Model name: model_name=Sim_LAMMPS_MEAM_AsadiZaeemNouranian_2015_Cu__SM_239791545509_000 a1: a1=[1, -1, 0] a2: a2=[1, 1, -2] a3: a3=[1, 1, 1] Species: species=Cu Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=3.620386689901352 cohesive_energy=3.5402784093701025 mass=63.546 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=60.0 Max. denominator: max_denominator=8 Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5 Min. number unit cell repetitions along x direction: x_repeat=1 Min. number unit cell repetitions along z direction: z_repeat=1 Min. cell height (Angstroms): min_cell_height=10.0 Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25 Isolated atom energy: 0.0 eV ======================================== theta = 0.0 ======================================== Energy: 0.016712825549728992 Energy: 0.380641912201753 Energy: 0.8808464954389449 Energy: 0.38075485494675576 Energy: 0.016712825550239587 Energy: 0.3806419122024905 Energy: 0.8808464954376968 Energy: 0.33057546550130973 Energy: 0.01695388363870653 Energy: 0.2430291628883693 Energy: 0.017034306778369444 Energy: 0.33057546550204725 Energy: 0.016953883637940637 Energy: 0.24302916288862458 Energy: 0.016712825549984288 Energy: 0.38064191220200827 Energy: 0.8808464954389449 Energy: 0.38075485494650047 Energy: 0.016712825550239587 Energy: 0.3806419122024905 Energy: 0.8808464954376968 Energy: 0.33057546550105443 Energy: 0.016953883638451232 Energy: 0.243029162888114 Energy: 0.017034306778114145 Energy: 0.33057546550230255 Energy: 0.016953883637685338 Energy: 0.2430291628883693 Energy: 0.016712825549984288 Energy: 0.38064191220200827 Energy: 0.8808464954389449 Energy: 0.38075485494650047 Energy: 0.016712825549984288 Energy: 0.38064191220274585 Energy: 0.8808464954376968 Energy: 0.33057546550130973 Energy: 0.01695388363870653 Energy: 0.243029162888114 Energy: 0.01703430677785885 Energy: 0.33057546550204725 Energy: 0.016953883638195937 Energy: 0.2430291628883693 minimum gb energy = 0.016712825549728992 eV minimum distance = 2.53873194436205 Angstroms sigma value = 5 ======================================== theta = 24.43269767945453 ======================================== Energy: 1.0509003934064716 Energy: 1.097216322671938 Energy: 1.0898446292556305 Energy: 1.0971501699562178 Energy: 1.0509003934064716 Energy: 1.0972163226688885 Energy: 1.0898446292556305 Energy: 1.013828416009841 Energy: 1.0351026086072415 Energy: 1.0271406003413248 Energy: 1.033419538006955 Energy: 1.0138284160037416 Energy: 1.0351026086072415 Energy: 1.0271406003443744 Energy: 0.970096333312424 Energy: 0.9851117113740695 Energy: 1.1044052753008833 Energy: 1.0301395782436975 Energy: 0.970096333312424 Energy: 0.9851117113801688 Energy: 1.1044052753069824 Energy: 1.0523456411211844 Energy: 0.9974838745404495 Energy: 1.0908775298056437 Energy: 1.0315102068106627 Energy: 1.0523456411242342 Energy: 0.9974838745465489 Energy: 1.0908775298056437 Energy: 0.9774752541510648 Energy: 0.959221914452201 Energy: 1.090219875067664 Energy: 0.9981806534421948 Energy: 0.9774752541510648 Energy: 0.959221914452201 Energy: 1.090219875067664 Energy: 1.0157092274406023 Energy: 1.029913884440326 Energy: 1.060694304265703 Energy: 1.018998785356152 Energy: 1.0157092274406023 Energy: 1.0299138844464255 Energy: 1.060694304265703 Energy: 0.9754846207985438 Energy: 1.0099955758257002 Energy: 1.1225550269182238 Energy: 1.0652036260024806 Energy: 0.975484620795494 Energy: 1.0099955758257002 Energy: 1.1225550269182238 Energy: 0.97106721128427 Energy: 0.9696991435711301 Energy: 1.1986725482399276 Energy: 1.000884154918321 Energy: 0.97106721128427 Energy: 0.9696991435711301 Energy: 1.1986725482368779 Energy: 0.9674392785014364 Energy: 0.9951826965194421 Energy: 1.175952736919269 Energy: 0.9686109740728747 Energy: 0.9674392784953372 Energy: 0.9951826965224919 Energy: 1.175952736919269 Energy: 0.9780944247265763 Energy: 1.026715059074683 Energy: 1.1399800124797395 Energy: 0.985165245007907 Energy: 0.9780944247326757 Energy: 1.026715059074683 Energy: 1.1399800124797395 Energy: 0.9814836931295998 Energy: 1.05734834638451 Energy: 1.0594701966512232 Energy: 1.018925773920325 Energy: 0.9814836931295998 Energy: 1.05734834638451 Energy: 1.0594701966481737 Energy: 1.0096561168288505 Energy: 1.0619674518386988 Energy: 1.0943305733930806 Energy: 0.9942998187545539 Energy: 1.0096561168288505 Energy: 1.0619674518356492 Energy: 1.0943305733930806 Energy: 1.1035536042485874 Energy: 1.0741295597042102 Energy: 1.114532674756662 Energy: 1.0232341375630105 Energy: 1.1035536042485874 Energy: 1.0741295597042102 Energy: 1.1145326747536124 Energy: 1.0105762421876265 Energy: 1.0163249986986356 Energy: 1.0424015186617632 Energy: 0.9821636700103422 Energy: 1.0105762421876265 Energy: 1.0163249986955858 Energy: 1.0424015186617632 Energy: 0.9820228812532631 Energy: 0.9997817542580975 Energy: 1.0574941619203553 Energy: 1.0213036532591218 Energy: 0.9820228812502133 Energy: 0.9997817542550477 Energy: 1.0574941619264546 Energy: 1.061809237850518 Energy: 1.0618272673457423 Energy: 1.1443620118340116 Energy: 1.13445359071422 Energy: 1.0618092378535677 Energy: 1.0618272673457423 Energy: 1.1443620118370614 Energy: 1.0172585394411948 Energy: 0.9927319893545048 Energy: 1.0453608802480188 Energy: 1.062758157770301 Energy: 1.0172585394411948 Energy: 0.9927319893545048 Energy: 1.045360880244969 Energy: 0.974873834138007 Energy: 0.9703141286689302 Energy: 1.1503674870076246 Energy: 0.9950771776234862 Energy: 0.974873834138007 Energy: 0.9703141286719799 Energy: 1.1503674870076246 Energy: 0.9903451730072205 Energy: 0.9791897204856091 Energy: 1.2003118553982266 Energy: 0.9979999781433527 Energy: 0.9903451730072205 Energy: 0.9791897204856091 Energy: 1.2003118553982266 Energy: 0.9810821429025537 Energy: 0.9594914349998773 Energy: 1.0953797716446054 Energy: 1.004534794282105 Energy: 0.9810821428995039 Energy: 0.9594914349998773 Energy: 1.0953797716446054 Energy: 0.9753921449481747 Energy: 1.0506722141972182 Energy: 1.061732322897213 Energy: 0.9823783038445584 Energy: 0.975392144945125 Energy: 1.0506722141972182 Energy: 1.0617323229002626 Energy: 0.9756599301935894 Energy: 1.040203262708614 Energy: 1.186132692121274 Energy: 0.9794985667692264 Energy: 0.9756599301935894 Energy: 1.0402032627055642 Energy: 1.186132692121274 Energy: 1.0139298871822178 Energy: 0.9947237064695793 Energy: 1.197057313242032 Energy: 0.9952425502635892 Energy: 1.0139298871822178 Energy: 0.9947237064665296 Energy: 1.1970573132450817 Energy: 1.0034171381887143 Energy: 1.0934929420082022 Energy: 1.0899343913101318 Energy: 1.0065240044025425 Energy: 1.0034171381826147 Energy: 1.0934929420051525 Energy: 1.0899343913131816 Energy: 0.9754401803677243 Energy: 1.0868034343668063 Energy: 1.1476173636244933 Energy: 1.0058009459678936 Energy: 0.9754401803707741 Energy: 1.0868034343668063 Energy: 1.1476173636214437 Energy: 0.9998934121408694 Energy: 1.0284619751069932 Energy: 1.0410760663138072 Energy: 1.0457364235776472 Energy: 0.9998934121378197 Energy: 1.0284619751008937 Energy: 1.041076066316857 Energy: 1.040354226775411 Energy: 1.0113682635419998 Energy: 1.0872143919902209 Energy: 0.9866815595200227 Energy: 1.0403542267723613 Energy: 1.0113682635450494 Energy: 1.1026278999949202 Energy: 1.0345110990721202 Energy: 1.101417016860475 Energy: 1.089575334483107 Energy: 1.1204704700882542 Energy: 1.0345110990690705 Energy: 1.1014170168574253 Energy: 1.0895753344892065 Energy: 1.0054306720205883 Energy: 0.9966571271839333 Energy: 1.0789735192350047 Energy: 1.013000878766298 Energy: 1.0054306720236381 Energy: 0.9966571271839333 Energy: 1.0789735192350047 Energy: 0.9767368043849721 Energy: 1.0047145969201974 Energy: 1.1320690360516377 Energy: 1.0252208672981353 Energy: 0.9767368043819223 Energy: 1.0047145969232472 Energy: 1.1320690360485879 Energy: 0.9744986250013341 Energy: 1.027307071907438 Energy: 1.187384788508537 Energy: 1.077307586129589 Energy: 0.9744986250074336 Energy: 1.0273070719013389 Energy: 1.1873847885054873 Energy: 0.9957498890871967 Energy: 1.0092207487652574 Energy: 1.0302510432918985 Energy: 1.0293090228060515 Energy: 0.9957498890902463 Energy: 1.0092207487622078 Energy: 1.0302510432918985 Energy: 0.9915412130525595 Energy: 1.001022031564226 Energy: 1.154277746858411 Energy: 0.9977464220998626 Energy: 0.9915412130525595 Energy: 1.0010220315672755 Energy: 1.154277746858411 Energy: 0.9885140393285964 Energy: 0.9794419635913565 Energy: 1.1980700295691906 Energy: 1.0002653000599906 Energy: 0.9885140393285964 Energy: 0.979441963588307 Energy: 1.1980700295691906 Energy: 0.9764860168812721 Energy: 0.973763408518937 Energy: 1.0396801906709756 Energy: 1.0383846213945658 Energy: 0.9764860168843217 Energy: 0.973763408518937 Energy: 1.0396801906709756 Energy: 0.9758805040626577 Energy: 1.0279217908193363 Energy: 1.102052035518125 Energy: 0.9825908887053197 Energy: 0.9758805040596081 Energy: 1.027921790822386 Energy: 1.1020520355150756 Energy: 0.959439247375445 Energy: 1.018251884624625 Energy: 1.1844560999694052 Energy: 0.9794921079055502 Energy: 0.959439247375445 Energy: 1.0182518846276745 Energy: 1.184456099972455 Energy: 0.9758189140072003 Energy: 0.9914883384488353 Energy: 1.1223801810618579 Energy: 1.0005328250179872 Energy: 0.9758189140163492 Energy: 0.9914883384549348 Energy: 1.1223801810588083 Energy: 0.9966503281593968 Energy: 1.1104667003384772 Energy: 1.1264927550980912 Energy: 0.9991030423396434 Energy: 0.9966503281624466 Energy: 1.1104667003384772 Energy: 1.1264927550920474 Energy: 1.0572322918344481 Energy: 1.0882716970649622 Energy: 1.1186143926274685 Energy: 1.0313284953144601 Energy: 1.0572322918344481 Energy: 1.0882716970649622 Energy: 1.118614392630518 Energy: 1.003409619360634 Energy: 1.013438447780864 Energy: 1.0433034256511973 Energy: 1.036595790592701 Energy: 1.0034096193575843 Energy: 1.0134384477839138 Energy: 1.0433034256511973 Energy: 1.0601309718885947 Energy: 0.9809721886288822 Energy: 1.0429865508336462 Energy: 0.9940326343660167 Energy: 1.060130971885545 Energy: 0.9809721886288822 Energy: 1.0429865508336462 Energy: 1.1053304511950441 Energy: 1.0025799796720867 Energy: 1.1257307606167029 Energy: 1.0999930391320232 Energy: 1.1053304512011433 Energy: 1.0025799796751365 Energy: 1.1257307606197526 Energy: 1.0079309741915539 Energy: 1.0031406932513018 Energy: 1.1503310668145033 Energy: 1.059374196241272 Energy: 1.0079309741946034 Energy: 1.003140693248252 Energy: 1.1503310668114535 Energy: 0.9594684784067505 Energy: 0.9845827133530197 Energy: 1.1408689842585165 Energy: 1.0272389520823557 Energy: 0.9594684784067505 Energy: 0.9845827133560694 Energy: 1.140868984255467 Energy: 0.9758092777365049 Energy: 1.0059610378269366 Energy: 1.2388418439755982 Energy: 1.0506313558804135 Energy: 0.9758092777395546 Energy: 1.0059610378269366 Energy: 1.238841843978648 Energy: 0.964804858593555 Energy: 1.0455010166722563 Energy: 1.0738571231678573 Energy: 0.984521319580354 Energy: 0.9648048585874557 Energy: 1.045501016675306 Energy: 1.0738571231648077 minimum gb energy = 0.959221914452201 eV minimum distance = 2.29767778277776 Angstroms sigma value = 401 ======================================== theta = 27.79577249602797 ======================================== Energy: 1.0595499049347887 Energy: 1.1100722134470882 Energy: 1.0518716799395402 Energy: 1.1172938075043222 Energy: 1.0595499049351034 Energy: 1.1100722134477805 Energy: 1.0518716799392256 Energy: 0.9601515124240104 Energy: 1.0509824727659385 Energy: 1.0785685818839787 Energy: 1.0246459800665422 Energy: 0.9601515124243879 Energy: 1.0509824727673232 Energy: 1.0785685818843564 Energy: 0.9593208729582582 Energy: 1.0415037924024393 Energy: 1.032544777424101 Energy: 0.981239524162817 Energy: 0.9593208729582582 Energy: 1.0415037924027541 Energy: 1.032544777422024 Energy: 0.981245467922411 Energy: 1.0618887351838746 Energy: 1.0579236848636975 Energy: 1.0304216231393086 Energy: 0.9812454679206486 Energy: 1.0618887351848816 Energy: 1.0579236848654598 Energy: 0.9688508334475567 Energy: 0.9980478481250908 Energy: 1.133356814003298 Energy: 1.1023141291376992 Energy: 0.9688508334472421 Energy: 0.9980478481226992 Energy: 1.133356814001913 Energy: 0.9599838489437537 Energy: 0.9812847007435259 Energy: 1.1296530326445944 Energy: 1.065039646763812 Energy: 0.9599838489423691 Energy: 0.9812847007431482 Energy: 1.1296530326439023 Energy: 0.9684281918264351 Energy: 0.9771094537793578 Energy: 1.1601584860890675 Energy: 1.0464111990910745 Energy: 0.9684281918278198 Energy: 0.9771094537807424 Energy: 1.1601584860911445 Energy: 0.9697794587713832 Energy: 1.028653253671032 Energy: 1.1433960152613787 Energy: 0.9908321185613294 Energy: 0.9697794587703131 Energy: 1.0286532536721023 Energy: 1.1433960152613787 Energy: 0.9517345403968762 Energy: 1.1045473042605984 Energy: 1.0485737935509378 Energy: 0.9790751520034372 Energy: 0.9517345403978833 Energy: 1.1045473042592135 Energy: 1.0485737935527 Energy: 0.981101149953291 Energy: 1.1120441182341636 Energy: 1.046023455356632 Energy: 1.0190617484138713 Energy: 0.9811011499515918 Energy: 1.1120441182334713 Energy: 1.046023455356632 Energy: 0.9905064282848256 Energy: 1.0160993617674334 Energy: 1.0580319842800197 Energy: 1.0352824978284647 Energy: 0.9905064282851402 Energy: 1.0160993617664265 Energy: 1.0580319842800197 Energy: 0.9596823344831068 Energy: 0.9794893958418052 Energy: 1.0600117772078104 Energy: 1.0386579581730067 Energy: 0.9596823344824145 Energy: 0.9794893958431898 Energy: 1.0600117772057334 Energy: 0.974442756008751 Energy: 1.002444991186839 Energy: 1.1207603726395066 Energy: 1.079511531304417 Energy: 0.974442756007744 Energy: 1.0024449911861466 Energy: 1.120760372639192 Energy: 0.97806857398545 Energy: 1.1100722134470882 Energy: 1.0518716799395402 Energy: 1.1172938075043222 Energy: 0.9780685739823659 Energy: 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1.0902603793929508 Energy: 1.0386579581740765 Energy: 0.9589389084331302 Energy: 0.9794893958431898 Energy: 1.0902603793947132 Energy: 0.9611196242033069 Energy: 1.0024449911871536 Energy: 1.1303204668414433 Energy: 1.0795115313041022 Energy: 0.9611196242029293 Energy: 1.002444991186839 Energy: 1.130320466841758 Energy: 1.059549904934411 Energy: 1.1100722134474028 Energy: 1.0271947704467976 Energy: 1.11729380750363 Energy: 1.059549904934411 Energy: 1.1100722134474028 Energy: 1.0271947704474897 Energy: 0.9601515124236957 Energy: 1.0509824727655608 Energy: 1.0785685818836641 Energy: 1.0246459800665422 Energy: 0.9601515124240104 Energy: 1.0509824727673232 Energy: 1.0785685818839787 Energy: 0.9593208729589504 Energy: 1.0415037924031318 Energy: 1.032544777424101 Energy: 0.9812395241635093 Energy: 0.9593208729586357 Energy: 1.0415037924027541 Energy: 1.0325447774217094 Energy: 0.981245467921341 Energy: 1.0618887351841892 Energy: 1.0579236848647673 Energy: 1.0304216231386163 Energy: 0.9812454679210263 Energy: 1.061888735185574 Energy: 1.0579236848640752 Energy: 0.9688508334472421 Energy: 0.9980478481247762 Energy: 1.1333568140036754 Energy: 1.1023141291380767 Energy: 0.9688508334475567 Energy: 0.9980478481226992 Energy: 1.1333568140015984 Energy: 0.9599838489437537 Energy: 0.9812847007431482 Energy: 1.1296530326449092 Energy: 1.0650396467645042 Energy: 0.9599838489423691 Energy: 0.9812847007438407 Energy: 1.1296530326439023 Energy: 0.9684281918271276 Energy: 0.9771094537797353 Energy: 1.1601584860897598 Energy: 1.0464111990934661 Energy: 0.9684281918281975 Energy: 0.9771094537793578 Energy: 1.1601584860915222 Energy: 0.9697794587703131 Energy: 1.0286532536703399 Energy: 1.1433960152596796 Energy: 0.9908321185613294 Energy: 0.9697794587703131 Energy: 1.028653253671032 Energy: 1.1433960152617564 Energy: 0.951734540397191 Energy: 1.1045473042605984 Energy: 1.0683613026753895 Energy: 0.9790751520024301 Energy: 0.9517345403982609 Energy: 1.104547304258836 Energy: 1.0683613026753895 Energy: 0.9811011499536687 Energy: 1.112044118234856 Energy: 1.1298423195694494 Energy: 1.0190617484138713 Energy: 0.981101149951214 Energy: 1.1120441182341636 Energy: 1.1298423195690717 Energy: 0.9905064282848256 Energy: 1.0160993617671188 Energy: 1.1480466037229158 Energy: 1.0352824978288424 Energy: 0.9905064282851402 Energy: 1.0160993617657341 Energy: 1.1480466037222232 Energy: 0.9596823344831068 Energy: 0.9794893958414275 Energy: 1.1336586957523127 Energy: 1.0386579581740765 Energy: 0.9596823344817221 Energy: 0.9794893958424975 Energy: 1.1336586957502355 Energy: 0.9744427560091288 Energy: 1.002444991186839 Energy: 1.1303204668414433 Energy: 1.079511531304417 Energy: 0.9744427560080587 Energy: 1.0024449911864612 Energy: 1.130320466841758 Energy: 0.9780685739847578 Energy: 1.1100722134467105 Energy: 1.0271947704467976 Energy: 1.1172938075043222 Energy: 0.9780685739823659 Energy: 1.1100722134477805 Energy: 1.0271947704484967 Energy: 0.9601515124236957 Energy: 1.0509824727662533 Energy: 1.0785685818843564 Energy: 1.0459097223656717 Energy: 0.9601515124247026 Energy: 1.0509824727676378 Energy: 1.0785685818843564 minimum gb energy = 0.9517345403968762 eV minimum distance = 2.29869834467528 Angstroms sigma value = 311 ======================================== theta = 32.20422750397202 ======================================== Energy: 1.0969922958500835 Energy: 0.9943308155546267 Energy: 1.192916152659701 Energy: 1.001397784046353 Energy: 1.0969922958504832 Energy: 0.9943308155550264 Energy: 1.1929161526589016 Energy: 1.0131424543559995 Energy: 1.0217447088477223 Energy: 1.0376762772949883 Energy: 1.0139392500496496 Energy: 1.0131424543555996 Energy: 1.0217447088477223 Energy: 1.0376762772953878 Energy: 1.070139190253624 Energy: 0.9896850428021677 Energy: 1.1317009546393417 Energy: 1.022665340398901 Energy: 1.0701391902532242 Energy: 0.9896850428017681 Energy: 1.1317009546393417 Energy: 1.00192638206927 Energy: 0.9771887398636456 Energy: 1.1216469784588299 Energy: 0.9988039187701971 Energy: 1.00192638206967 Energy: 0.9771887398632461 Energy: 1.1216469784584304 Energy: 1.0170249152764075 Energy: 0.9736373813958056 Energy: 1.1457826418369377 Energy: 1.0166581618692585 Energy: 1.017024915276008 Energy: 0.9736373813954058 Energy: 1.1457826418369377 Energy: 1.003675006748115 Energy: 0.9464294810296612 Energy: 1.0437769605368181 Energy: 1.0101879131634854 Energy: 1.003675006748115 Energy: 0.9464294810296612 Energy: 1.0437769605356189 Energy: 0.9979439157187914 Energy: 1.0763477263192653 Energy: 1.078768095260381 Energy: 1.041023859170089 Energy: 0.9979439157191913 Energy: 1.076347726319665 Energy: 1.078768095260781 Energy: 1.0024343445078843 Energy: 1.006646617563436 Energy: 1.2115943517554835 Energy: 0.9911012549490978 Energy: 1.0024343445078843 Energy: 1.006646617563436 Energy: 1.2115943517558831 Energy: 1.0066641968087953 Energy: 1.000683025670252 Energy: 1.1286506275513888 Energy: 0.9579731310523584 Energy: 1.0066641968087953 Energy: 1.0006830256710513 Energy: 1.1286506275509889 Energy: 1.00097103093924 Energy: 1.0393788506707555 Energy: 1.1077156217800852 Energy: 1.0368598046428317 Energy: 1.0009710309380406 Energy: 1.0393788506707555 Energy: 1.1077156217808846 Energy: 1.0371975824791093 Energy: 0.9569494866342504 Energy: 1.0729189369653314 Energy: 0.9409524113621842 Energy: 1.037197582479509 Energy: 0.9569494866330512 Energy: 1.0729189369649317 Energy: 1.028346092622675 Energy: 1.0303740541763418 Energy: 1.1252786138047952 Energy: 1.0387513377718662 Energy: 1.0283460926222752 Energy: 1.0303740541775408 Energy: 1.1252786138055946 Energy: 0.9702685283259745 Energy: 0.993941978640754 Energy: 1.0836153942861577 Energy: 0.9845211156290335 Energy: 0.9702685283259745 Energy: 0.9939419786399544 Energy: 1.0836153942849587 Energy: 0.9757348397704414 Energy: 0.9995584096493739 Energy: 1.0869378490558796 Energy: 1.0102243713673829 Energy: 0.9757348397696418 Energy: 0.9995584096497736 Energy: 1.0869378490566792 Energy: 1.0456294943324553 Energy: 0.9787306884063699 Energy: 1.0992448688615108 Energy: 1.0303266916624902 Energy: 1.045629494332855 Energy: 0.9787306884059702 Energy: 1.0992448688615108 Energy: 1.025317365554067 Energy: 1.0072630143645835 Energy: 1.076072595060193 Energy: 1.0364900045472973 Energy: 1.0253173655536674 Energy: 1.007263014365383 Energy: 1.0760725950597931 Energy: 1.0174276115334568 Energy: 0.9442611059033656 Energy: 1.0528990559994869 Energy: 0.9598196623885404 Energy: 1.0174276115326575 Energy: 0.9442611059037653 Energy: 1.0528990559986873 Energy: 0.9875452776929834 Energy: 1.059293920870049 Energy: 1.1640436869454853 Energy: 1.0236897744133275 Energy: 0.9875452776937463 Energy: 1.0592939208708485 Energy: 1.164043686945885 Energy: 0.9892129630789704 Energy: 0.975060575341099 Energy: 1.1565116684804388 Energy: 1.0218831469014413 Energy: 0.98921296307937 Energy: 0.975060575341099 Energy: 1.1565116684792396 Energy: 1.0023150362485966 Energy: 0.9463287628957062 Energy: 1.122393419177804 Energy: 0.9585948106482726 Energy: 1.0023150362485966 Energy: 0.9463287628949066 Energy: 1.1223934191770044 Energy: 1.0096181891064087 Energy: 1.046611383127837 Energy: 1.1181217828295764 Energy: 1.0066317468667991 Energy: 1.0096181891064087 Energy: 1.0466113831274373 Energy: 1.1181217828299759 Energy: 1.0067382565159404 Energy: 0.9821384224222611 Energy: 1.0613575803409754 Energy: 0.9634029069561496 Energy: 1.00673825651634 Energy: 0.9821384224226607 Energy: 1.0613575803417747 Energy: 1.0161653004149653 Energy: 0.9955547771188193 Energy: 1.2276209823588595 Energy: 0.9797104923239173 Energy: 1.0161653004145657 Energy: 0.9955547771192192 Energy: 1.2276209823580602 Energy: 0.9812963405458447 Energy: 1.0072854089630168 Energy: 1.1107970206613542 Energy: 0.9839544718275537 Energy: 0.9812963405470438 Energy: 1.0072854089634165 Energy: 1.1107970206617541 Energy: 1.060831395928608 Energy: 1.0172552515256983 Energy: 1.1535450931967288 Energy: 0.9936836913885182 Energy: 1.0608313959294076 Energy: 1.0172552515252984 Energy: 1.1535450931967288 Energy: 1.0545735208053588 Energy: 1.038311320665769 Energy: 1.06618947750296 Energy: 1.0701313450769503 Energy: 1.0545735208053588 Energy: 1.038311320666968 Energy: 1.0661894775033594 Energy: 1.0577122438683657 Energy: 0.9862618381268232 Energy: 1.1568903566256603 Energy: 1.0010500242693512 Energy: 1.0577122438675663 Energy: 0.9862618381272231 Energy: 1.1568903566240614 Energy: 1.0147746845906647 Energy: 1.0448461948302137 Energy: 1.0208770580114275 Energy: 1.02905875191764 Energy: 1.0147746845906647 Energy: 1.044846194829414 Energy: 1.0208770580122268 Energy: 1.01413892396918 Energy: 0.9959345280782336 Energy: 1.1331154392956193 Energy: 1.014367428483098 Energy: 1.0141389239687801 Energy: 0.9959345280786333 Energy: 1.1331154392960192 Energy: 0.981253400970713 Energy: 1.004665918967948 Energy: 1.1283050814256752 Energy: 1.0220274765742179 Energy: 0.9812534009711129 Energy: 1.0046659189671485 Energy: 1.128305081426075 Energy: 1.022765281401455 Energy: 0.9869470647342606 Energy: 1.1069912796433625 Energy: 0.9901589721175205 Energy: 1.0227652814010553 Energy: 0.986947064733461 Energy: 1.1069912796453611 Energy: 1.0038193704251794 Energy: 0.9537517885618839 Energy: 1.059113680553754 Energy: 0.9869986958531477 Energy: 1.00381937042438 Energy: 0.9537517885622836 Energy: 1.059113680553754 Energy: 0.9922430736397204 Energy: 1.0719721170875032 Energy: 1.1030312370939088 Energy: 1.0092736135867666 Energy: 0.9922430736397204 Energy: 1.0719721170871035 Energy: 1.1030312370947082 Energy: 1.0070084130094796 Energy: 0.972895365148661 Energy: 1.1838629091216326 Energy: 0.999275218527249 Energy: 1.0070084130098795 Energy: 0.972895365148661 Energy: 1.1838629091224322 Energy: 0.9903321901277857 Energy: 1.000520657460323 Energy: 1.1348466512969597 Energy: 0.9671823718903302 Energy: 0.9903321901273862 Energy: 1.0005206574595233 Energy: 1.1348466512973592 Energy: 1.0075637411679574 Energy: 1.02863126158147 Energy: 1.1095080881720607 Energy: 1.043248380414253 Energy: 1.0075637411679574 Energy: 1.0286312615810702 Energy: 1.1095080881728603 minimum gb energy = 0.9409524113621842 eV minimum distance = 2.28941182048708 Angstroms sigma value = 39 ======================================== theta = 38.21321070173819 ======================================== Energy: 0.9075025042268231 Energy: 0.9478015189513713 Energy: 1.1047655820952624 Energy: 0.9476840897630113 Energy: 0.9075025042263513 Energy: 0.9478015189508997 Energy: 1.1047655820947908 Energy: 0.9649152650919881 Energy: 0.9679149799161673 Energy: 0.9534082100569174 Energy: 0.9862424692608011 Energy: 0.9649152650934032 Energy: 0.9679149799142804 Energy: 0.9534082100573892 Energy: 0.9078733553479429 Energy: 0.8747093735343408 Energy: 1.1146695958290715 Energy: 0.9106412952044486 Energy: 0.9078733553479429 Energy: 0.8747093735343408 Energy: 1.114669595830959 Energy: 0.9133090131280195 Energy: 1.0113655028714474 Energy: 0.9560130296109461 Energy: 1.0497763222229015 Energy: 0.9133090131280195 Energy: 1.0113655028709756 Energy: 0.9560130296142484 Energy: 0.9747568763718534 Energy: 0.9089416843979622 Energy: 1.1249329612429537 Energy: 0.9110232175360196 Energy: 0.9747568763718534 Energy: 0.9089416843960751 Energy: 1.1249329612448407 Energy: 0.911698213378096 Energy: 1.0190530266961386 Energy: 1.0862710674962774 Energy: 1.0632966165394906 Energy: 0.9116982133799401 Energy: 1.019053026695667 Energy: 1.0862710674976925 Energy: 1.0951968980920752 Energy: 1.0083111019250983 Energy: 0.9943203494057895 Energy: 1.003579695284316 Energy: 1.0951968980906597 Energy: 1.0083111019232114 Energy: 0.994320349406733 Energy: 0.8940903728150996 Energy: 0.9714837109256395 Energy: 1.0445691553874819 Energy: 0.9714834069076189 Energy: 0.894090372812741 Energy: 0.9714837109246961 Energy: 1.0445691553874819 Energy: 1.0951754381607208 Energy: 1.0019729565125501 Energy: 1.0340488755263988 Energy: 1.0084280534152479 Energy: 1.095175438158834 Energy: 1.0019729565120783 Energy: 1.0340488755287576 Energy: 0.9121486332904933 Energy: 1.0632796690712547 Energy: 1.0865109763747773 Energy: 1.0188236464198674 Energy: 0.9121486332886064 Energy: 1.063279669068424 Energy: 1.0865109763747773 Energy: 0.9746300155707258 Energy: 0.9111006194991159 Energy: 1.1035932939563886 Energy: 0.9088856160020471 Energy: 0.9746300155683673 Energy: 0.9111006195000593 Energy: 1.1035932939549735 Energy: 0.9132190826646398 Energy: 1.0497911583516557 Energy: 0.9560345605526505 Energy: 1.0109862438579869 Energy: 0.9132190826641681 Energy: 1.0497911583502406 Energy: 0.9560345605521787 Energy: 0.9077436185621864 Energy: 0.910999553530132 Energy: 1.0126512366998184 Energy: 0.8747290315584798 Energy: 0.9077436185621864 Energy: 0.910999553528245 Energy: 1.01265123670029 Energy: 0.9648433208876741 Energy: 0.9861470466225146 Energy: 0.9530997764134413 Energy: 0.9674573987326366 Energy: 0.9648433208876741 Energy: 0.9861470466215712 Energy: 0.9530997764110826 Energy: 0.9075025042268231 Energy: 0.9478015189513713 Energy: 1.1159996148662237 Energy: 0.9476840897630113 Energy: 0.9075025042272948 Energy: 0.9478015189508997 Energy: 1.1159996148648084 Energy: 0.9649152650924598 Energy: 0.9679149799161673 Energy: 0.9534082100569174 Energy: 0.9862424692608011 Energy: 0.9649152650934032 Energy: 0.9679149799147522 Energy: 0.9534082100573892 Energy: 0.9078733553479429 Energy: 0.8747093735343408 Energy: 1.1146695958295434 Energy: 0.9106412952044486 Energy: 0.9078733553479429 Energy: 0.8747093735343408 Energy: 1.1146695958314305 Energy: 0.9133090131280195 Energy: 1.0113655028714474 Energy: 0.9560130296109461 Energy: 1.0497763222229015 Energy: 0.9133090131280195 Energy: 1.011365502870504 Energy: 0.9560130296137767 Energy: 0.9747568763713816 Energy: 0.9089416843979622 Energy: 1.1249329612429537 Energy: 0.9110232175360196 Energy: 0.9747568763723251 Energy: 0.9089416843970186 Energy: 1.1249329612448407 Energy: 0.9116982133789966 Energy: 1.0190530266961386 Energy: 1.086271067496749 Energy: 1.0632966165390187 Energy: 0.9116982133804119 Energy: 1.019053026695667 Energy: 1.0862710674976925 Energy: 1.0951968980920752 Energy: 1.0083111019246267 Energy: 0.9943203494057895 Energy: 1.003579695284316 Energy: 1.0951968980906597 Energy: 1.0083111019236832 Energy: 0.9943203494072046 Energy: 0.8940903728141562 Energy: 0.9714837109256395 Energy: 1.0445691553870102 Energy: 0.9714834069076189 Energy: 0.8940903728132126 Energy: 0.9714837109251678 Energy: 1.0445691553874819 Energy: 1.0951754381607208 Energy: 1.0019729565125501 Energy: 1.0340488755263988 Energy: 1.0084280534161911 Energy: 1.095175438158362 Energy: 1.0019729565125501 Energy: 1.0340488755282855 Energy: 0.9121486332895499 Energy: 1.0632796690717263 Energy: 1.0865109763757206 Energy: 1.0188236464198674 Energy: 0.912148633289078 Energy: 1.063279669068424 Energy: 1.0865109763766643 Energy: 0.9746300155693106 Energy: 0.9111006194991159 Energy: 1.103593293957332 Energy: 0.9088856160020471 Energy: 0.9746300155697823 Energy: 0.9111006195000593 Energy: 1.1618568325900618 Energy: 0.9132190826646398 Energy: 1.049791158351184 Energy: 0.9560345605526505 Energy: 1.0109862438579869 Energy: 0.9132190826641681 Energy: 1.0497911583502406 Energy: 0.9560345605526505 Energy: 0.9077436185621864 Energy: 0.910999553530132 Energy: 1.0126512366984033 Energy: 0.8747290315584798 Energy: 0.9077436185626583 Energy: 0.910999553528245 Energy: 1.01265123670029 Energy: 0.9648433208876741 Energy: 0.9861470466225146 Energy: 0.9530997764129695 Energy: 0.9674573987340519 Energy: 0.9648433208876741 Energy: 0.9861470466220429 Energy: 0.9530997764110826 Energy: 0.9075025042272948 Energy: 0.9478015189513713 Energy: 1.115999614865752 Energy: 0.9476840897634831 Energy: 0.9075025042272948 Energy: 0.9478015189513713 Energy: 1.1277042513975966 Energy: 0.9649152650919881 Energy: 0.9679149799156955 Energy: 0.9534082100569174 Energy: 0.9862424692612728 Energy: 0.9649152650929315 Energy: 0.9679149799147522 Energy: 0.9534082100573892 minimum gb energy = 0.8747093735343408 eV minimum distance = 2.32316447855165 Angstroms sigma value = 21 ======================================== theta = 46.82644889274107 ======================================== Energy: 0.9572305015979045 Energy: 1.0805310025574 Energy: 1.1638660651811163 Energy: 1.0799386751556181 Energy: 0.9572305015979045 Energy: 1.0805310025579726 Energy: 1.1638660651805437 Energy: 0.999471422346477 Energy: 0.8999038880926239 Energy: 1.0311845525135028 Energy: 0.8993480516442078 Energy: 0.999471422346477 Energy: 0.8999038880920512 Energy: 1.0311845525135028 Energy: 0.9566248159661213 Energy: 0.9847936091190432 Energy: 1.0259091247843697 Energy: 0.8767330349188818 Energy: 0.9566248159661213 Energy: 0.9847936091190432 Energy: 1.0259091247843697 Energy: 1.0551904998841397 Energy: 1.0723794087326453 Energy: 1.0881483477796623 Energy: 0.916626459565707 Energy: 1.0551904998852852 Energy: 1.0723794087326453 Energy: 1.0881483477790896 Energy: 0.9088921143653409 Energy: 1.0306080929512735 Energy: 0.9288822486246011 Energy: 0.9275516183657762 Energy: 0.9088921143659136 Energy: 1.0306080929512735 Energy: 0.9288822486257465 Energy: 1.055486127471055 Energy: 0.9239668009407664 Energy: 1.054828472590536 Energy: 0.9289657474826678 Energy: 1.0554861274716278 Energy: 0.9239668009424844 Energy: 1.054828472589963 Energy: 0.98915988522231 Energy: 1.0624101342805292 Energy: 0.9703504707512113 Energy: 0.9290107905701694 Energy: 0.9891598852211646 Energy: 1.0624101342799568 Energy: 0.9703504707506387 Energy: 0.9366070502509682 Energy: 0.9637882438954268 Energy: 1.054155189620003 Energy: 0.9253787045555185 Energy: 0.9366070502503955 Energy: 0.9637882438965722 Energy: 1.0541551896205756 Energy: 0.9889629918790118 Energy: 0.9247183421241865 Energy: 0.9558213084224318 Energy: 1.0428244100880872 Energy: 0.9889629918790118 Energy: 0.9247183421236138 Energy: 0.9558213084230045 Energy: 0.9638790796300997 Energy: 0.9260786764278202 Energy: 1.0851458300570425 Energy: 0.9755151631130201 Energy: 0.9638790796300997 Energy: 0.9260786764295381 Energy: 1.085145830058188 Energy: 1.0091272893720078 Energy: 1.0382609639156142 Energy: 0.9341009590060765 Energy: 0.8999104540351216 Energy: 1.0091272893720078 Energy: 1.038260963916187 Energy: 0.9341009590055039 Energy: 0.8576791520680025 Energy: 1.0600684534790372 Energy: 0.9293558203665386 Energy: 0.9579413269929773 Energy: 0.8576791520680025 Energy: 1.0600684534801825 Energy: 0.9293558203659659 Energy: 1.0077936825166958 Energy: 1.0222369239291633 Energy: 1.0852114861859097 Energy: 0.8959290234948255 Energy: 1.007793682517841 Energy: 1.022236923929736 Energy: 1.0852114861859097 Energy: 0.8579615721107539 Energy: 0.9877177813264557 Energy: 1.0132124286393376 Energy: 1.0146079459538964 Energy: 0.8579615721113266 Energy: 0.9877177813264557 Energy: 1.0132124286393376 Energy: 1.0434420131864162 Energy: 0.9601023613583552 Energy: 0.9805990432866564 Energy: 0.890112457951992 Energy: 1.0434420131875615 Energy: 0.960102361358928 Energy: 0.9805990432860836 Energy: 0.8631017913417249 Energy: 1.016425684559928 Energy: 0.9304474449443927 Energy: 0.959435124764251 Energy: 0.8631017913405795 Energy: 1.0164256845593556 Energy: 0.9304474449455381 Energy: 0.9992826864643164 Energy: 0.8723808842023033 Energy: 1.0371694485805345 Energy: 0.8900422141545251 Energy: 0.9992826864643164 Energy: 0.8723808842017305 Energy: 1.037169448579962 Energy: 0.8629508645965506 Energy: 0.9282811930328989 Energy: 0.9211089886919555 Energy: 0.9999971315725245 Energy: 0.8629508645971232 Energy: 0.9282811930317536 Energy: 0.9211089886919555 Energy: 0.9567823608194778 Energy: 0.9393350110496561 Energy: 1.0793163176680267 Energy: 0.9192173275782963 Energy: 0.9567823608194778 Energy: 0.9393350110496561 Energy: 1.0793163176691722 Energy: 0.8634990237063724 Energy: 0.9612485739542582 Energy: 0.9882123741753414 Energy: 0.9805662679569035 Energy: 0.8634990237063724 Energy: 0.9612485739542582 Energy: 0.9882123741753414 Energy: 0.9567923658136013 Energy: 0.91929624452926 Energy: 1.0791346717094294 Energy: 0.9394170261843314 Energy: 0.9567923658136013 Energy: 0.9192962445286873 Energy: 1.0791346717077113 Energy: 0.8628834073555189 Energy: 0.9997181049385107 Energy: 0.920925530573915 Energy: 0.9283413915351806 Energy: 0.862883407357237 Energy: 0.9997181049367926 Energy: 0.9209255305750603 Energy: 0.9993306204155695 Energy: 0.890946447828535 Energy: 1.1355051605579967 Energy: 0.8725448881440563 Energy: 0.9993306204161423 Energy: 0.8909464478279885 Energy: 1.135505160557424 Energy: 0.8632390160478309 Energy: 0.9591409919016447 Energy: 0.9302622255063193 Energy: 1.016187943414954 Energy: 0.8632390160472583 Energy: 0.9591409919016447 Energy: 0.9302622255057467 Energy: 1.043268844264325 Energy: 0.8903821016426626 Energy: 1.1864338794925755 Energy: 0.9602555394879043 Energy: 1.0432688442648974 Energy: 0.8903821016432352 Energy: 1.1864338794920029 minimum gb energy = 0.8576791520680025 eV minimum distance = 2.30580612568899 Angstroms sigma value = 113 ======================================== theta = 52.659006983369785 ======================================== Energy: 1.043318033104719 Energy: 1.0574438247352198 Energy: 1.1012349487966717 Energy: 1.0490402038688917 Energy: 1.0433180330983265 Energy: 1.0574438247352198 Energy: 1.1012349487934758 Energy: 1.0761796223739795 Energy: 1.0533015339970937 Energy: 1.040235065169914 Energy: 1.0404014555458123 Energy: 1.0761796223739795 Energy: 1.0533015339970937 Energy: 1.040235065169914 Energy: 1.0461670529704301 Energy: 1.0115621790208287 Energy: 1.051727932324856 Energy: 0.9970113424361071 Energy: 1.0461670529704301 Energy: 1.0115621790208287 Energy: 1.051727932328052 Energy: 0.9128160597928041 Energy: 1.0852084201358283 Energy: 1.1427358620085029 Energy: 1.087233746739478 Energy: 0.9128160597991963 Energy: 1.0852084201358283 Energy: 1.142735862005307 Energy: 1.0407946598573055 Energy: 1.0050715934565542 Energy: 0.9665637094374115 Energy: 0.9331376789749241 Energy: 1.0407946598605016 Energy: 1.0050715934597503 Energy: 0.9665637094374115 Energy: 0.9361341521631084 Energy: 0.9837987192658325 Energy: 1.0673074108325782 Energy: 0.9920322337673056 Energy: 0.9361341521663045 Energy: 0.9837987192626365 Energy: 1.067307410829382 Energy: 1.0056436069526744 Energy: 1.0080343671261578 Energy: 1.0050569345222444 Energy: 1.0106992685810097 Energy: 1.0056436069526744 Energy: 1.0080343671229617 Energy: 1.0050569345254405 Energy: 0.9333453596963961 Energy: 1.0002059050132783 Energy: 1.0509089430323366 Energy: 0.9872103737379233 Energy: 0.9333453596995923 Energy: 1.0002059050100822 Energy: 1.0509089430323366 Energy: 1.0054835419290749 Energy: 1.006764792735576 Energy: 1.0556964554300203 Energy: 0.9851480742449629 Energy: 1.005483541932271 Energy: 1.006764792735576 Energy: 1.0556964554300203 Energy: 0.9703339601013614 Energy: 0.9977016629781678 Energy: 1.0815341145380812 Energy: 1.025649131014866 Energy: 0.9703339601077536 Energy: 0.9977016629813639 Energy: 1.0815341145380812 Energy: 0.9764833550057571 Energy: 1.0402869054391464 Energy: 1.1102349034608507 Energy: 1.0026660584665792 Energy: 0.9764833550089531 Energy: 1.0402869054391464 Energy: 1.1102349034640469 Energy: 1.0017294763083886 Energy: 0.9760191632946331 Energy: 1.1918473995575247 Energy: 1.0430523964474236 Energy: 1.0017294763051925 Energy: 0.9760191632946331 Energy: 1.1918473995607208 Energy: 1.0000532762299439 Energy: 1.0444643327095782 Energy: 1.1167761331550552 Energy: 1.0249772390357599 Energy: 1.00005327623314 Energy: 1.0444643327127745 Energy: 1.1167761331550552 Energy: 1.0235082251416663 Energy: 1.0733194260606156 Energy: 1.1909605254741387 Energy: 1.0717561548658285 Energy: 1.0235082251416663 Energy: 1.0733194260638117 Energy: 1.1909605254741387 Energy: 1.0007761509969764 Energy: 1.059030584696513 Energy: 1.1984513374847081 Energy: 1.0500688252301764 Energy: 1.0007761509969764 Energy: 1.059030584696513 Energy: 1.1984513374847081 Energy: 1.023406759520598 Energy: 0.9727955700164574 Energy: 1.1579464910961434 Energy: 1.0684503568321824 Energy: 1.023406759520598 Energy: 0.9727955700132613 Energy: 1.1579464910961434 Energy: 1.00889847866735 Energy: 1.0263719148912036 Energy: 1.1670343906427358 Energy: 1.0124447471022233 Energy: 1.0088984786737423 Energy: 1.0263719148912036 Energy: 1.1670343906395397 Energy: 0.9433305627828076 Energy: 0.9715477842895406 Energy: 1.1505827726366389 Energy: 1.0337762492134503 Energy: 0.9433305627828076 Energy: 0.9715477842959328 Energy: 1.1505827726366389 Energy: 1.0095273799059739 Energy: 1.050376877887572 Energy: 1.1114883627996957 Energy: 0.993945416305756 Energy: 1.0095273799059739 Energy: 1.050376877887572 Energy: 1.1114883627964998 Energy: 0.9496323110421723 Energy: 0.9962350701508133 Energy: 1.1097077171363678 Energy: 1.0222504157037238 Energy: 0.9496323110357802 Energy: 0.9962350701508133 Energy: 1.1097077171299756 Energy: 0.9725640322242771 Energy: 1.0129816637008309 Energy: 1.1134420335021105 Energy: 1.0865284614371564 Energy: 0.9725640322210809 Energy: 1.0129816636976348 Energy: 1.1134420335053068 Energy: 0.9585131715986797 Energy: 1.0306539323147326 Energy: 1.0924234927129268 Energy: 0.9536000458134898 Energy: 0.9585131715986797 Energy: 1.0306539323115365 Energy: 1.0924234927129268 Energy: 0.9761929283923706 Energy: 0.9915634877720226 Energy: 1.092747281398984 Energy: 1.0555944101743737 Energy: 0.9761929283891746 Energy: 0.9915634877720226 Energy: 1.092747281398984 Energy: 1.0080861456443446 Energy: 0.9869707379892463 Energy: 1.083255305682239 Energy: 0.925216830653839 Energy: 1.0080861456475407 Energy: 0.9869707379892463 Energy: 1.0832553056854348 Energy: 0.983363844657304 Energy: 1.042764317020089 Energy: 1.0896273642909267 Energy: 1.1180496223085585 Energy: 0.983363844657304 Energy: 1.042764317020089 Energy: 1.0896273642941228 Energy: 0.9962563427129297 Energy: 1.0083855152081584 Energy: 1.094637956885425 Energy: 1.026494059685316 Energy: 0.9962563427129297 Energy: 1.0083855151985703 Energy: 1.094637956885425 Energy: 1.0973594145131493 Energy: 1.0041444812640004 Energy: 1.0614298195928706 Energy: 1.0866798963883253 Energy: 1.0973594145099532 Energy: 1.004144481254412 Energy: 1.0614298195928706 Energy: 0.9403362349793991 Energy: 1.0848553697140495 Energy: 1.1161063694435016 Energy: 1.0596680529057227 Energy: 0.9403362349793991 Energy: 1.0848553697140495 Energy: 1.1161063694403057 Energy: 1.038116116128312 Energy: 1.0077698475922356 Energy: 1.0440373159913945 Energy: 1.0866479214357818 Energy: 1.038116116131508 Energy: 1.0077698475922356 Energy: 1.0440373159913945 Energy: 0.944077706095446 Energy: 1.027430442490695 Energy: 1.0702010924550194 Energy: 1.034309883951607 Energy: 0.944077706095446 Energy: 1.027430442487499 Energy: 1.0702010924550194 Energy: 0.985402019782364 Energy: 1.0055721332601226 Energy: 1.0795175421964693 Energy: 1.0740318392048933 Energy: 0.985402019782364 Energy: 1.005572133263319 Energy: 1.079517542193273 Energy: 0.990252456565483 Energy: 0.9691153013811344 Energy: 1.0235035961901664 Energy: 0.9870909959442625 Energy: 0.990252456568679 Energy: 0.9691153013779384 Energy: 1.0235035961901664 Energy: 0.988306259393914 Energy: 0.9434001992768435 Energy: 1.1700642665996717 Energy: 1.01701877387238 Energy: 0.9883062593971101 Energy: 0.9434001992768435 Energy: 1.1700642665996717 Energy: 0.9406701258998016 Energy: 0.9753334572729304 Energy: 1.0053067214429903 Energy: 0.9819314041711686 Energy: 0.9406701258998016 Energy: 0.9753334572729304 Energy: 1.0053067214397944 Energy: 0.9408814000070053 Energy: 0.9123931154968495 Energy: 1.0676350393088405 Energy: 1.0538556424178778 Energy: 0.9408814000102013 Energy: 0.9123931155000455 Energy: 1.0676350393056444 Energy: 0.9407137991871705 Energy: 0.9928492070222713 Energy: 0.9923081338407318 Energy: 0.9527517460768327 Energy: 0.9407137991871705 Energy: 0.9928492070222713 Energy: 0.9923081338375356 Energy: 0.9571705837396149 Energy: 0.933233163854617 Energy: 1.0726168230248325 Energy: 1.0291334572790813 Energy: 0.957170583742811 Energy: 0.933233163854617 Energy: 1.0726168230280289 Energy: 0.9454831293955165 Energy: 0.9195582006789439 Energy: 1.03028204644834 Energy: 0.9530208896922324 Energy: 0.9454831293923203 Energy: 0.9195582006789439 Energy: 1.0302820464515363 Energy: 0.9568654087261141 Energy: 0.9796552230937247 Energy: 1.1632230212412802 Energy: 1.062560995449736 Energy: 0.9568654087261141 Energy: 0.9796552230969207 Energy: 1.1632230212476724 Energy: 0.9876529003073479 Energy: 0.9712395265984831 Energy: 1.0547913914402829 Energy: 0.9979804576894574 Energy: 0.9876529003073479 Energy: 0.9712395265952871 Energy: 1.0547913914338904 Energy: 1.0239309747139014 Energy: 0.9864308716493781 Energy: 1.162449863216368 Energy: 1.0604068054358309 Energy: 1.0239309747139014 Energy: 0.9864308716429859 Energy: 1.162449863213172 Energy: 0.9882502197115293 Energy: 1.059342041718504 Energy: 1.1306625218765354 Energy: 1.0236080432242305 Energy: 0.9882502197115293 Energy: 1.0593420417153658 Energy: 1.1306625218733393 Energy: 1.0299854962889863 Energy: 0.9862904969447651 Energy: 1.1617177952136997 Energy: 1.0631480103212696 Energy: 1.0299854962889863 Energy: 0.986290496941569 Energy: 1.1617177952168958 Energy: 1.0097973251343053 Energy: 0.9709656885049847 Energy: 1.1422784336189375 Energy: 0.9888691281332754 Energy: 1.0097973251343053 Energy: 0.9709656885081807 Energy: 1.1422784336221339 Energy: 0.9426119240293774 Energy: 0.9842821988793277 Energy: 1.1444849953650702 Energy: 1.0443229370761693 Energy: 0.9426119240262395 Energy: 0.9842821988761317 Energy: 1.1444849953650702 minimum gb energy = 0.9123931154968495 eV minimum distance = 2.29799227235915 Angstroms sigma value = 365 ======================================== theta = 59.99999999999999 ======================================== Energy: 1.0408548477734236 Energy: 1.0881346665796894 Energy: 1.1782490750537293 Energy: 1.0881346665789688 Energy: 1.0408548477734236 Energy: 1.0881346665775276 Energy: 1.1782490750537293 Energy: 1.0408548477741442 Energy: 1.0881346665782483 Energy: 1.1782490750537293 Energy: 1.0881346665782483 Energy: 1.040854847772703 Energy: 1.0881346665775276 Energy: 1.1782490750537293 Energy: 1.040854847772703 Energy: 1.0881346665775276 Energy: 1.1782490750537293 Energy: 1.0881346665775276 Energy: 1.0408548477741442 Energy: 1.0881346665782483 Energy: 1.1782490750544499 Energy: 1.0408548477734236 Energy: 1.0881346665796894 Energy: 1.1782490750537293 Energy: 1.0881346665789688 Energy: 1.040854847772703 Energy: 1.0881346665782483 Energy: 1.1782490750530086 Energy: 1.0408548477741442 Energy: 1.0881346665782483 Energy: 1.1782490750537293 Energy: 1.0881346665782483 Energy: 1.040854847772703 Energy: 1.0881346665775276 Energy: 1.1782490750537293 Energy: 1.040854847772703 Energy: 1.0881346665775276 Energy: 1.1782490750537293 Energy: 1.0881346665775276 Energy: 1.0408548477741442 Energy: 1.0881346665782483 Energy: 1.1782490750544499 Energy: 1.0408548477734236 Energy: 1.0881346665796894 Energy: 1.1782490750537293 Energy: 1.0881346665789688 Energy: 1.0408548477734236 Energy: 1.0881346665775276 Energy: 1.1782490750530086 Energy: 1.0408548477741442 Energy: 1.0881346665782483 Energy: 1.1782490750537293 Energy: 1.0881346665789688 Energy: 1.040854847772703 Energy: 1.0881346665775276 Energy: 1.1782490750530086 Energy: 1.0408548477719823 Energy: 1.0881346665775276 Energy: 1.1782490750537293 Energy: 1.0881346665775276 Energy: 1.0408548477741442 Energy: 1.0881346665782483 Energy: 1.1782490750544499 Energy: 1.0408548477734236 Energy: 1.0881346665796894 Energy: 1.1782490750537293 Energy: 1.0881346665789688 Energy: 1.0408548477734236 Energy: 1.0881346665782483 Energy: 1.1782490750537293 Energy: 1.0408548477741442 Energy: 1.0881346665789688 Energy: 1.1782490750537293 Energy: 1.0881346665782483 Energy: 1.040854847772703 Energy: 1.0881346665775276 Energy: 1.1782490750537293 Energy: 1.040854847772703 Energy: 1.0881346665775276 Energy: 1.1782490750537293 Energy: 1.0881346665775276 Energy: 1.0408548477741442 Energy: 1.0881346665782483 Energy: 1.1782490750544499 Energy: 1.040854847772703 Energy: 1.0881346665796894 Energy: 1.1782490750537293 Energy: 1.0881346665789688 Energy: 1.0408548477734236 Energy: 1.0881346665782483 Energy: 1.1782490750530086 Energy: 1.0408548477741442 Energy: 1.0881346665782483 Energy: 1.1782490750537293 Energy: 1.0881346665782483 Energy: 1.040854847772703 Energy: 1.088134666576807 Energy: 1.1782490750537293 Energy: 1.040854847772703 Energy: 1.0881346665775276 Energy: 1.1782490750537293 Energy: 1.0881346665782483 Energy: 1.0408548477741442 Energy: 1.0881346665782483 Energy: 1.1782490750537293 Energy: 1.0408548477734236 Energy: 1.0881346665789688 Energy: 1.1782490750537293 Energy: 1.0881346665789688 Energy: 1.0408548477734236 Energy: 1.0881346665775276 Energy: 1.1782490750530086 Energy: 1.0408548477741442 Energy: 1.0881346665782483 Energy: 1.1782490750537293 Energy: 1.0881346665782483 Energy: 1.040854847772703 Energy: 1.0881346665775276 Energy: 1.1782490750537293 Energy: 1.040854847772703 Energy: 1.0881346665775276 Energy: 1.1782490750537293 Energy: 1.0881346665775276 Energy: 1.0408548477741442 Energy: 1.0881346665782483 Energy: 1.1782490750544499 Energy: 1.0408548477734236 Energy: 1.0881346665789688 Energy: 1.1782490750544499 Energy: 1.0881346665789688 Energy: 1.040854847772703 Energy: 1.0881346665782483 Energy: 1.1782490750530086 Energy: 1.0408548477741442 Energy: 1.0881346665782483 Energy: 1.1782490750537293 Energy: 1.0881346665782483 Energy: 1.040854847772703 Energy: 1.088134666576807 Energy: 1.1782490750537293 minimum gb energy = 1.0408548477719823 eV minimum distance = 2.39174660718935 Angstroms sigma value = 23