.8949148365116568 Energy: 1.1792561980473104 Energy: 0.8949148365116568 Energy: 1.1792561980473104 Energy: 0.9011841920761448 Energy: 0.9355869779198827 Energy: 0.9011841920761448 Energy: 0.9355869779198827 Energy: 0.9011841920761448 Energy: 0.9355869779198827 Energy: 0.8828596710212472 Energy: 1.0188228749884898 Energy: 0.8828596710206735 Energy: 1.0188228749884898 Energy: 0.8828596710206735 Energy: 1.0188228749884898 Energy: 1.2312218110443065 Energy: 1.2120983049641632 Energy: 1.2312218110443065 Energy: 1.2120983049641632 Energy: 1.2312218110443065 Energy: 1.2120983049641632 Energy: 0.8694611092666825 Energy: 0.9660114071165956 Energy: 0.8694611092666825 Energy: 0.9660114071165956 Energy: 0.8694611092666825 Energy: 0.9660114071165956 Energy: 0.9158506403489931 Energy: 0.9355114792324808 Energy: 0.9158506403489931 Energy: 0.9355114792330544 Energy: 0.9158506403489931 Energy: 0.9355114792324808 Energy: 0.9373461568326267 Energy: 1.103190719065991 Energy: 0.9373461568326267 Energy: 1.103190719065991 Energy: 0.9373461568326267 Energy: 1.1031907190654175 Energy: 1.0164823402456025 Energy: 1.1965101964865261 Energy: 1.0164823402456025 Energy: 1.1965101964865261 Energy: 1.0164823402456025 Energy: 1.1965101964865261 Energy: 0.9894359422069375 Energy: 0.939373169728767 Energy: 0.9894359422069375 Energy: 0.939373169728767 Energy: 0.9894359422069375 Energy: 0.939373169728767 Energy: 0.9161820935923943 Energy: 1.0349706801375083 Energy: 0.9161820935923943 Energy: 1.0349706801363612 Energy: 0.9161820935923943 Energy: 1.0349706801375083 Energy: 0.9541727407416499 Energy: 1.318607048307308 Energy: 0.954172740742797 Energy: 1.318607048307308 Energy: 0.9541727407410762 Energy: 1.318607048307308 Energy: 1.0029582114118618 Energy: 0.9440875224136781 Energy: 1.0029582114112878 Energy: 0.9440875224136781 Energy: 1.0029582114112878 Energy: 0.9440875224136781 Energy: 0.8692097333601619 Energy: 1.0262187547157164 Energy: 0.8692097333601619 Energy: 1.0262187547157164 Energy: 0.8692097333601619 Energy: 1.0262187547157164 Energy: 0.8700918088519566 Energy: 1.2506100158314504 Energy: 0.8700918088519566 Energy: 1.2506100158314504 Energy: 0.8700918088519566 Energy: 1.2506100158314504 Energy: 0.9259882183414652 Energy: 1.0096608918664134 Energy: 0.9259882183414652 Energy: 1.0096608918652659 Energy: 0.9259882183414652 Energy: 1.0096608918658396 Energy: 0.9012317998852658 Energy: 0.9440695134019518 Energy: 0.9012317998852658 Energy: 0.9440695134019518 Energy: 0.9012317998852658 Energy: 0.9440695134019518 Energy: 0.9498673197319988 Energy: 1.0186119297994214 Energy: 0.9498673197319988 Energy: 1.0186119297988476 Energy: 0.9498673197319988 Energy: 1.0186119297994214 Energy: 0.988746826602035 Energy: 1.1975168777759844 Energy: 0.9887468266026086 Energy: 1.1975168777765584 Energy: 0.9887468266026086 Energy: 1.1975168777759844 Energy: 1.0867638071694028 Energy: 0.9597799605955247 Energy: 1.0867638071694028 Energy: 0.9597799606190444 Energy: 1.0867638071694028 Energy: 0.9597799606483007 Energy: 0.8947202682230131 Energy: 1.1730912016637518 Energy: 0.8947202682230131 Energy: 1.1730912016637518 Energy: 0.8947202682230131 Energy: 1.1730912016637518 Energy: 0.9573510968829457 Energy: 0.99360531178647 Energy: 0.9573510968823721 Energy: 0.99360531178647 Energy: 0.9573510968829457 Energy: 0.99360531178647 Energy: 0.8698502524207686 Energy: 0.9536397884182817 Energy: 0.869850252420195 Energy: 0.9536397884182817 Energy: 0.869850252420195 Energy: 0.9536397884182817 minimum gb energy = 0.8692097333601619 eV minimum distance = 2.3127522699191 Angstroms sigma value = 33 ======================================== theta = 62.439396894736774 ======================================== Energy: 1.1117357405077302 Energy: 1.0008802460699224 Energy: 1.1117357405077302 Energy: 1.0008802460702886 Energy: 1.1117357405077302 Energy: 1.0008802460702886 Energy: 1.095681647029417 Energy: 0.9133601191461689 Energy: 1.0956816470298563 Energy: 0.9133601191465349 Energy: 1.095681647029417 Energy: 0.9133601191465349 Energy: 1.0000762890156203 Energy: 1.1298449024645016 Energy: 1.0000762890159862 Energy: 1.1298449024640627 Energy: 1.0000762890156203 Energy: 1.1298449024636965 Energy: 0.9980563745658075 Energy: 0.9766797021882044 Energy: 0.9980563745653683 Energy: 0.9766797021882044 Energy: 0.9980563745653683 Energy: 0.9766797021882044 Energy: 1.0160487714324768 Energy: 1.0666632942751144 Energy: 1.0160487714324768 Energy: 1.0666632942718939 Energy: 1.0160487714321107 Energy: 1.0666632942735041 Energy: 1.4098944361213757 Energy: 1.005391335316437 Energy: 1.409894436121742 Energy: 1.005391335316437 Energy: 1.409894436121742 Energy: 1.0053913353159978 Energy: 0.9816334145719853 Energy: 1.0764288047451274 Energy: 0.9816334145719853 Energy: 1.0764288047451274 Energy: 0.9816334145719853 Energy: 1.0764288047455666 Energy: 1.0352116127092754 Energy: 1.028468119833871 Energy: 1.0352116127092754 Energy: 1.0284681198330659 Energy: 1.0352116127092754 Energy: 1.028468119833505 Energy: 1.1602205668903545 Energy: 1.0422659098138785 Energy: 1.1602205668903545 Energy: 1.0422659098138785 Energy: 1.1602205668907934 Energy: 1.0422659098138785 Energy: 1.4788727879954688 Energy: 0.9785637171452919 Energy: 1.4788727879954688 Energy: 0.9785637171457311 Energy: 1.478872787995908 Energy: 0.9785637171457311 Energy: 1.040374720402955 Energy: 1.0351910051968025 Energy: 1.040374720402955 Energy: 1.0351910051968025 Energy: 1.040374720402955 Energy: 1.0351910051968025 Energy: 1.0125893912796018 Energy: 0.9510647184336187 Energy: 1.0125893904759515 Energy: 0.9510647184339849 Energy: 1.012589391307344 Energy: 0.9510647184339849 Energy: 1.0408349714424594 Energy: 1.1626308904943958 Energy: 1.040834971442093 Energy: 1.1626308904947618 Energy: 1.0408349714424594 Energy: 1.1626308904943958 Energy: 1.028059952321458 Energy: 1.0367371894588169 Energy: 1.0280599523206526 Energy: 1.0367371894588169 Energy: 1.0280599523210188 Energy: 1.0367371894588169 Energy: 1.04744158028403 Energy: 0.9764155343497204 Energy: 1.047441580283664 Energy: 0.9764155343500863 Energy: 1.047441580283664 Energy: 0.9764155343497204 Energy: 0.9849791745045775 Energy: 1.4052862195613969 Energy: 0.9849791745041384 Energy: 1.4052862195613969 Energy: 0.9849791745041384 Energy: 1.4052862195613969 Energy: 1.0677436385861971 Energy: 0.9532683449514323 Energy: 1.0677436385870023 Energy: 0.9532683449514323 Energy: 1.0677436385889785 Energy: 0.9532683449509931 Energy: 0.968222307144391 Energy: 1.0034970990234837 Energy: 0.9682223071439517 Energy: 1.0034970990231178 Energy: 0.9682223071439517 Energy: 1.0034970990239231 Energy: 1.1370004462309242 Energy: 0.9986078213466116 Energy: 1.1370004462309242 Energy: 0.9986078213466116 Energy: 1.1370004462309242 Energy: 0.9986078213461725 Energy: 1.043737013748634 Energy: 1.0120047283725848 Energy: 1.043737013748268 Energy: 1.0120047283725848 Energy: 1.043737013748634 Energy: 1.0120047283725848 Energy: 0.9541621715981548 Energy: 1.0569503676763605 Energy: 0.9541621715981548 Energy: 1.0569503676763605 Energy: 0.9541621715981548 Energy: 1.0569503676759213 Energy: 0.9397335538775978 Energy: 1.0976623460646673 Energy: 0.9397335538775978 Energy: 1.0976623460646673 Energy: 0.9397335538775978 Energy: 1.0976623460646673 Energy: 1.048346156685474 Energy: 0.924180639575033 Energy: 1.0483461566859131 Energy: 0.9241806395753992 Energy: 1.0483461566859131 Energy: 0.9241806395753992 Energy: 0.9517099498967282 Energy: 1.050369196446373 Energy: 0.9517099498963622 Energy: 1.0503691964468123 Energy: 0.9517099498967282 Energy: 1.0503691964468123 Energy: 1.028010861986429 Energy: 0.9531442767158593 Energy: 1.028010861987673 Energy: 0.9531442767158593 Energy: 1.028010861987673 Energy: 0.9531442767158593 Energy: 0.9970125129999197 Energy: 1.403448641330807 Energy: 0.9970125130002857 Energy: 1.4034486413312461 Energy: 0.9970125129999197 Energy: 1.4034486413320515 Energy: 1.0933710041707163 Energy: 0.988689902673057 Energy: 1.0933710041703504 Energy: 0.988689902673057 Energy: 1.0933710041707163 Energy: 0.9886899026726911 Energy: 1.053222464791889 Energy: 0.9527060702921624 Energy: 1.053222464791889 Energy: 0.9527060702917962 Energy: 1.053222464791889 Energy: 0.9527060702921624 Energy: 1.0443316015816206 Energy: 1.1621808642745102 Energy: 1.0443316015816206 Energy: 1.1621808642756815 Energy: 1.0443316015816206 Energy: 1.1621808642764866 Energy: 0.971200131818722 Energy: 1.4717372533846738 Energy: 0.9712001318182829 Energy: 1.4717372533846738 Energy: 0.9712001318182829 Energy: 1.4717372533851127 Energy: 0.9987837663670958 Energy: 0.9607502271750161 Energy: 0.9987837663670958 Energy: 0.9607502271750161 Energy: 0.9987837663670958 Energy: 0.9607502271750161 Energy: 0.9517996748995283 Energy: 1.4471408711947467 Energy: 0.9517996748995283 Energy: 1.4471408712402762 Energy: 0.9517996748995283 Energy: 1.4471408712820728 Energy: 1.0438805410668548 Energy: 0.9868994124501183 Energy: 1.0438800440904197 Energy: 0.9868994124501183 Energy: 1.0438807049732857 Energy: 0.9868994124501183 Energy: 1.0444308462348426 Energy: 1.056741925256459 Energy: 1.0444308462348426 Energy: 1.056741925256459 Energy: 1.0444308462352088 Energy: 1.056741925256459 Energy: 1.045816443124987 Energy: 1.0562656512170507 Energy: 1.045816443124987 Energy: 1.0562656512170507 Energy: 1.045816443124987 Energy: 1.0562656512170507 Energy: 1.0452054318292263 Energy: 0.9869252508595291 Energy: 1.0452054422095556 Energy: 0.9869252508595291 Energy: 1.045205434729438 Energy: 0.9869252508595291 Energy: 0.9517923213220979 Energy: 1.0129933672942595 Energy: 0.9517923213216586 Energy: 1.0129933672854756 Energy: 0.9517923213216586 Energy: 1.012993367282621 Energy: 0.9986563376456262 Energy: 0.9606954365896647 Energy: 0.9986563376451871 Energy: 0.9606954365892987 Energy: 0.9986563376451871 Energy: 0.9606954365892987 Energy: 0.97117761472738 Energy: 1.4715341857191953 Energy: 0.9711776147277461 Energy: 1.4715341857191953 Energy: 0.9711776147277461 Energy: 1.4715341857191953 Energy: 1.0442845165624595 Energy: 1.162535804156718 Energy: 1.0442845165624595 Energy: 1.1625358041543024 Energy: 1.0442845165624595 Energy: 1.1625358041554736 Energy: 1.053151315879177 Energy: 0.9529329638718401 Energy: 1.053151315879177 Energy: 0.9529329638722792 Energy: 1.053151315879177 Energy: 0.9529329638718401 Energy: 1.0934991679172914 Energy: 0.9887092036178555 Energy: 1.0934991679172914 Energy: 0.9887092036178555 Energy: 1.0934991679176573 Energy: 0.9887092036178555 Energy: 0.996934519449979 Energy: 1.4034010249017383 Energy: 0.996934519449979 Energy: 1.4034010249013726 Energy: 0.996934519449979 Energy: 1.4034010249013726 Energy: 1.0231744998896137 Energy: 0.9534768655949947 Energy: 1.023174499890053 Energy: 0.9534768655949947 Energy: 1.0231744998892478 Energy: 0.9534768655946286 Energy: 0.9516402945708056 Energy: 1.0514225325172906 Energy: 0.9516402945704397 Energy: 1.0514225325177295 Energy: 0.9516402945708056 Energy: 1.0514225325172906 Energy: 1.0483209896120913 Energy: 0.9243319132911547 Energy: 1.0483209896116519 Energy: 0.9243319132907887 Energy: 1.0483209896116519 Energy: 0.9243319132907887 Energy: 0.9397028965101611 Energy: 1.0980146251196923 Energy: 0.939702896509722 Energy: 1.0980146251196923 Energy: 0.939702896509722 Energy: 1.0980146251200584 minimum gb energy = 0.9133601191461689 eV minimum distance = 2.3059509988934 Angstroms sigma value = 67 ======================================== theta = 70.52877936550931 ======================================== Energy: 1.1907625683594434 Energy: 1.072138559666677 Energy: 1.1907625683594434 Energy: 1.072138559666677 Energy: 1.1907625683594434 Energy: 1.072138559666677 Energy: 1.1150080168151597 Energy: 0.9659546069106697 Energy: 1.1150080168151597 Energy: 0.9659546069106697 Energy: 1.1150080168151597 Energy: 0.9659546069106697 Energy: 0.969706077510144 Energy: 1.2589037191204389 Energy: 0.9697060775128349 Energy: 1.2589037191204389 Energy: 0.9697060775128349 Energy: 1.2589037191204389 Energy: 1.1149430445830846 Energy: 0.9661951036059023 Energy: 1.1149430445830846 Energy: 0.9661951036059023 Energy: 1.1149430445830846 Energy: 0.9661951036059023 Energy: 1.1907625683594434 Energy: 1.072138559666677 Energy: 1.1907625683594434 Energy: 1.072138559666677 Energy: 1.1907625683594434 Energy: 1.072138559666677 Energy: 1.1150080168151597 Energy: 0.9659546069106697 Energy: 1.1150080168151597 Energy: 0.9659546069106697 Energy: 1.1150080168151597 Energy: 0.9659546069106697 Energy: 0.9697060775128349 Energy: 1.2589037191204389 Energy: 0.9697060775182162 Energy: 1.2589037191204389 Energy: 0.9697060775155254 Energy: 1.2589037191204389 minimum gb energy = 0.9659546069106697 eV minimum distance = 2.31352154125447 Angstroms sigma value = 3 ======================================== theta = 77.88488253796277 ======================================== Energy: 1.433597479622778 Energy: 1.3085838364945936 Energy: 1.375657082260274 Energy: 1.3085838364945936 Energy: 1.433597479622778 Energy: 1.3085838364945936 Energy: 1.2904678886191836 Energy: 1.1873235733871823 Energy: 1.2904678886191836 Energy: 1.1873235733871823 Energy: 1.2904678886191836 Energy: 1.1873235733871823 Energy: 1.341798183677477 Energy: 1.3980294427749962 Energy: 1.3408658831184643 Energy: 1.3980294427749962 Energy: 1.341798183677477 Energy: 1.3980294427713345 Energy: 1.2771879492660976 Energy: 1.1647418816832709 Energy: 1.2771879492660976 Energy: 1.2662363414783089 Energy: 1.2771879492660976 Energy: 1.2662363414783089 Energy: 1.3226555193561498 Energy: 1.322660905998873 Energy: 1.3226555193561498 Energy: 1.322660905998873 Energy: 1.3226555193524883 Energy: 1.322660905998873 Energy: 1.2462001181832276 Energy: 1.2451822530858179 Energy: 1.2462001181832276 Energy: 1.2451822530858179 Energy: 1.2462001181832276 Energy: 1.2451822530858179 Energy: 1.3786522453700751 Energy: 1.2674018248327799 Energy: 1.378615371084098 Energy: 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1.157617913369623 Energy: 1.539972348842531 Energy: 1.4636183942260652 Energy: 1.2392455902482762 Energy: 1.4636183942260652 Energy: 1.2392455902482762 Energy: 1.4636183942265677 Energy: 1.239245590247774 Energy: 1.1956117095110905 Energy: 1.105481370185876 Energy: 1.1956117095110905 Energy: 1.105481370185876 Energy: 1.1956117095110905 Energy: 1.105481370185876 Energy: 1.165012495471617 Energy: 1.1079643061909379 Energy: 1.165012495471617 Energy: 1.1079643061909379 Energy: 1.165012495471617 Energy: 1.1079643061909379 minimum gb energy = 1.055788064829335 eV minimum distance = 2.33445016134611 Angstroms sigma value = 43 ======================================== theta = 82.945868617881 ======================================== Energy: 1.4992589592225543 Energy: 1.133710552660891 Energy: 1.4992589592225543 Energy: 1.133710552660891 Energy: 1.4992589592225543 Energy: 1.133710552660891 Energy: 1.2862408157535286 Energy: 1.1422933387800316 Energy: 1.2862408157535286 Energy: 1.1422933387800316 Energy: 1.2862408157535286 Energy: 1.1422933387800316 Energy: 1.2260070566660293 Energy: 1.4009351493377722 Energy: 1.3325493464974512 Energy: 1.4009351493383897 Energy: 1.3325493464980687 Energy: 1.4009351493383897 Energy: 1.200245012471428 Energy: 1.2365800402224743 Energy: 1.200245012471428 Energy: 1.2365800402230915 Energy: 1.200245012471428 Energy: 1.2365800402224743 Energy: 1.1727749670330145 Energy: 1.2969041998099262 Energy: 1.1727749670330145 Energy: 1.2969041998099262 Energy: 1.1727749670330145 Energy: 1.2969041998099262 Energy: 1.2196212201931607 Energy: 1.2378902241046044 Energy: 1.2196212201931607 Energy: 1.2378902241046044 Energy: 1.2196212201931607 Energy: 1.2378902241046044 Energy: 1.3534351865137997 Energy: 1.3448047442503124 Energy: 1.265279938148901 Energy: 1.3448047442503124 Energy: 1.3534351865137997 Energy: 1.3448047442503124 Energy: 1.2055576088278648 Energy: 1.2870907561398557 Energy: 1.2055576088278648 Energy: 1.2870907561398557 Energy: 1.2055576088278648 Energy: 1.287090756140473 Energy: 1.3230400522904118 Energy: 1.1607870059481082 Energy: 1.3230400572628516 Energy: 1.1607870059481082 Energy: 1.3230400571980652 Energy: 1.1607870059481082 Energy: 1.2228104302109726 Energy: 1.239329219066689 Energy: 1.2228104302109726 Energy: 1.2393292190673064 Energy: 1.2228104302109726 Energy: 1.239329219066689 Energy: 1.4503380222227855 Energy: 1.267346258846344 Energy: 1.35621304690162 Energy: 1.267346258846344 Energy: 1.4503380222227855 Energy: 1.267346258846344 Energy: 1.2057180828844565 Energy: 1.2020230803392395 Energy: 1.2057180828844565 Energy: 1.2020230803392395 Energy: 1.2057180828844565 Energy: 1.2020230803392395 Energy: 1.1840001021796398 Energy: 1.2395272166592357 Energy: 1.1842786186153231 Energy: 1.2395272166592357 Energy: 1.1902421401739263 Energy: 1.2395272166592357 Energy: 1.0999690835515712 Energy: 1.405894764603398 Energy: 1.0999690835515712 Energy: 1.405894764603398 Energy: 1.0999690835515712 Energy: 1.405894764603398 Energy: 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1.0040123888939947 Energy: 1.26512261839068 Energy: 1.004012388894612 Energy: 1.26512261839068 Energy: 1.0040123888939947 Energy: 1.3263657910196305 Energy: 1.1820600166789634 Energy: 1.326365791018396 Energy: 1.1820600166049458 Energy: 1.3263657910122229 Energy: 1.1820600165197894 Energy: 1.1016360124284479 Energy: 1.3158746835288262 Energy: 1.1016360124278306 Energy: 1.3158746835288262 Energy: 1.1016360124278306 Energy: 1.3158746835288262 Energy: 1.1890929370100347 Energy: 1.225299088215004 Energy: 1.1880294086203285 Energy: 1.225299088214387 Energy: 1.1894358759571106 Energy: 1.225299088214387 Energy: 1.2052758537577872 Energy: 1.1846117351862548 Energy: 1.2052758537577872 Energy: 1.1846117351862548 Energy: 1.2052758537577872 Energy: 1.1846117351862548 Energy: 1.2952788930333825 Energy: 1.2570831204496864 Energy: 1.2952788930333825 Energy: 1.2570831204496864 Energy: 1.2952788930333825 Energy: 1.2570831204496864 Energy: 1.2551423222639229 Energy: 1.141457829421663 Energy: 1.2961026987185307 Energy: 1.1414578294210458 Energy: 1.2551423222633056 Energy: 1.141457829421663 Energy: 1.4154304601642316 Energy: 1.1489302725742367 Energy: 1.4154304601642316 Energy: 1.1489302725742367 Energy: 1.4154304601642316 Energy: 1.1489302725742367 Energy: 1.205183330884619 Energy: 1.286702187054677 Energy: 1.205183330884619 Energy: 1.286702187054677 Energy: 1.205183330884619 Energy: 1.286702187054677 Energy: 1.2805677209595874 Energy: 1.3120165087176692 Energy: 1.2805677209595874 Energy: 1.3120165087176692 Energy: 1.2805677209595874 Energy: 1.3120165087176692 Energy: 1.2206468313776524 Energy: 1.2383116611608698 Energy: 1.2813262975723445 Energy: 1.2383116611608698 Energy: 1.2206468313776524 Energy: 1.2383116611608698 minimum gb energy = 1.0040123888939947 eV minimum distance = 2.29856469642534 Angstroms sigma value = 57 ======================================== theta = 86.6277133165661 ======================================== Energy: 1.3642615415815336 Energy: 1.1892635333141361 Energy: 1.2490168311979801 Energy: 1.1892635333141361 Energy: 1.3642615415815336 Energy: 1.1892635333141361 Energy: 1.3355421060901205 Energy: 1.209579008642778 Energy: 1.3355421060901205 Energy: 1.209579008642778 Energy: 1.3355421060901205 Energy: 1.209579008642778 Energy: 1.2974270807691095 Energy: 1.3732954986397363 Energy: 1.3041218898638471 Energy: 1.3732954986397363 Energy: 1.2977122230265512 Energy: 1.3732954986397363 Energy: 1.2534513508642458 Energy: 1.3491395388863996 Energy: 1.2534513508642458 Energy: 1.3491395388863996 Energy: 1.2534513508642458 Energy: 1.3491395388863996 Energy: 1.2300657153771026 Energy: 1.293154502034257 Energy: 1.2300657153779018 Energy: 1.293154502034257 Energy: 1.2300657153771026 Energy: 1.293154502034257 Energy: 1.3168531627357019 Energy: 1.19285856577484 Energy: 1.3168531627357019 Energy: 1.19285856577484 Energy: 1.3168531627357019 Energy: 1.19285856577484 Energy: 1.3232978474026704 Energy: 1.3293363476198898 Energy: 1.3232978474026704 Energy: 1.3293363476190905 Energy: 1.3232978474026704 Energy: 1.3293363476190905 Energy: 1.2536842481875516 Energy: 1.271123851406963 Energy: 1.2536842481867525 Energy: 1.271123851406963 Energy: 1.2536842481875516 Energy: 1.271123851406963 Energy: 1.287084895242729 Energy: 1.203991577165626 Energy: 1.2870848952435283 Energy: 1.203991577165626 Energy: 1.2870848952435283 Energy: 1.203991577165626 Energy: 1.1828997698036015 Energy: 1.2340423754655507 Energy: 1.1831726177390534 Energy: 1.2340423754655507 Energy: 1.1828997698036015 Energy: 1.2340423754655507 Energy: 1.2490352959289295 Energy: 1.3483795673420982 Energy: 1.2490352959289295 Energy: 1.3483795673420982 Energy: 1.2490352959289295 Energy: 1.3483795673420982 Energy: 1.2392421274416177 Energy: 1.2849166719632164 Energy: 1.2392421274416177 Energy: 1.284916671962417 Energy: 1.2392421274408185 Energy: 1.284916671962417 Energy: 1.2705580915226429 Energy: 1.2042174863383113 Energy: 1.2705580960683485 Energy: 1.2042174863383113 Energy: 1.2705580940926877 Energy: 1.204217486337512 Energy: 1.321070391909469 Energy: 1.2021666096089616 Energy: 1.1269442891334414 Energy: 1.2021666096089616 Energy: 1.3210703919102682 Energy: 1.2021666096089616 Energy: 1.2552271531675818 Energy: 1.2106973595153112 Energy: 1.1272740711508633 Energy: 1.2106973595161106 Energy: 1.2552271531675818 Energy: 1.2106973595161106 Energy: 1.2706435100707183 Energy: 1.1906715024568215 Energy: 1.2706435100707183 Energy: 1.1906715024568215 Energy: 1.2706435100707183 Energy: 1.1906715024568215 Energy: 1.1856836993552613 Energy: 1.2051287629183745 Energy: 1.1858778331404107 Energy: 1.2051287629183745 Energy: 1.1856836993544622 Energy: 1.2051287629183745 Energy: 1.2458020712368827 Energy: 1.1066031928172388 Energy: 1.2458020712376818 Energy: 1.1066031928172388 Energy: 1.2458020712376818 Energy: 1.1066031928172388 Energy: 1.1760185279894988 Energy: 1.2020349055036903 Energy: 1.1760185279894988 Energy: 1.2020349055036903 Energy: 1.1760185279894988 Energy: 1.2020349055036903 Energy: 1.1458315530210612 Energy: 1.190711372205323 Energy: 1.1458315530218606 Energy: 1.190711372205323 Energy: 1.1458315530218606 Energy: 1.190711372205323 Energy: 1.1271674717013682 Energy: 1.194483136881095 Energy: 1.1271674717013682 Energy: 1.1944831368802957 Energy: 1.1271674717013682 Energy: 1.1944831368802957 Energy: 1.1281748715787665 Energy: 1.2492079499717383 Energy: 1.1281748715779671 Energy: 1.2492079499725377 Energy: 1.128174871775308 Energy: 1.2492079499725377 Energy: 1.3840772048237675 Energy: 1.2011408368983436 Energy: 1.4185585462479424 Energy: 1.2011408368983436 Energy: 1.3840772046983225 Energy: 1.2011408368983436 Energy: 1.409277140468522 Energy: 1.3070453725232067 Energy: 1.4091690521619138 Energy: 1.3070453725192106 Energy: 1.409277140468522 Energy: 1.3070453725248052 minimum gb energy = 1.1066031928172388 eV minimum distance = 2.20169859621618 Angstroms sigma value = 17 ======================================== theta = 93.3722866834339 ======================================== Energy: 1.14427189107051 Energy: 1.1270884501921004 Energy: 1.14427189107051 Energy: 1.12708845019097 Energy: 1.14427189107051 Energy: 1.12708845019097 Energy: 1.0937828236782507 Energy: 1.1026939479940092 Energy: 1.0937828236782507 Energy: 1.1026939479940092 Energy: 1.0937828236782507 Energy: 1.1026939479940092 Energy: 1.3313644445410933 Energy: 1.2893895214288367 Energy: 1.3313644445410933 Energy: 1.2893895214288367 Energy: 1.3313644445410933 Energy: 1.2893895214288367 Energy: 0.9824376653409055 Energy: 1.273749209456901 Energy: 0.9824376653409055 Energy: 1.273749209456901 Energy: 0.9824376653409055 Energy: 1.273749209456901 Energy: 1.1272539430796575 Energy: 1.2191893604022621 Energy: 1.1272539430796575 Energy: 1.2191893604022621 Energy: 1.1272539430796575 Energy: 1.2191893604022621 Energy: 1.1659609080633508 Energy: 1.2406049713117602 Energy: 1.1659609080633508 Energy: 1.2406049713117602 Energy: 1.1659609080633508 Energy: 1.2406049713117602 Energy: 1.1785770139000298 Energy: 1.0843446836405186 Energy: 1.1785770139000298 Energy: 1.0843446836405186 Energy: 1.1785770139000298 Energy: 1.0843446836405186 Energy: 0.9820225211806547 Energy: 1.1978230906453122 Energy: 0.9820225211806547 Energy: 1.1978230906464427 Energy: 0.9820225211795245 Energy: 1.1978230906464427 Energy: 1.223403646783077 Energy: 1.1090025558040884 Energy: 1.223403646783077 Energy: 1.1090025558040884 Energy: 1.223403646783077 Energy: 1.1090025558040884 Energy: 1.1650029566144762 Energy: 1.09256825216528 Energy: 1.1650029566144762 Energy: 1.09256825216528 Energy: 1.1650029566144762 Energy: 1.09256825216528 Energy: 1.1476187836696816 Energy: 1.0444712132965261 Energy: 1.1476187836696816 Energy: 1.0444712132965261 Energy: 1.1476187836696816 Energy: 1.0444712132976564 Energy: 1.1222553160490079 Energy: 1.0964552492684603 Energy: 1.1222553160490079 Energy: 1.09645524926733 Energy: 1.1222553160490079 Energy: 1.0964552492684603 Energy: 1.0359412919732391 Energy: 1.241354955341681 Energy: 1.0359412919732391 Energy: 1.241354955341681 Energy: 1.0359412919732391 Energy: 1.241354955341681 Energy: 1.164353532391046 Energy: 1.2455193909360813 Energy: 1.164353532391046 Energy: 1.2455193909360813 Energy: 1.164353532391046 Energy: 1.2455193909360813 Energy: 1.1722495991148425 Energy: 1.0148186512659676 Energy: 1.1722495991148425 Energy: 1.0148186512659676 Energy: 1.1722495991148425 Energy: 1.0148186512659676 Energy: 1.1704271150605154 Energy: 1.2416916475374022 Energy: 1.1704271150616459 Energy: 1.2416916475374022 Energy: 1.1704271150616459 Energy: 1.2416916475374022 Energy: 1.1621125242856074 Energy: 1.2416490542883234 Energy: 1.1621125242867378 Energy: 1.2416490542883234 Energy: 1.1621125242856074 Energy: 1.2416490542883234 minimum gb energy = 0.9820225211795245 eV minimum distance = 2.28000613619396 Angstroms sigma value = 17 ======================================== theta = 97.054131382119 ======================================== Energy: 1.1441287905659876 Energy: 1.0262398367571122 Energy: 1.1441287905655513 Energy: 1.0262398367571122 Energy: 1.1441287905659876 Energy: 1.0262398367571122 Energy: 1.0495734390704625 Energy: 1.026086338947518 Energy: 1.0495734390704625 Energy: 1.026086338947518 Energy: 1.0495734390704625 Energy: 1.026086338947518 Energy: 1.071724511968398 Energy: 1.0980031256709726 Energy: 1.0717245119688346 Energy: 1.0980031256709726 Energy: 1.0717245119688346 Energy: 1.0980031256709726 Energy: 0.9994771842199626 Energy: 1.112102372967166 Energy: 0.9994771842203992 Energy: 1.1121023729676025 Energy: 0.9994771842195262 Energy: 1.1121023729676025 Energy: 1.036713884689793 Energy: 0.9899643516715938 Energy: 1.036713884689793 Energy: 0.9899643516715938 Energy: 1.036713884689793 Energy: 0.9899643516711574 Energy: 1.1031573447649414 Energy: 1.0418194798690246 Energy: 1.1031573447653777 Energy: 1.0418194798690246 Energy: 1.1031573447653777 Energy: 1.0418194798690246 Energy: 1.0460670688082931 Energy: 1.0397898126408194 Energy: 1.0460670688082931 Energy: 1.0397898126412557 Energy: 1.0460670688082931 Energy: 1.0397898126408194 Energy: 1.077271373224729 Energy: 1.1574329654472555 Energy: 1.0772713732251653 Energy: 1.157432965447692 Energy: 1.0772713732251653 Energy: 1.157432965447692 Energy: 1.0746326476516483 Energy: 1.0985324667454 Energy: 1.0746326476516483 Energy: 1.0985324667458365 Energy: 1.0746326476516483 Energy: 1.0985324667458365 Energy: 1.0382295059368833 Energy: 0.9462263787666315 Energy: 1.0382295059368833 Energy: 0.9462263787666315 Energy: 1.0382295059364468 Energy: 0.946226378766195 Energy: 0.9640982973976588 Energy: 1.114155517959456 Energy: 0.9640982973972225 Energy: 1.114155517959456 Energy: 0.9640982973972225 Energy: 1.114155517959456 Energy: 1.1641024678578908 Energy: 1.0209318028744891 Energy: 1.1641024678574543 Energy: 1.0209318028740526 Energy: 1.1641024678574543 Energy: 1.0209318028744891 Energy: 1.067006526874341 Energy: 1.0190776965129156 Energy: 1.0670065268747775 Energy: 1.0190776965129156 Energy: 1.0670065268747775 Energy: 1.0190776965129156 Energy: 1.0472679879121893 Energy: 1.033625816452842 Energy: 1.0472679879117528 Energy: 1.033625816452842 Energy: 1.0472679879121893 Energy: 1.033625816452842 Energy: 1.0931331488205742 Energy: 1.114067617844635 Energy: 1.0931331488205742 Energy: 1.114067617844635 Energy: 1.0931331488205742 Energy: 1.1140676178441984 Energy: 0.9634357049789016 Energy: 1.1349733525833487 Energy: 0.9634357049789016 Energy: 1.1349733525829124 Energy: 0.9634357049789016 Energy: 1.1349733525833487 Energy: 1.0632400981800352 Energy: 1.087707667086232 Energy: 1.0632400981800352 Energy: 1.087707667086232 Energy: 1.0632400981800352 Energy: 1.087707667086232 Energy: 1.1058792023744979 Energy: 1.0863332483817276 Energy: 1.1058792023740613 Energy: 1.0863332483817276 Energy: 1.1058792023749344 Energy: 1.0863332483817276 Energy: 1.0607751377117542 Energy: 1.079281553239947 Energy: 1.0607751377117542 Energy: 1.0792815532395106 Energy: 1.0607751377117542 Energy: 1.079281553239947 Energy: 1.0616669913918473 Energy: 0.9434005724883128 Energy: 1.0616669913918473 Energy: 0.9434005724883128 Energy: 1.0616669913914107 Energy: 0.9434005724883128 Energy: 1.0609609514460925 Energy: 1.0801595618184328 Energy: 1.0609609514456557 Energy: 1.0801595618289082 Energy: 1.0609609514460925 Energy: 1.0801595618184328 Energy: 1.106052192689708 Energy: 1.0864802449694138 Energy: 1.106052192689708 Energy: 1.0864802449694138 Energy: 1.106052192689272 Energy: 1.0864802449694138 Energy: 1.063289597922385 Energy: 1.0874847497954951 Energy: 1.063289597922385 Energy: 1.0874847497959317 Energy: 1.0632895979228214 Energy: 1.0874847497959317 Energy: 0.9631215042647358 Energy: 1.1674478121488443 Energy: 0.9631215042642993 Energy: 1.1674478121488443 Energy: 0.9631215042642993 Energy: 1.1674478121492415 Energy: 1.0931079636496475 Energy: 1.11318859523144 Energy: 1.0931079636496475 Energy: 1.1131885952310034 Energy: 1.0931079636496475 Energy: 1.113188595230567 Energy: 1.0471559272632736 Energy: 1.0275580252786012 Energy: 1.0471559272632736 Energy: 1.0275580252786012 Energy: 1.0471559272632736 Energy: 1.0275580252786012 Energy: 1.0667447180938077 Energy: 1.0193493944573861 Energy: 1.0667447180938077 Energy: 1.01934939445564 Energy: 1.0667447180938077 Energy: 1.0193493944578225 Energy: 1.1637610513254335 Energy: 1.020623622804611 Energy: 1.1637610513254335 Energy: 1.020623622804611 Energy: 1.16376105132587 Energy: 1.020623622804611 Energy: 0.9645572370602039 Energy: 1.1138923745884557 Energy: 0.9645572370597674 Energy: 1.1138923745884557 Energy: 0.9645572370597674 Energy: 1.1138923745884557 Energy: 1.0378249039679222 Energy: 0.9444077227705151 Energy: 1.0378249039679222 Energy: 0.9444077227705151 Energy: 1.0378249039679222 Energy: 0.9444077227705151 Energy: 1.0745373361293804 Energy: 1.0987153005089076 Energy: 1.0745373361293804 Energy: 1.0987153005093442 Energy: 1.0745373361293804 Energy: 1.0987153005093442 Energy: 1.0618503421950247 Energy: 1.1572767459274353 Energy: 1.0618503421950247 Energy: 1.1572767459274353 Energy: 1.0618503421950247 Energy: 1.1572767459274353 Energy: 1.0459022734995675 Energy: 1.0397515317035977 Energy: 1.045902273500004 Energy: 1.0397515317040342 Energy: 1.0459022734995675 Energy: 1.0397515317040342 Energy: 1.103161068148809 Energy: 1.0062935724811408 Energy: 1.103161068148809 Energy: 1.0062935724811408 Energy: 1.103161068148809 Energy: 1.0062935724811408 Energy: 1.0407718869305191 Energy: 0.9896756491363362 Energy: 1.0407718869296463 Energy: 0.9896756491363362 Energy: 1.040771886930083 Energy: 0.9896756491363362 Energy: 0.9987380191657201 Energy: 1.1069592032897058 Energy: 0.9987380191657201 Energy: 1.106959203289309 Energy: 0.9987380191661565 Energy: 1.106959203289309 Energy: 1.0797434478420371 Energy: 1.098274595554634 Energy: 1.0797434478420371 Energy: 1.0982745955550703 Energy: 1.0797434478424734 Energy: 1.0982745955550703 Energy: 1.0493325944241696 Energy: 0.9905863622628011 Energy: 1.0493325944241696 Energy: 0.9905863622628011 Energy: 1.0493325944237328 Energy: 0.9905863622628011 Energy: 1.1441287905655513 Energy: 1.0262398367575487 Energy: 1.1441287905655513 Energy: 1.0262398367571122 Energy: 1.1441287905655513 Energy: 1.0262398367571122 Energy: 1.0495734390704625 Energy: 1.0018549980233378 Energy: 1.049573439070026 Energy: 1.0018549980229012 Energy: 1.0495734390704625 Energy: 1.0018549980229012 Energy: 1.071724511968398 Energy: 1.0980031256709726 Energy: 1.071724511968398 Energy: 1.0980031256709726 Energy: 1.071724511968398 Energy: 1.0980031256709726 Energy: 0.9994771842203992 Energy: 1.0872111019550441 Energy: 0.9994771842208356 Energy: 1.0872111019546078 Energy: 0.9994771842195262 Energy: 1.0872111019550441 Energy: 1.036713884689793 Energy: 0.9899643516711574 Energy: 1.036713884689793 Energy: 0.9899643516711574 Energy: 1.036713884689793 Energy: 0.9899643516715938 minimum gb energy = 0.9434005724883128 eV minimum distance = 2.29910117614712 Angstroms sigma value = 57 ======================================== theta = 99.36891557845483 ======================================== Energy: 1.0484998257027167 Energy: 0.9452051447159852 Energy: 1.0484998257027167 Energy: 0.9452051447159852 Energy: 1.0484998257027167 Energy: 0.9452051447152744 Energy: 1.0693144714067417 Energy: 0.9313204056963832 Energy: 1.0693144714067417 Energy: 0.9313204056963832 Energy: 1.0693144714067417 Energy: 0.9313204056963832 Energy: 1.1248427493309634 Energy: 1.012128267310629 Energy: 1.1248427493302529 Energy: 1.012128267310629 Energy: 1.1248427493302529 Energy: 1.012128267310629 Energy: 0.9062854050959485 Energy: 1.0397437017861353 Energy: 0.9062854050959485 Energy: 1.0397437017861353 Energy: 0.9062854050952378 Energy: 1.0397437017861353 Energy: 0.9440317188066599 Energy: 0.9170063236781016 Energy: 0.9440317188059492 Energy: 0.9170063236781016 Energy: 0.9440317188066599 Energy: 0.9170063236773909 Energy: 1.0327541945397578 Energy: 0.9307243430696175 Energy: 1.0327541945404686 Energy: 0.9307243430696175 Energy: 1.0327541945404686 Energy: 0.9307243430696175 Energy: 0.9380729908941684 Energy: 0.9955798067138936 Energy: 0.9380729908856401 Energy: 0.9955798067138936 Energy: 0.9380729908977218 Energy: 0.9955798067138936 Energy: 1.1792652705818336 Energy: 0.9712921248020955 Energy: 1.1792652705818336 Energy: 0.9712921248020955 Energy: 1.1792652705818336 Energy: 0.9712921248020955 Energy: 0.9420710552327909 Energy: 0.9329919953181484 Energy: 0.9420710552320801 Energy: 0.9329919953188591 Energy: 0.9420710552327909 Energy: 0.9329919953181484 Energy: 0.9526619524101585 Energy: 0.9580406385170285 Energy: 0.9526619524101585 Energy: 0.9580406385170285 Energy: 0.9526619524101585 Energy: 0.9580406385170285 Energy: 0.8844228740981193 Energy: 1.0802546239204904 Energy: 0.8844228740981193 Energy: 1.0802546239197797 Energy: 0.8844228740981193 Energy: 1.0802546239204904 Energy: 0.9846086516893336 Energy: 0.8967177358804505 Energy: 0.9846086516893336 Energy: 0.8967177358804505 Energy: 0.9846086516893336 Energy: 0.8967177358804505 Energy: 0.9496647811983998 Energy: 1.0190227111332315 Energy: 0.9496647811983998 Energy: 1.0190227111332315 Energy: 0.9496647811983998 Energy: 1.0190227111325207 Energy: 0.9009871854269567 Energy: 0.9835429240449058 Energy: 0.9009871854269567 Energy: 0.9835429240449058 Energy: 0.9009871854269567 Energy: 0.9835429240449058 Energy: 1.0613856458434823 Energy: 0.9481420148610082 Energy: 1.0613856458434823 Energy: 0.9481420148610082 Energy: 1.0613856458441933 Energy: 0.9481420148610082 Energy: 0.9484499482582096 Energy: 0.9428367207591349 Energy: 0.9484499482574988 Energy: 0.9428367207584242 Energy: 0.9484499482574988 Energy: 0.9428367207584242 Energy: 0.9802571658675747 Energy: 1.0698076974547583 Energy: 0.9802571658675747 Energy: 1.0698076974540478 Energy: 0.9802571658668641 Energy: 1.0698076974547583 Energy: 1.0101930992847297 Energy: 1.0367344319594023 Energy: 1.0101930992847297 Energy: 1.0367344319594023 Energy: 1.0101930992847297 Energy: 1.0367344319594023 Energy: 0.916673003161938 Energy: 1.0054372224869843 Energy: 0.916673003161938 Energy: 1.0054372224414996 Energy: 0.916673003161938 Energy: 1.0054372224457637 Energy: 0.9047910957716686 Energy: 1.0314788686311094 Energy: 0.9047910957716686 Energy: 1.0314788686311094 Energy: 0.9047910957723794 Energy: 1.0314788686311094 Energy: 1.0055441472508495 Energy: 0.9997095083838984 Energy: 1.005544147250139 Energy: 0.9997095083838984 Energy: 1.005544147250139 Energy: 0.9997095083838984 Energy: 0.8844590767967556 Energy: 1.124676397915739 Energy: 0.8844590767967556 Energy: 1.124676397915739 Energy: 0.8844590767967556 Energy: 1.124676397915739 Energy: 0.9774346965381994 Energy: 0.9832477628117162 Energy: 0.97743469653891 Energy: 0.983247762812427 Energy: 0.9774346965381994 Energy: 0.983247762812427 Energy: 0.9678125283649301 Energy: 1.1238841583238375 Energy: 0.9678125283649301 Energy: 1.1238841583231267 Energy: 0.9678125283649301 Energy: 1.1238841583238375 Energy: 0.9677884394829055 Energy: 1.203320291605601 Energy: 0.9677884394829055 Energy: 1.2033202916063117 Energy: 0.9677884394821947 Energy: 1.2033202916063117 Energy: 0.9463914073728457 Energy: 0.9824976816342712 Energy: 0.946391407372135 Energy: 0.9824976816342712 Energy: 0.946391407372135 Energy: 0.9824976816342712 Energy: 0.8991235432659272 Energy: 1.1181655021237429 Energy: 0.8991235432659272 Energy: 1.1181655021237429 Energy: 0.899123543266638 Energy: 1.1181655021237429 minimum gb energy = 0.8844228740981193 eV minimum distance = 2.26812413978966 Angstroms sigma value = 43 ======================================== theta = 102.11511746203723 ======================================== Energy: 0.8992138619294759 Energy: 0.8437135728951438 Energy: 0.8992138619294759 Energy: 0.8437135728951438 Energy: 0.8992138619294759 Energy: 0.8437135728946261 Energy: 0.9248975078761628 Energy: 0.8581584422216056 Energy: 0.9248975078761628 Energy: 0.8581584422216056 Energy: 0.9248975078761628 Energy: 0.8581584422216056 Energy: 0.9657803327540488 Energy: 0.9128705458258939 Energy: 0.9657803327540488 Energy: 0.9128705458253762 Energy: 0.9657803327540488 Energy: 0.9128705458253762 Energy: 0.8862802983847279 Energy: 0.8894493429196888 Energy: 0.8862802983852456 Energy: 0.8894493429202067 Energy: 0.8862802983847279 Energy: 0.8894493429202067 Energy: 0.9173169293700122 Energy: 0.8163647506945882 Energy: 0.9173169293700122 Energy: 0.8163647506945882 Energy: 0.9173169293700122 Energy: 0.8163647506945882 Energy: 0.8733055371416981 Energy: 0.8303450046759343 Energy: 0.8733055371416981 Energy: 0.8303450046764522 Energy: 0.8733055371416981 Energy: 0.8303450046764522 Energy: 0.7871394517565201 Energy: 0.8606141413161849 Energy: 0.7871394517616983 Energy: 0.8606141413167027 Energy: 0.7871394517539311 Energy: 0.8606141413161849 Energy: 0.9190908259913138 Energy: 0.8012140624005014 Energy: 0.9190908259913138 Energy: 0.8012140624005014 Energy: 0.919090825990796 Energy: 0.8012140624005014 Energy: 0.8356281323661081 Energy: 0.8188854524718322 Energy: 0.8356281323666258 Energy: 0.8188854524723499 Energy: 0.8356281323661081 Energy: 0.8188854524718322 Energy: 0.9294188269794988 Energy: 0.8171598274171651 Energy: 0.9294188269794988 Energy: 0.8171598274166473 Energy: 0.9294188269794988 Energy: 0.8171598274166473 Energy: 1.0050863829720873 Energy: 0.8974565645086041 Energy: 1.0050863829726049 Energy: 0.8974565645086041 Energy: 1.0050863829720873 Energy: 0.8974565645086041 Energy: 0.7890258396213967 Energy: 0.8209777355800308 Energy: 0.789025839620879 Energy: 0.8209777355800308 Energy: 0.7890258396213967 Energy: 0.8209777355800308 Energy: 0.9285718998143401 Energy: 0.7781588734419815 Energy: 0.9285718998138222 Energy: 0.7781588734419815 Energy: 0.9285718998138222 Energy: 0.7781588734414637 Energy: 1.0039595714754486 Energy: 1.001191874054067 Energy: 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0.902091475479525 Energy: 0.8666071833751106 Energy: 0.902091475479525 Energy: 0.9100707697086786 Energy: 0.834901329375224 Energy: 0.9100707697086786 Energy: 0.834901329375224 Energy: 0.9100707697086786 Energy: 0.834901329375224 Energy: 0.8565688741316014 Energy: 0.9163748340669738 Energy: 0.8565688741316014 Energy: 0.9163748340669738 Energy: 0.8565688741316014 Energy: 0.9163748340669738 Energy: 0.8645526639068856 Energy: 0.912983670544566 Energy: 0.8645526639068856 Energy: 0.912983670544566 Energy: 0.8645526639063676 Energy: 0.912983670544566 Energy: 0.9601325304593631 Energy: 0.8386277056962035 Energy: 0.960132530459881 Energy: 0.8386277056962035 Energy: 0.960132530459881 Energy: 0.8386277056962035 Energy: 0.86955076232273 Energy: 0.898272917722087 Energy: 0.8695507623232478 Energy: 0.898272917722087 Energy: 0.86955076232273 Energy: 0.8982729177215693 Energy: 0.8099639698117359 Energy: 0.8860649477319414 Energy: 0.8099639698117359 Energy: 0.8860649477319414 Energy: 0.8099639698117359 Energy: 0.8860649477319414 Energy: 0.8809320361998995 Energy: 0.8063532771748271 Energy: 0.8707319088871869 Energy: 0.8063532771748271 Energy: 0.8809320362004172 Energy: 0.8063532771748271 Energy: 0.7806388896181711 Energy: 0.8914747580078207 Energy: 0.7806388896176534 Energy: 0.8914747580083388 Energy: 0.7806388896181711 Energy: 0.8914747580083388 Energy: 0.8099181626210318 Energy: 0.8334150987944814 Energy: 0.8099181626215495 Energy: 0.8334150987944814 Energy: 0.8099181626215495 Energy: 0.8334150987944814 Energy: 0.8104860712515218 Energy: 0.935497721894934 Energy: 0.8104860712515218 Energy: 0.935497721894934 Energy: 0.810486071251004 Energy: 0.935497721894934 Energy: 0.7985881886206375 Energy: 0.8893092215498987 Energy: 0.7985881886211554 Energy: 0.8893092215493809 Energy: 0.7985881886211554 Energy: 0.8893092215498987 Energy: 0.8102062042530462 Energy: 0.803228872284654 Energy: 0.8102062042530462 Energy: 0.803228872284654 Energy: 0.8102062042530462 Energy: 0.803228872284654 Energy: 0.7843048995697446 Energy: 0.8985404712835978 Energy: 0.7843048995697446 Energy: 0.89854047128308 Energy: 0.7843048995697446 Energy: 0.8985404712835978 Energy: 0.9267182977705878 Energy: 1.0105176256091883 Energy: 0.9267182977705878 Energy: 1.0105176256097064 Energy: 0.9267182977705878 Energy: 1.0105176256097064 Energy: 0.843205717050374 Energy: 0.7786195368863753 Energy: 0.843205717050374 Energy: 0.7786195368863753 Energy: 0.843205717050374 Energy: 0.7786195368863753 Energy: 0.7269361406797502 Energy: 0.8965676084191302 Energy: 0.7269361406797502 Energy: 0.8965676084191302 Energy: 0.7269361406797502 Energy: 0.8965676084191302 minimum gb energy = 0.7269361406797502 eV minimum distance = 2.25643349059225 Angstroms sigma value = 81 ======================================== theta = 109.47122063449069 ======================================== Energy: 0.014520448265496618 Energy: 0.0680276252577018 Energy: 0.014520448265496618 Energy: 0.0680276252577018 Energy: 0.014520448265496618 Energy: 0.0680276252577018 Energy: 0.6755859371268309 Energy: 0.016996751683222837 Energy: 0.6755859371268309 Energy: 0.016996751681320255 Energy: 0.6755859371268309 Energy: 0.016996751677515083 Energy: 0.6755239352373513 Energy: 0.017045531508997493 Energy: 0.6755239352373513 Energy: 0.01704553150709491 Energy: 0.6755239352373513 Energy: 0.017045531508997493 Energy: 0.014520448265496618 Energy: 0.0680276252577018 Energy: 0.014520448265496618 Energy: 0.0680276252577018 Energy: 0.014520448265496618 Energy: 0.0680276252577018 Energy: 0.6755859371268309 Energy: 0.016996751675612497 Energy: 0.6755859371268309 Energy: 0.01699675168512542 Energy: 0.6755859371268309 Energy: 0.016996751683222837 Energy: 0.6755239352373513 Energy: 0.017045531522272336 Energy: 0.6755239352373513 Energy: 0.017045531520412997 Energy: 0.6755239352373513 Energy: 0.01704553152798009 Energy: 0.014520448265496618 Energy: 0.0680276252577018 Energy: 0.014520448265496618 Energy: 0.0680276252577018 Energy: 0.014520448265496618 Energy: 0.0680276252577018 Energy: 0.6755859371268309 Energy: 0.01699675166800217 Energy: 0.6755859371268309 Energy: 0.01699675166800217 Energy: 0.6755859371268309 Energy: 0.016996751673709915 Energy: 0.6755239352373513 Energy: 0.017045531535590422 Energy: 0.6755239352373513 Energy: 0.017045531535590422 Energy: 0.6755239352373513 Energy: 0.017045531541298172 Energy: 0.014520448265496618 Energy: 0.0680276252577018 Energy: 0.014520448265496618 Energy: 0.0680276252577018 Energy: 0.014520448265496618 Energy: 0.0680276252577018 minimum gb energy = 0.014520448265496618 eV minimum distance = 2.44359604292995 Angstroms sigma value = 3 ======================================== theta = 117.56060310526324 ======================================== Energy: 0.7390403650381376 Energy: 0.726046337852215 Energy: 0.7390403650381376 Energy: 0.726046337852215 Energy: 0.7390403650381376 Energy: 0.7260463378527843 Energy: 0.6237805336767488 Energy: 0.7211092987949791 Energy: 0.6237805336773181 Energy: 0.7211092987949791 Energy: 0.6237805336773181 Energy: 0.7211092987949791 Energy: 0.7435502178317538 Energy: 0.7237286501576495 Energy: 0.7435502178317538 Energy: 0.7237286501576495 Energy: 0.7435502178317538 Energy: 0.7237286501576495 Energy: 0.7540773819057761 Energy: 0.6987660220809999 Energy: 0.7540773819057761 Energy: 0.6987660220804306 Energy: 0.7540773819057761 Energy: 0.6987660220804306 Energy: 0.6268847200526864 Energy: 0.7237750906940268 Energy: 0.6268847200526864 Energy: 0.7237750906940268 Energy: 0.6268847200526864 Energy: 0.7237750906940268 Energy: 0.746016706600435 Energy: 0.7290207012920231 Energy: 0.746016706600435 Energy: 0.7290207012925924 Energy: 0.746016706600435 Energy: 0.7290207012920231 Energy: 0.724516690124681 Energy: 0.706108521380187 Energy: 0.7245166901241117 Energy: 0.706108521380187 Energy: 0.7245166901241117 Energy: 0.706108521380187 Energy: 0.624113502114005 Energy: 0.7279140983490644 Energy: 0.624113502114005 Energy: 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0.6998137096387024 Energy: 0.6760229416712434 Energy: 0.7345484818743638 Energy: 0.7611629307744712 Energy: 0.7345484818743638 Energy: 0.7611629307739018 Energy: 0.7345484818743638 Energy: 0.7611629307739018 Energy: 0.7092948332355078 Energy: 0.6341128435628919 Energy: 0.7092948332355078 Energy: 0.6341128435628919 Energy: 0.7092948332355078 Energy: 0.6341128435628919 Energy: 0.5518222428579551 Energy: 0.777124761967461 Energy: 0.5518222428573858 Energy: 0.777124761967461 Energy: 0.5518222428579551 Energy: 0.777124761967461 Energy: 0.7184601815252345 Energy: 0.7085235743415652 Energy: 0.7184601815252345 Energy: 0.7085235743415652 Energy: 0.7184601815252345 Energy: 0.7085235743415652 Energy: 0.7104879245507408 Energy: 0.6443198832348632 Energy: 0.7104879245507408 Energy: 0.6443198832348632 Energy: 0.7104879245507408 Energy: 0.6443198832354325 Energy: 0.716398496195114 Energy: 0.7572834717395488 Energy: 0.716398496195114 Energy: 0.7572834717395488 Energy: 0.716398496195114 Energy: 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0.8245377155131417 Energy: 0.6112662661635938 Energy: 0.8245377155131417 Energy: 0.6112662661641631 Energy: 0.8245377155131417 Energy: 0.6112662661641631 Energy: 0.7369919716333466 Energy: 0.7694702560993885 Energy: 0.7369919716333466 Energy: 0.7694702560993885 Energy: 0.7369919716333466 Energy: 0.7694702560993885 Energy: 0.7183138208606847 Energy: 0.726885919673185 Energy: 0.7183138208606847 Energy: 0.726885919673185 Energy: 0.7183138208606847 Energy: 0.726885919673185 Energy: 0.8299137328640593 Energy: 0.6612862795665759 Energy: 0.8299137328640593 Energy: 0.6612862795665759 Energy: 0.8299137328640593 Energy: 0.6612862795665759 Energy: 0.7578554067052126 Energy: 0.762560376186497 Energy: 0.7578554067052126 Energy: 0.762560376186497 Energy: 0.7578554067052126 Energy: 0.762560376186497 Energy: 0.6883300571108197 Energy: 0.7241348613549234 Energy: 0.6883300571108197 Energy: 0.7241348613549234 Energy: 0.6883300571108197 Energy: 0.7241348613549234 Energy: 0.7602688493815039 Energy: 0.7473759724714667 Energy: 0.7602688493815039 Energy: 0.7473759724714667 Energy: 0.7602688493815039 Energy: 0.7473759724714667 minimum gb energy = 0.5094992117326337 eV minimum distance = 2.30898173681454 Angstroms sigma value = 67 ======================================== theta = 121.00758300686714 ======================================== Energy: 0.9864809262529194 Energy: 0.9299340791403712 Energy: 0.9864809262537305 Energy: 0.9299340791395599 Energy: 0.9864809262537305 Energy: 0.9299340791395599 Energy: 0.924598110335819 Energy: 0.9207344824058157 Energy: 0.9245981103366302 Energy: 0.9207344824058157 Energy: 0.9245981103366302 Energy: 0.9207344824058157 Energy: 0.9783011647039055 Energy: 0.9545825589505518 Energy: 0.9783011647039055 Energy: 0.9545825589505518 Energy: 0.9783011647039055 Energy: 0.9545825589497406 Energy: 0.9656955723448102 Energy: 0.9586264968395208 Energy: 0.9656955723448102 Energy: 0.9586264968395208 Energy: 0.9656955723448102 Energy: 0.9586264968395208 Energy: 0.8549224924526997 Energy: 0.9060992050070846 Energy: 0.8549224924526997 Energy: 0.9060992050070846 Energy: 0.8549224924526997 Energy: 0.9060992050070846 Energy: 0.9814944454238368 Energy: 0.9550915366237321 Energy: 0.9814944454238368 Energy: 0.9550915366237321 Energy: 0.9814944454238368 Energy: 0.9550915366237321 Energy: 0.9076778598165748 Energy: 0.9272548226933043 Energy: 0.9076778598165748 Energy: 0.9272548226933043 Energy: 0.9076778598157635 Energy: 0.9272548226933043 Energy: 0.9106554993350153 Energy: 0.8900333055332204 Energy: 0.9106554993350153 Energy: 0.8900333055332204 Energy: 0.9106554993350153 Energy: 0.8900333055332204 Energy: 1.0090339429809576 Energy: 1.0187161130306082 Energy: 1.0090339429809576 Energy: 1.0187161130306082 Energy: 1.0090339429809576 Energy: 1.0187161130306082 Energy: 0.9470420205245631 Energy: 0.8714881655954422 Energy: 0.9470420205245631 Energy: 0.8714881655954422 Energy: 0.9470420205245631 Energy: 0.8714881655954422 Energy: 0.9867460438290335 Energy: 0.96190106115025 Energy: 0.9867460438298449 Energy: 0.96190106115025 Energy: 0.9867460438298449 Energy: 0.96190106115025 Energy: 0.9159658739767318 Energy: 0.9618658966857534 Energy: 0.9159658739767318 Energy: 0.9618658966857534 Energy: 0.915965873977543 Energy: 0.9618658966857534 Energy: 0.9460965308018886 Energy: 0.9209268866007665 Energy: 0.9460965308018886 Energy: 0.9209268865999553 Energy: 0.9460965308027 Energy: 0.9209268866007665 Energy: 0.9348594306470462 Energy: 0.9697971227733944 Energy: 0.9348594306462351 Energy: 0.9697971227733944 Energy: 0.9348594306470462 Energy: 0.9697971227733944 Energy: 0.9124809411710927 Energy: 0.9169734371993623 Energy: 0.9124809411710927 Energy: 0.9169734371993623 Energy: 0.9124809411719039 Energy: 0.9169734371993623 Energy: 0.9626223974599724 Energy: 0.9316648147807741 Energy: 0.9626223974599724 Energy: 0.9316648147815855 Energy: 0.9626223974607837 Energy: 0.9316648147815855 Energy: 0.9680935733848538 Energy: 0.9588538217585036 Energy: 0.9680935733848538 Energy: 0.9588538217593149 Energy: 0.9680935733848538 Energy: 0.9588538217593149 Energy: 0.9077622726930676 Energy: 0.9053164229478595 Energy: 0.9077622726930676 Energy: 0.9053164229478595 Energy: 0.9077622726930676 Energy: 0.9053164229478595 Energy: 0.9547872478527869 Energy: 0.9815424655411196 Energy: 0.9547872478527869 Energy: 0.9815424655403084 Energy: 0.9547872478527869 Energy: 0.9815424655403084 Energy: 0.8530088358929837 Energy: 0.9562283931791836 Energy: 0.8530088358921725 Energy: 0.9562283931791836 Energy: 0.8530088358921725 Energy: 0.9562283931791836 Energy: 0.9674105474189979 Energy: 0.9269377894557856 Energy: 0.9674105474189979 Energy: 0.9269377894557856 Energy: 0.9674105474198091 Energy: 0.9269377894557856 Energy: 0.9695540539104863 Energy: 1.0206182454199137 Energy: 0.9695540539104863 Energy: 1.0206182454199137 Energy: 0.9695540539104863 Energy: 1.0206182454199137 Energy: 0.9464487190359325 Energy: 0.9562546963163326 Energy: 0.9464487190359325 Energy: 0.9562546963163326 Energy: 0.9464487190359325 Energy: 0.9562546963163326 minimum gb energy = 0.8530088358921725 eV minimum distance = 2.3150216177451 Angstroms sigma value = 33 ======================================== theta = 124.1232945407953 ======================================== Energy: 1.1262302955359278 Energy: 1.0612504784521526 Energy: 1.1262302955359278 Energy: 1.0612504784521526 Energy: 1.1262302955359278 Energy: 1.0612504784521526 Energy: 1.0617901809334824 Energy: 1.0886676007807985 Energy: 1.0617901809339971 Energy: 1.0886676007807985 Energy: 1.0617901809334824 Energy: 1.0886676007807985 Energy: 1.1081153350347275 Energy: 1.090842487809899 Energy: 1.1081153350347275 Energy: 1.090842487809899 Energy: 1.1081153350347275 Energy: 1.090842487809899 Energy: 1.10904837468023 Energy: 1.1123030935923002 Energy: 1.10904837468023 Energy: 1.1123030935928149 Energy: 1.10904837468023 Energy: 1.1123030935928149 Energy: 1.087672791679613 Energy: 1.0798396899954406 Energy: 1.087672791679613 Energy: 1.0798396899954406 Energy: 1.087672791679613 Energy: 1.0798396899954406 Energy: 1.1669521971564607 Energy: 1.118521638668271 Energy: 1.1669521971564607 Energy: 1.1768877945897387 Energy: 1.1669521971569754 Energy: 1.1768877945897387 Energy: 1.0590529982709702 Energy: 1.065153537832821 Energy: 1.0590529982709702 Energy: 1.065153537832821 Energy: 1.0590529982709702 Energy: 1.065153537832821 Energy: 1.1424453381370219 Energy: 1.124141334667248 Energy: 1.1424453381370219 Energy: 1.124141334667248 Energy: 1.1424453381370219 Energy: 1.124141334667248 Energy: 1.0980471009073476 Energy: 1.1407118916093113 Energy: 1.0980471009073476 Energy: 1.140711891609826 Energy: 1.0980471009073476 Energy: 1.140711891609826 Energy: 1.1179214631974055 Energy: 1.077600545794876 Energy: 1.1179214631979202 Energy: 1.077600545794876 Energy: 1.1179214631974055 Energy: 1.077600545794876 Energy: 1.1373540456101128 Energy: 1.084322641305045 Energy: 1.1373540456101128 Energy: 1.084322641305045 Energy: 1.1373540456101128 Energy: 1.084322641305045 Energy: 1.059768697419075 Energy: 1.0763539994511107 Energy: 1.059768697419075 Energy: 1.0763539994511107 Energy: 1.059768697419075 Energy: 1.0763539994516254 Energy: 1.0962773734458566 Energy: 1.0652434753352287 Energy: 1.0962773734458566 Energy: 1.0652434753352287 Energy: 1.0962773734458566 Energy: 1.0652434753352287 Energy: 1.068456365646697 Energy: 1.0938504890428435 Energy: 1.068456365646697 Energy: 1.0938504890428435 Energy: 1.068456365646697 Energy: 1.0938504890423288 Energy: 1.0590248752266929 Energy: 1.0792587440914343 Energy: 1.0590248752266929 Energy: 1.0792587440914343 Energy: 1.0590248752272073 Energy: 1.0792587440914343 Energy: 1.1091554818477407 Energy: 1.121397455380531 Energy: 1.1091554818477407 Energy: 1.1213974553800163 Energy: 1.1091554818477407 Energy: 1.1213974553800163 Energy: 1.1032301783230707 Energy: 1.0923974565817878 Energy: 1.1032301783241 Energy: 1.0923974565817878 Energy: 1.1032301783235854 Energy: 1.0923974565817878 Energy: 1.1317787361204257 Energy: 1.1692788883600633 Energy: 1.1317787361204257 Energy: 1.1692788883600633 Energy: 1.1317787361204257 Energy: 1.1692788883600633 Energy: 1.040920279611971 Energy: 1.1348161011944669 Energy: 1.040920279611971 Energy: 1.1348161011944669 Energy: 1.040920279611971 Energy: 1.1348161011944669 Energy: 1.0877539093608268 Energy: 1.0937646430729782 Energy: 1.0877539093608268 Energy: 1.0937646430729782 Energy: 1.0877539093608268 Energy: 1.093764643073493 Energy: 1.1028813462739901 Energy: 1.1275502870606948 Energy: 1.1028813462739901 Energy: 1.1275502870606948 Energy: 1.1028813462739901 Energy: 1.1275502870606948 Energy: 1.0595807607713794 Energy: 1.066791922074413 Energy: 1.0595807607718941 Energy: 1.066791922074413 Energy: 1.0595807607718941 Energy: 1.066791922074413 Energy: 1.12530076725189 Energy: 1.0848403397041928 Energy: 1.12530076725189 Energy: 1.0848403397047075 Energy: 1.1253007672513753 Energy: 1.0848403397047075 Energy: 1.1189178795896648 Energy: 1.0698797813251315 Energy: 1.1189178795896648 Energy: 1.0698797813251315 Energy: 1.11891787958915 Energy: 1.0698797813251315 Energy: 1.0547384180100192 Energy: 1.067569122887277 Energy: 1.0547384180100192 Energy: 1.067569122887277 Energy: 1.0547384180100192 Energy: 1.0675691228867625 Energy: 1.1242676375543148 Energy: 1.1102840270586058 Energy: 1.1242676375543148 Energy: 1.1102840270580911 Energy: 1.1242676375543148 Energy: 1.1102840270580911 Energy: 1.0582213467588484 Energy: 1.068146851177283 Energy: 1.0582213467588484 Energy: 1.068146851177283 Energy: 1.0582213467588484 Energy: 1.0681468511767682 Energy: 1.0989751109533363 Energy: 1.1735344576484006 Energy: 1.0989751109533363 Energy: 1.1735344576484006 Energy: 1.0989751109533363 Energy: 1.1735344576484006 Energy: 1.0861235291225173 Energy: 1.081693329114136 Energy: 1.0861235291225173 Energy: 1.081693329114136 Energy: 1.0861235291225173 Energy: 1.081693329114136 Energy: 1.0409452247551636 Energy: 1.059814153973678 Energy: 1.0409452247556783 Energy: 1.059814153973678 Energy: 1.0409452247556783 Energy: 1.059814153973678 Energy: 1.1781657950374644 Energy: 1.1703618265842994 Energy: 1.1781657950369497 Energy: 1.1703618265848141 Energy: 1.1781657950369497 Energy: 1.1703618265842994 Energy: 1.0891564394273594 Energy: 1.0927934577108376 Energy: 1.0891564394273594 Energy: 1.0927934577108376 Energy: 1.0891564394273594 Energy: 1.0927934577108376 Energy: 1.1084672683773351 Energy: 1.120632739404392 Energy: 1.1084672683773351 Energy: 1.120632739404392 Energy: 1.1084672683773351 Energy: 1.120632739404392 Energy: 1.0803840423153213 Energy: 1.0725625616502374 Energy: 1.0803840423153213 Energy: 1.0725625616502374 Energy: 1.0803840423153213 Energy: 1.0725625616507521 Energy: 1.0683975672953112 Energy: 1.0924494696435698 Energy: 1.0683975672953112 Energy: 1.0924494696440845 Energy: 1.0683975672947965 Energy: 1.0924494696435698 Energy: 1.1146532335955437 Energy: 1.0695474223237005 Energy: 1.1146532335955437 Energy: 1.0695474223237005 Energy: 1.1146532335955437 Energy: 1.0695474223237005 Energy: 1.0623924949330579 Energy: 1.0705790265661885 Energy: 1.0623924949330579 Energy: 1.0705790265661885 Energy: 1.0623924949330579 Energy: 1.0705790265661885 minimum gb energy = 1.040920279611971 eV minimum distance = 2.29900944662971 Angstroms sigma value = 41 ======================================== theta = 129.5211963586422 ======================================== Energy: 1.3416913766996001 Energy: 1.3329626449373266 Energy: 1.3416913766996001 Energy: 1.3329626449359218 Energy: 1.3416913766996001 Energy: 1.3329626449359218 Energy: 1.289376989414802 Energy: 1.309169850040406 Energy: 1.289376989414802 Energy: 1.309169850040406 Energy: 1.289376989414802 Energy: 1.309169850040406 Energy: 1.4982391013469079 Energy: 1.3039143114503553 Energy: 1.4006453059575792 Energy: 1.3039143114489498 Energy: 1.4006453059575792 Energy: 1.3039143114503553 Energy: 1.3296355892521645 Energy: 1.379581597452142 Energy: 1.3296355892521645 Energy: 1.379581597452142 Energy: 1.3296355892535698 Energy: 1.379581597452142 Energy: 1.2910489643976442 Energy: 1.348204784748828 Energy: 1.2910489643976442 Energy: 1.348204784748828 Energy: 1.2910489643976442 Energy: 1.348204784748828 Energy: 1.430862103396995 Energy: 1.4007208254310313 Energy: 1.430862103396995 Energy: 1.4007208254310313 Energy: 1.430862103396995 Energy: 1.4007208254310313 Energy: 1.330109931731072 Energy: 1.2680481896962852 Energy: 1.330109931731072 Energy: 1.2680481896962852 Energy: 1.330109931731072 Energy: 1.2680481896962852 Energy: 1.3475580715443085 Energy: 1.3107174732073057 Energy: 1.3475580715443085 Energy: 1.3107174732087106 Energy: 1.3475580715443085 Energy: 1.3107174732087106 Energy: 1.2923938972752504 Energy: 1.2862437367833768 Energy: 1.2923938972752504 Energy: 1.2862437367833768 Energy: 1.2923938972752504 Energy: 1.2862437367847819 Energy: 1.3278247447332854 Energy: 1.314404594454629 Energy: 1.3278247447332854 Energy: 1.314404594454629 Energy: 1.3278247447332854 Energy: 1.314404594454629 Energy: 1.2843296193559568 Energy: 1.3049892352976742 Energy: 1.2843296193559568 Energy: 1.3049892352976742 Energy: 1.2843296193559568 Energy: 1.3049892352976742 Energy: 1.3335593272705126 Energy: 1.3087378426664482 Energy: 1.3335593272691078 Energy: 1.3087378426664482 Energy: 1.3335593272705126 Energy: 1.3087378426664482 Energy: 1.3596053951117908 Energy: 1.3789836258188868 Energy: 1.3596053951117908 Energy: 1.3789836258188868 Energy: 1.3596053951117908 Energy: 1.3789836258188868 Energy: 1.2927920754018232 Energy: 1.3107879171716208 Energy: 1.2927920754018232 Energy: 1.3107879171716208 Energy: 1.2927920754018232 Energy: 1.3107879171716208 minimum gb energy = 1.2680481896962852 eV minimum distance = 2.28680546549745 Angstroms sigma value = 11 ======================================== theta = 135.99657265110037 ======================================== Energy: 1.5468862400812786 Energy: 1.5674037775981615 Energy: 1.5468862400812786 Energy: 1.567403777597544 Energy: 1.5468862400812786 Energy: 1.567403777597544 Energy: 1.4392050002121968 Energy: 1.488875374040751 Energy: 1.4392050002121968 Energy: 1.4888753740401337 Energy: 1.4392050002115793 Energy: 1.4888753740401337 Energy: 1.532648633913419 Energy: 1.510947480491017 Energy: 1.532648633913419 Energy: 1.510947480491017 Energy: 1.532648633913419 Energy: 1.5109474804916343 Energy: 1.5058635914456204 Energy: 1.4666789421893873 Energy: 1.5058635914456204 Energy: 1.4666789421893873 Energy: 1.5058635914456204 Energy: 1.4666789421893873 Energy: 1.5299882754845546 Energy: 1.4735852452799127 Energy: 1.5299882754845546 Energy: 1.4735852452799127 Energy: 1.5299882754845546 Energy: 1.4735852452799127 Energy: 1.495841083017515 Energy: 1.5451647798231596 Energy: 1.4958410830168978 Energy: 1.5451647798231596 Energy: 1.495841083017515 Energy: 1.5451647798231596 Energy: 1.508572076438562 Energy: 1.4958975518055682 Energy: 1.508572076438562 Energy: 1.4958975518049509 Energy: 1.508572076438562 Energy: 1.4958975518049509 Energy: 1.5017413375143773 Energy: 1.486860873218073 Energy: 1.5017413375143773 Energy: 1.486860873218073 Energy: 1.5017413375143773 Energy: 1.486860873218073 Energy: 1.518299125137825 Energy: 1.4818593354565261 Energy: 1.518299125137825 Energy: 1.4818593354565261 Energy: 1.518299125138442 Energy: 1.4818593354565261 Energy: 1.4887040879347797 Energy: 1.5350256783435434 Energy: 1.4887040879353968 Energy: 1.5350256783435434 Energy: 1.4887040879347797 Energy: 1.5350256783435434 Energy: 1.5008176229971375 Energy: 1.4958000958246447 Energy: 1.5008176229965202 Energy: 1.495800095825262 Energy: 1.5008176229965202 Energy: 1.495800095825262 Energy: 1.514753649988252 Energy: 1.5123367298023114 Energy: 1.514753649988252 Energy: 1.5123367298023114 Energy: 1.514753649988252 Energy: 1.5123367298023114 Energy: 1.5039011113803027 Energy: 1.4870995347584837 Energy: 1.5039011113803027 Energy: 1.4870995347584837 Energy: 1.5039011113803027 Energy: 1.4870995347584837 Energy: 1.5054580578534305 Energy: 1.518731750682856 Energy: 1.5054580578528134 Energy: 1.518731750682856 Energy: 1.5054580578528134 Energy: 1.518731750682856 Energy: 1.4853500873878493 Energy: 1.4945021360236377 Energy: 1.4853500873878493 Energy: 1.4945021360236377 Energy: 1.4853500873878493 Energy: 1.4945021360236377 Energy: 1.4928548716149321 Energy: 1.4951106210573981 Energy: 1.4928548716149321 Energy: 1.4951106210573981 Energy: 1.4928548716143148 Energy: 1.4951106210573981 Energy: 1.46937863435978 Energy: 1.4929601387615552 Energy: 1.46937863435978 Energy: 1.4929601387615552 Energy: 1.46937863435978 Energy: 1.4929601387621725 Energy: 1.5562485005844087 Energy: 1.5609470936348673 Energy: 1.5562485005844087 Energy: 1.5609470936348673 Energy: 1.5562485005844087 Energy: 1.5609470936348673 Energy: 1.4741204420498006 Energy: 1.4248743886992508 Energy: 1.4741204420498006 Energy: 1.4248743886992508 Energy: 1.4741204420498006 Energy: 1.4248743886992508 Energy: 1.4929129332595799 Energy: 1.4905907924964092 Energy: 1.4929129332595799 Energy: 1.4905907924964092 Energy: 1.4929129332601974 Energy: 1.4905907924964092 Energy: 1.4588300919019659 Energy: 1.4769948340176338 Energy: 1.4588300919025834 Energy: 1.4769948340176338 Energy: 1.4588300919025834 Energy: 1.4769948340176338 Energy: 1.5497025128918769 Energy: 1.553322521599461 Energy: 1.5497025128918769 Energy: 1.553322521599461 Energy: 1.5497025128918769 Energy: 1.553322521599461 Energy: 1.515472627950737 Energy: 1.5113225315397443 Energy: 1.5154726279501198 Energy: 1.5113225315397443 Energy: 1.515472627950737 Energy: 1.5113225315397443 Energy: 1.5525091170826297 Energy: 1.4917517006092418 Energy: 1.5525091170826297 Energy: 1.491751700609859 Energy: 1.5525091170826297 Energy: 1.491751700609859 Energy: 1.489664941810175 Energy: 1.5192750473506735 Energy: 1.489664941810175 Energy: 1.5192750473506735 Energy: 1.489664941810175 Energy: 1.5192750473506735 Energy: 1.4875347436878845 Energy: 1.4928902719566337 Energy: 1.4875347436878845 Energy: 1.4928902719566337 Energy: 1.4875347436878845 Energy: 1.4928902719566337 Energy: 1.4711329354010174 Energy: 1.564156555491021 Energy: 1.4711329354010174 Energy: 1.564156555491021 Energy: 1.4711329354010174 Energy: 1.564156555491021 Energy: 1.511261355789092 Energy: 1.488433423190858 Energy: 1.511261355789092 Energy: 1.488433423190858 Energy: 1.5112613557884744 Energy: 1.488433423190858 Energy: 1.5191210436268363 Energy: 1.5068993793457695 Energy: 1.5191210436268363 Energy: 1.5068993793457695 Energy: 1.5191210436268363 Energy: 1.5068993793457695 Energy: 1.4863615786049347 Energy: 1.4331021942893587 Energy: 1.4863615786049347 Energy: 1.4331021942893587 Energy: 1.4863615786049347 Energy: 1.4331021942887414 Energy: 1.4797978697669945 Energy: 1.557596393688338 Energy: 1.4797978697669945 Energy: 1.557596393688338 Energy: 1.4797978697669945 Energy: 1.557596393688338 minimum gb energy = 1.4248743886992508 eV minimum distance = 2.25868026893391 Angstroms sigma value = 57 ======================================== theta = 141.05755873101862 ======================================== Energy: 1.4741679695717975 Energy: 1.4655382687928906 Energy: 1.4741679695717975 Energy: 1.4655382687928906 Energy: 1.4741679695717975 Energy: 1.4655382687928906 Energy: 1.5381620929971347 Energy: 1.5552606108336404 Energy: 1.5381620929971347 Energy: 1.5552606108336404 Energy: 1.5381620929971347 Energy: 1.555260610832542 Energy: 1.5283063840637932 Energy: 1.5376807526770175 Energy: 1.528306384062695 Energy: 1.5376807526770175 Energy: 1.5283063840637932 Energy: 1.5376807526781158 Energy: 1.476857181458105 Energy: 1.517766738927702 Energy: 1.476857181458105 Energy: 1.517766738927702 Energy: 1.476857181458105 Energy: 1.517766738927702 Energy: 1.5288224380422446 Energy: 1.5377521884612675 Energy: 1.5288224380389492 Energy: 1.5377521884612675 Energy: 1.5288224380411461 Energy: 1.5377521884601688 Energy: 1.5382372128476416 Energy: 1.4522223796658862 Energy: 1.5382372128476416 Energy: 1.4522223796647877 Energy: 1.5382372128465431 Energy: 1.4522223796647877 Energy: 1.4741679695717975 Energy: 1.4655382687928906 Energy: 1.4741679695717975 Energy: 1.4655382687928906 Energy: 1.4741679695717975 Energy: 1.4655382687928906 Energy: 1.5381620929971347 Energy: 1.555260610832542 Energy: 1.5381620929971347 Energy: 1.555260610832542 Energy: 1.5381620929971347 Energy: 1.5552606108336404 Energy: 1.5283063840593993 Energy: 1.5376807526770175 Energy: 1.5283063840583009 Energy: 1.5376807526781158 Energy: 1.528306384062695 Energy: 1.5376807526770175 Energy: 1.476857181458105 Energy: 1.4501050779153266 Energy: 1.476857181458105 Energy: 1.4501050779153266 Energy: 1.476857181458105 Energy: 1.4501050779153266 Energy: 1.528822438047737 Energy: 1.5377521884601688 Energy: 1.5288224380488353 Energy: 1.5377521884612675 Energy: 1.528822438043343 Energy: 1.5377521884612675 Energy: 1.5382372128476416 Energy: 1.4522223796658862 Energy: 1.5382372128476416 Energy: 1.4522223796647877 Energy: 1.5382372128476416 Energy: 1.4522223796658862 Energy: 1.4741679695717975 Energy: 1.4655382687928906 Energy: 1.4741679695717975 Energy: 1.4655382687928906 Energy: 1.4741679695717975 Energy: 1.4655382687928906 Energy: 1.5381620929971347 Energy: 1.5552606108336404 Energy: 1.5381620929971347 Energy: 1.5552606108336404 Energy: 1.5381620929971347 Energy: 1.5552606108336404 Energy: 1.528306384060498 Energy: 1.5376807526770175 Energy: 1.528306384062695 Energy: 1.5376807526770175 Energy: 1.528306384060498 Energy: 1.5376807526770175 Energy: 1.476857181458105 Energy: 1.4501050779153266 Energy: 1.476857181458105 Energy: 1.4501050779153266 Energy: 1.476857181458105 Energy: 1.4501050779153266 Energy: 1.5288224380499338 Energy: 1.5377521884612675 Energy: 1.5288224380422446 Energy: 1.5377521884612675 Energy: 1.5288224380411461 Energy: 1.5377521884612675 minimum gb energy = 1.4501050779153266 eV minimum distance = 2.28609978757151 Angstroms sigma value = 9 ======================================== theta = 148.41366190347208 ======================================== Energy: 1.6119378011135743 Energy: 1.521886830234138 Energy: 1.6119378011135743 Energy: 1.521886830234138 Energy: 1.6119378011135743 Energy: 1.521886830234138 Energy: 1.5681227346930622 Energy: 1.5596565512165455 Energy: 1.5681227346930622 Energy: 1.5596565512165455 Energy: 1.5681227346930622 Energy: 1.5596565512165455 Energy: 1.5538828732932783 Energy: 1.5637587825544845 Energy: 1.5538828732932783 Energy: 1.5637587825553814 Energy: 1.5538828732932783 Energy: 1.5637587825553814 Energy: 1.532341478606798 Energy: 1.6602382313553092 Energy: 1.532341478606798 Energy: 1.6602382313553092 Energy: 1.532341478606798 Energy: 1.6602382313553092 Energy: 1.5576248796334016 Energy: 1.5781356789399252 Energy: 1.5576248796334016 Energy: 1.5781356789399252 Energy: 1.5576248796334016 Energy: 1.578135678940822 Energy: 1.5714640007323402 Energy: 1.573682670898534 Energy: 1.5714640007323402 Energy: 1.573682670898534 Energy: 1.5714640007323402 Energy: 1.573682670898534 Energy: 1.5492264297629974 Energy: 1.576949429726581 Energy: 1.5492264297629974 Energy: 1.576949429726581 Energy: 1.5492264297638942 Energy: 1.576949429726581 Energy: 1.5357748759996708 Energy: 1.6052891734095052 Energy: 1.5357748759996708 Energy: 1.6052891734095052 Energy: 1.5357748759996708 Energy: 1.605289173410402 Energy: 1.6795086476765315 Energy: 1.6086719025565799 Energy: 1.6795086476765315 Energy: 1.6086719025565799 Energy: 1.6795086476765315 Energy: 1.6086719025565799 Energy: 1.5617157265599706 Energy: 1.544591812350833 Energy: 1.5617157265599706 Energy: 1.544591812350833 Energy: 1.5617157265599706 Energy: 1.544591812350833 Energy: 1.5255556981552647 Energy: 1.5637711993742909 Energy: 1.5255556981552647 Energy: 1.5637711993742909 Energy: 1.5255556981552647 Energy: 1.5637711993742909 Energy: 1.6391492947039703 Energy: 1.5665417385232858 Energy: 1.6391492947039703 Energy: 1.5665417385232858 Energy: 1.6391492947039703 Energy: 1.5665417385232858 Energy: 1.5516406793816198 Energy: 1.6123292400095957 Energy: 1.5516406793807227 Energy: 1.6123292400095957 Energy: 1.5516406793807227 Energy: 1.6123292400095957 Energy: 1.541241046785608 Energy: 1.5492189532173894 Energy: 1.541241046785608 Energy: 1.5492189532173894 Energy: 1.5412410467847113 Energy: 1.5492189532182863 Energy: 1.6572179055729925 Energy: 1.5485503114835764 Energy: 1.657217905572096 Energy: 1.5485503114835764 Energy: 1.6572179055729925 Energy: 1.5485503114835764 Energy: 1.6202162415834325 Energy: 1.5674738312533163 Energy: 1.6202162415834325 Energy: 1.5674738312533163 Energy: 1.6202162415834325 Energy: 1.5674738312533163 Energy: 1.5939449435851347 Energy: 1.5631748897064652 Energy: 1.5939449435860316 Energy: 1.5631748897064652 Energy: 1.5939449435851347 Energy: 1.5631748897064652 Energy: 1.7332917766855633 Energy: 1.5455232009658202 Energy: 1.7332917766855633 Energy: 1.5455232009658202 Energy: 1.7332917766855633 Energy: 1.5455232009649236 Energy: 1.54732235612752 Energy: 1.5540522303266624 Energy: 1.54732235612752 Energy: 1.5540522303266624 Energy: 1.54732235612752 Energy: 1.5540522303266624 Energy: 1.5569969226138334 Energy: 1.521058112356016 Energy: 1.5569969226138334 Energy: 1.521058112356016 Energy: 1.5569969226138334 Energy: 1.521058112356016 Energy: 1.6438409680966442 Energy: 1.5826910780735421 Energy: 1.6438409680966442 Energy: 1.5826910780735421 Energy: 1.6438409680966442 Energy: 1.5826910780735421 minimum gb energy = 1.521058112356016 eV minimum distance = 2.2599021588552 Angstroms sigma value = 27 ======================================== theta = 153.4746479833903 ======================================== Energy: 1.5828108716965805 Energy: 1.5061972177880347 Energy: 1.5828108716965805 Energy: 1.5061972177880347 Energy: 1.5828108716965805 Energy: 1.5061972177880347 Energy: 1.5428110735576406 Energy: 1.4982432900094984 Energy: 1.5428110735568847 Energy: 1.4982432900102545 Energy: 1.5428110735576406 Energy: 1.4982432900102545 Energy: 1.50558905689944 Energy: 1.519393433295871 Energy: 1.50558905689944 Energy: 1.519393433295115 Energy: 1.50558905689944 Energy: 1.519393433295115 Energy: 1.501943458712843 Energy: 1.4972095427944125 Energy: 1.501943458712843 Energy: 1.4972095427951686 Energy: 1.501943458712843 Energy: 1.4972095427951686 Energy: 1.5006968571775952 Energy: 1.4563481115449035 Energy: 1.5006968571775952 Energy: 1.4563481115441475 Energy: 1.5006968571775952 Energy: 1.4563481115449035 Energy: 1.4442114340646912 Energy: 1.5332487107238766 Energy: 1.4442114340639354 Energy: 1.5332487107231203 Energy: 1.4442114340639354 Energy: 1.5332487107238766 Energy: 1.5283752720401995 Energy: 1.5215809975706367 Energy: 1.5283752720401995 Energy: 1.5215809975706367 Energy: 1.5283752720401995 Energy: 1.5215809975713928 Energy: 1.5547156952713035 Energy: 1.5052537221524456 Energy: 1.5547156952705474 Energy: 1.5052537221524456 Energy: 1.5547156952713035 Energy: 1.5052537221516895 Energy: 1.507449190637639 Energy: 1.5337222090362859 Energy: 1.507449190637639 Energy: 1.5337222090355296 Energy: 1.507449190637639 Energy: 1.5337222090362859 Energy: 1.502291824347573 Energy: 1.5091869379911222 Energy: 1.502291824347573 Energy: 1.5091869379911222 Energy: 1.502291824347573 Energy: 1.5091869379911222 Energy: 1.502156355098366 Energy: 1.5120856502576303 Energy: 1.502156355098366 Energy: 1.5120856502568742 Energy: 1.502156355098366 Energy: 1.5120856502568742 Energy: 1.5193288380806025 Energy: 1.5371391873986653 Energy: 1.5193288380806025 Energy: 1.5371391873986653 Energy: 1.5193288380806025 Energy: 1.5371391873986653 Energy: 1.5709701006871961 Energy: 1.5513503507019923 Energy: 1.5709701006871961 Energy: 1.5513503507027484 Energy: 1.5709701006871961 Energy: 1.5513503507019923 Energy: 1.5283047725050436 Energy: 1.5066116347392455 Energy: 1.5283047725050436 Energy: 1.5066116347392455 Energy: 1.5283047725050436 Energy: 1.5066116347392455 Energy: 1.4444951593271924 Energy: 1.5336046323891257 Energy: 1.4444951593271924 Energy: 1.5336046323891257 Energy: 1.4444951593271924 Energy: 1.5336046323891257 Energy: 1.5000156201108052 Energy: 1.4568042824725294 Energy: 1.5000156201100492 Energy: 1.4568042824725294 Energy: 1.5000156201108052 Energy: 1.4568042824725294 Energy: 1.5115434356621136 Energy: 1.5082640031769399 Energy: 1.5115434356621136 Energy: 1.5082640031769399 Energy: 1.5115434356621136 Energy: 1.5082640031769399 Energy: 1.4950935122074651 Energy: 1.517934701724161 Energy: 1.4950935122074651 Energy: 1.517934701724161 Energy: 1.4950935122074651 Energy: 1.517934701724161 Energy: 1.497860732706505 Energy: 1.49869893596633 Energy: 1.497860732706505 Energy: 1.498698935967086 Energy: 1.497860732706505 Energy: 1.49869893596633 Energy: 1.5828108716965805 Energy: 1.5061972177880347 Energy: 1.5828108716965805 Energy: 1.5061972177887906 Energy: 1.5828108716965805 Energy: 1.5061972177880347 Energy: 1.5428110735576406 Energy: 1.4982432900094984 Energy: 1.5428110735576406 Energy: 1.4982432900102545 Energy: 1.5428110735576406 Energy: 1.4982432900102545 Energy: 1.50558905689944 Energy: 1.519393433295115 Energy: 1.50558905689944 Energy: 1.519393433295115 Energy: 1.50558905689944 Energy: 1.519393433295871 Energy: 1.501943458712843 Energy: 1.4972095427951686 Energy: 1.501943458712843 Energy: 1.4972095427944125 Energy: 1.501943458712843 Energy: 1.4972095427951686 Energy: 1.5006968571775952 Energy: 1.4563481115441475 Energy: 1.5006968571775952 Energy: 1.4563481115441475 Energy: 1.5006968571775952 Energy: 1.4563481115441475 Energy: 1.4442114340646912 Energy: 1.5332487107231203 Energy: 1.4442114340639354 Energy: 1.5332487107231203 Energy: 1.4442114340646912 Energy: 1.5332487107238766 minimum gb energy = 1.4442114340639354 eV minimum distance = 2.28243497313189 Angstroms sigma value = 19 ======================================== theta = 157.15649268207542 ======================================== Energy: 1.5069366905608634 Energy: 1.5160363898915081 Energy: 1.5069366905608634 Energy: 1.5160363898915081 Energy: 1.5069366905608634 Energy: 1.5160363898915081 Energy: 1.496039171300172 Energy: 1.4838557395086953 Energy: 1.496039171300172 Energy: 1.4838557395086953 Energy: 1.4960391712995194 Energy: 1.4838557395086953 Energy: 1.5837006732459449 Energy: 1.449835887077866 Energy: 1.5139748378380475 Energy: 1.449835887077866 Energy: 1.5139748378380475 Energy: 1.449835887077866 Energy: 1.4700353821753744 Energy: 1.4884776131488533 Energy: 1.4700353821753744 Energy: 1.4884776131488533 Energy: 1.4700353821753744 Energy: 1.4884776131488533 Energy: 1.4963835055872883 Energy: 1.5261514439809059 Energy: 1.4963835055866357 Energy: 1.5261514439809059 Energy: 1.4963835055866357 Energy: 1.5261514439809059 Energy: 1.4793730228483366 Energy: 1.4737111319979255 Energy: 1.4793730228483366 Energy: 1.4737111319979255 Energy: 1.4793730228483366 Energy: 1.4737111319979255 Energy: 1.4575210098353075 Energy: 1.5281926775047192 Energy: 1.4575210098353075 Energy: 1.5281926775047192 Energy: 1.4575210098353075 Energy: 1.5281926775040666 Energy: 1.4872363014767003 Energy: 1.5359396158078646 Energy: 1.4872363014767003 Energy: 1.5359396158078646 Energy: 1.4872363014767003 Energy: 1.5359396158078646 Energy: 1.588703657048151 Energy: 1.4489052471849482 Energy: 1.588703657048151 Energy: 1.4489052471849482 Energy: 1.588703657048151 Energy: 1.4489052471849482 Energy: 1.5339380296563148 Energy: 1.4852571593186765 Energy: 1.5339380296563148 Energy: 1.4852571593186765 Energy: 1.5339380296563148 Energy: 1.4852571593186765 Energy: 1.453030520958218 Energy: 1.5330563905058567 Energy: 1.453030520958218 Energy: 1.5330563905058567 Energy: 1.453030520958218 Energy: 1.5330563905058567 Energy: 1.5045030779769326 Energy: 1.449072782567929 Energy: 1.5045030779769326 Energy: 1.449072782567929 Energy: 1.5045030779769326 Energy: 1.449072782567929 Energy: 1.5047330594722588 Energy: 1.4843417661104932 Energy: 1.5047330594722588 Energy: 1.4843417661104932 Energy: 1.5047330594722588 Energy: 1.4843417661104932 Energy: 1.4680703427042912 Energy: 1.4873659031827962 Energy: 1.4680703427042912 Energy: 1.4873659031827962 Energy: 1.4680703427042912 Energy: 1.4873659031827962 Energy: 1.5184706308668212 Energy: 1.451410529260772 Energy: 1.5184706308668212 Energy: 1.451410529260772 Energy: 1.5184706308668212 Energy: 1.451410529260772 Energy: 1.5209493618935597 Energy: 1.4494078280178502 Energy: 1.5209493618935597 Energy: 1.4494078280178502 Energy: 1.5209493618935597 Energy: 1.4494078280178502 Energy: 1.4690710130999534 Energy: 1.503610978386103 Energy: 1.4690710130999534 Energy: 1.503610978386103 Energy: 1.4690710131006062 Energy: 1.503610978386103 Energy: 1.518380937499772 Energy: 1.560931655727552 Energy: 1.5183809374991195 Energy: 1.560931655727552 Energy: 1.5183809374991195 Energy: 1.560931655727552 Energy: 1.4894854391685246 Energy: 1.4693097228655625 Energy: 1.4894854391685246 Energy: 1.4693097228655625 Energy: 1.4894854391685246 Energy: 1.4693097228655625 Energy: 1.4681592666292218 Energy: 1.5043106797262653 Energy: 1.4681592666285694 Energy: 1.5043106797262653 Energy: 1.4681592666292218 Energy: 1.5043106797262653 Energy: 1.4568720736655911 Energy: 1.5340448934118291 Energy: 1.4568720736655911 Energy: 1.5340448934118291 Energy: 1.4568720736655911 Energy: 1.534044893412482 Energy: 1.554522850106823 Energy: 1.464540536576091 Energy: 1.554522850106823 Energy: 1.464540536576091 Energy: 1.554522850106823 Energy: 1.464540536576091 Energy: 1.5716975328554166 Energy: 1.4934058750199344 Energy: 1.5716975328554166 Energy: 1.4934058750199344 Energy: 1.5716975328554166 Energy: 1.4934058750199344 Energy: 1.5061680962217407 Energy: 1.524931689393753 Energy: 1.5061680962217407 Energy: 1.524931689393753 Energy: 1.5061680962217407 Energy: 1.524931689393753 Energy: 1.4946751544201675 Energy: 1.4568477258311123 Energy: 1.4946751544201675 Energy: 1.4568477258311123 Energy: 1.4946751544201675 Energy: 1.4568477258311123 Energy: 1.525983502044732 Energy: 1.4728719852732142 Energy: 1.525983502044732 Energy: 1.4728719852738668 Energy: 1.525983502044732 Energy: 1.4728719852732142 Energy: 1.4514583027457126 Energy: 1.5003710711052365 Energy: 1.4514583027450603 Energy: 1.5003710711052365 Energy: 1.4514583027450603 Energy: 1.5003710711052365 Energy: 1.527328820100683 Energy: 1.4737786265056732 Energy: 1.527328820100683 Energy: 1.4737786265050206 Energy: 1.527328820100683 Energy: 1.4737786265050206 Energy: 1.4949381171489526 Energy: 1.474900536091081 Energy: 1.4949381171489526 Energy: 1.474900536091081 Energy: 1.4949381171489526 Energy: 1.4749005360904284 minimum gb energy = 1.4489052471849482 eV minimum distance = 2.25555499832303 Angstroms sigma value = 101 ======================================== theta = 159.95002427584853 ======================================== Energy: 1.423738488843589 Energy: 1.4905009699616156 Energy: 1.423738488843589 Energy: 1.490500969961042 Energy: 1.423738488843589 Energy: 1.490500969961042 Energy: 1.4948300981990783 Energy: 1.420545189234422 Energy: 1.4948300981990783 Energy: 1.420545189234422 Energy: 1.494830098199652 Energy: 1.420545189234422 Energy: 1.461272021363529 Energy: 1.3810959082155847 Energy: 1.461272021363529 Energy: 1.3810959082155847 Energy: 1.461272021363529 Energy: 1.3810959082155847 Energy: 1.375115203840177 Energy: 1.5150016283699155 Energy: 1.3751152038396035 Energy: 1.4576888713550475 Energy: 1.3751152038396035 Energy: 1.4576888713550475 Energy: 1.4301616166164528 Energy: 1.454233502035835 Energy: 1.4301616166164528 Energy: 1.454233502035835 Energy: 1.4301616166158795 Energy: 1.454233502035835 Energy: 1.4453359374949537 Energy: 1.3805602315858347 Energy: 1.4453359374949537 Energy: 1.3805602315858347 Energy: 1.4453359374955272 Energy: 1.3805602315858347 Energy: 1.418663791704954 Energy: 1.4761605768116546 Energy: 1.418663791704954 Energy: 1.4761605768116546 Energy: 1.418663791704954 Energy: 1.4761605768116546 Energy: 1.3759203655632524 Energy: 1.4691403307459223 Energy: 1.3759203655632524 Energy: 1.4691403307453488 Energy: 1.3759203655632524 Energy: 1.4691403307459223 Energy: 1.446591152830469 Energy: 1.381816600784748 Energy: 1.446591152830469 Energy: 1.381816600784748 Energy: 1.446591152830469 Energy: 1.381816600784748 Energy: 1.4288301837127972 Energy: 1.4662003748899601 Energy: 1.4288301837127972 Energy: 1.4662003748899601 Energy: 1.4288301837127972 Energy: 1.4662003748899601 Energy: 1.3722615266991438 Energy: 1.6295523962699245 Energy: 1.3722615266991438 Energy: 1.6295523962693508 Energy: 1.3722615266997173 Energy: 1.6295523962699245 Energy: 1.5184350447293584 Energy: 1.4191679996194446 Energy: 1.5184350447293584 Energy: 1.4191679996194446 Energy: 1.5184350447293584 Energy: 1.4191679996194446 Energy: 1.4431896514130167 Energy: 1.421296044365887 Energy: 1.4431896514130167 Energy: 1.421296044365887 Energy: 1.4431896514130167 Energy: 1.421296044365887 Energy: 1.4305841643306585 Energy: 1.4965883522179535 Energy: 1.4305841643306585 Energy: 1.4965883522179535 Energy: 1.4305841643306585 Energy: 1.541092486008226 Energy: 1.498115115323333 Energy: 1.4203577734904203 Energy: 1.498115115323333 Energy: 1.4203577734904203 Energy: 1.498115115323333 Energy: 1.4203577734898463 Energy: 1.4615673830925355 Energy: 1.3801787026399006 Energy: 1.4615673830925355 Energy: 1.3801787026399006 Energy: 1.4615673830925355 Energy: 1.3801787026399006 Energy: 1.3691050433650802 Energy: 1.4928702953554014 Energy: 1.3691050433650802 Energy: 1.4928702953554014 Energy: 1.3691050433650802 Energy: 1.4928702953554014 Energy: 1.3671725505010874 Energy: 1.4525747613565994 Energy: 1.3671725505016612 Energy: 1.4525747613565994 Energy: 1.3671725505010874 Energy: 1.4525747613565994 Energy: 1.4440258216761517 Energy: 1.3819372779476042 Energy: 1.444025821675578 Energy: 1.3819372779476042 Energy: 1.444025821675578 Energy: 1.3819372779476042 Energy: 1.4224217703100381 Energy: 1.4545341546569837 Energy: 1.4224217703100381 Energy: 1.4545341546569837 Energy: 1.4224217703100381 Energy: 1.4545341546569837 Energy: 1.372647915002774 Energy: 1.6219388015826703 Energy: 1.372647915002774 Energy: 1.6219388015826703 Energy: 1.372647915002774 Energy: 1.6219388015826703 Energy: 1.4990379315038571 Energy: 1.3739896633595345 Energy: 1.4990379315038571 Energy: 1.3739896633595345 Energy: 1.4990379315038571 Energy: 1.3739896633595345 Energy: 1.4986083669857428 Energy: 1.4096957418449299 Energy: 1.4986083669857428 Energy: 1.4096957418449299 Energy: 1.4986083669857428 Energy: 1.4096957418449299 Energy: 1.3749930656291784 Energy: 1.497292901007208 Energy: 1.374993065628605 Energy: 1.497292901007208 Energy: 1.3749930656291784 Energy: 1.497292901007208 Energy: 1.5155517103177418 Energy: 1.4216267502434115 Energy: 1.5155517103183154 Energy: 1.4216267502434115 Energy: 1.5155517103183154 Energy: 1.4216267502434115 Energy: 1.4471680505769846 Energy: 1.3795925653256933 Energy: 1.4471680505769846 Energy: 1.3795925653256933 Energy: 1.4471680505769846 Energy: 1.3795925653251198 Energy: 1.4232831967360893 Energy: 1.4784166760589479 Energy: 1.423283196736663 Energy: 1.4784166760589479 Energy: 1.423283196736663 Energy: 1.4784166760589479 Energy: 1.4234099993972666 Energy: 1.475931615083991 Energy: 1.4234099993972666 Energy: 1.475931615083991 Energy: 1.4234099993972666 Energy: 1.475931615083991 Energy: 1.4986758759063212 Energy: 1.3974796622259795 Energy: 1.4986758759057477 Energy: 1.3974796622259795 Energy: 1.4986758759063212 Energy: 1.3974796622259795 Energy: 1.3672039532316222 Energy: 1.47734086596544 Energy: 1.3672039532321958 Energy: 1.47734086596544 Energy: 1.3672039532316222 Energy: 1.47734086596544 Energy: 1.3697262120731235 Energy: 1.4465089837392773 Energy: 1.3697262120731235 Energy: 1.4465089837392773 Energy: 1.3697262120731235 Energy: 1.4465089837387037 Energy: 1.4986603739846605 Energy: 1.3738476740436025 Energy: 1.4986603739846605 Energy: 1.3738476740430288 Energy: 1.4986603739846605 Energy: 1.3738476740441763 Energy: 1.500343004065487 Energy: 1.4108448578681518 Energy: 1.5003430040649135 Energy: 1.4108448578681518 Energy: 1.500343004065487 Energy: 1.4108448578681518 minimum gb energy = 1.3671725505010874 eV minimum distance = 2.27000797713979 Angstroms sigma value = 33 ======================================== theta = 180.0 ======================================== Energy: 0.02094691704120125 Energy: 1.0942141874349998 Energy: 0.02094691704120125 Energy: 1.0942141874349998 Energy: 0.02094691704120125 Energy: 1.0942141874349998 Energy: 0.023951222133500927 Energy: 0.3714219328382761 Energy: 0.023951222133500927 Energy: 0.37142193283785246 Energy: 0.023951222133500927 Energy: 0.3714219328382761 Energy: 1.0949807656032777 Energy: 0.37211779975412485 Energy: 1.0949728628709983 Energy: 0.37211779977975684 Energy: 1.0949708667802962 Energy: 0.37211779977790327 Energy: 0.02395122213397756 Energy: 0.3714219328382761 Energy: 0.023951222133500927 Energy: 0.37142193283785246 Energy: 0.023951222133500927 Energy: 0.37142193283785246 minimum gb energy = 0.02094691704120125 eV minimum distance = 2.45075687949455 Angstroms sigma value = 1